diff --git a/sphinxman/master/_modules/index.html b/sphinxman/master/_modules/index.html
index 42091917055..abce66c4647 100644
--- a/sphinxman/master/_modules/index.html
+++ b/sphinxman/master/_modules/index.html
@@ -46,7 +46,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script src="../_static/tabs.js?v=3030b3cb"></script>
@@ -92,7 +92,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/index.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -210,7 +210,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/index.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -223,7 +223,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/_modules/psi4/driver/aliases.html b/sphinxman/master/_modules/psi4/driver/aliases.html
index 9ea73c5683b..30a2c100ab0 100644
--- a/sphinxman/master/_modules/psi4/driver/aliases.html
+++ b/sphinxman/master/_modules/psi4/driver/aliases.html
@@ -46,7 +46,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../../../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../../../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../../../_static/doctools.js?v=9a2dae69"></script>
     <script src="../../../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script src="../../../_static/tabs.js?v=3030b3cb"></script>
@@ -92,7 +92,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/aliases.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -385,7 +385,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/aliases.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -399,7 +399,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/_modules/psi4/driver/diatomic.html b/sphinxman/master/_modules/psi4/driver/diatomic.html
index 94e938f0512..137512f2934 100644
--- a/sphinxman/master/_modules/psi4/driver/diatomic.html
+++ b/sphinxman/master/_modules/psi4/driver/diatomic.html
@@ -46,7 +46,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../../../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../../../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../../../_static/doctools.js?v=9a2dae69"></script>
     <script src="../../../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script src="../../../_static/tabs.js?v=3030b3cb"></script>
@@ -92,7 +92,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/diatomic.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -461,7 +461,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/diatomic.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -475,7 +475,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/_modules/psi4/driver/driver.html b/sphinxman/master/_modules/psi4/driver/driver.html
index 070170bfeb6..c1fa7604bb9 100644
--- a/sphinxman/master/_modules/psi4/driver/driver.html
+++ b/sphinxman/master/_modules/psi4/driver/driver.html
@@ -46,7 +46,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../../../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../../../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../../../_static/doctools.js?v=9a2dae69"></script>
     <script src="../../../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script src="../../../_static/tabs.js?v=3030b3cb"></script>
@@ -92,7 +92,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/driver.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -2314,7 +2314,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/driver.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -2328,7 +2328,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/_modules/psi4/driver/driver_cbs.html b/sphinxman/master/_modules/psi4/driver/driver_cbs.html
index 8887a7b5220..9d017a4a9a9 100644
--- a/sphinxman/master/_modules/psi4/driver/driver_cbs.html
+++ b/sphinxman/master/_modules/psi4/driver/driver_cbs.html
@@ -46,7 +46,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../../../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../../../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../../../_static/doctools.js?v=9a2dae69"></script>
     <script src="../../../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script src="../../../_static/tabs.js?v=3030b3cb"></script>
@@ -92,7 +92,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/driver_cbs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -2012,7 +2012,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/driver_cbs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -2026,7 +2026,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/_modules/psi4/driver/driver_cbs_helper.html b/sphinxman/master/_modules/psi4/driver/driver_cbs_helper.html
index 522e48e0f7c..a7665066d9d 100644
--- a/sphinxman/master/_modules/psi4/driver/driver_cbs_helper.html
+++ b/sphinxman/master/_modules/psi4/driver/driver_cbs_helper.html
@@ -46,7 +46,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../../../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../../../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../../../_static/doctools.js?v=9a2dae69"></script>
     <script src="../../../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script src="../../../_static/tabs.js?v=3030b3cb"></script>
@@ -92,7 +92,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/driver_cbs_helper.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -893,7 +893,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/driver_cbs_helper.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -907,7 +907,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/_modules/psi4/driver/driver_findif.html b/sphinxman/master/_modules/psi4/driver/driver_findif.html
index 269708d4154..a879f6c773a 100644
--- a/sphinxman/master/_modules/psi4/driver/driver_findif.html
+++ b/sphinxman/master/_modules/psi4/driver/driver_findif.html
@@ -46,7 +46,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../../../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../../../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../../../_static/doctools.js?v=9a2dae69"></script>
     <script src="../../../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script src="../../../_static/tabs.js?v=3030b3cb"></script>
@@ -92,7 +92,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/driver_findif.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1747,7 +1747,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/driver_findif.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1761,7 +1761,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/_modules/psi4/driver/driver_nbody.html b/sphinxman/master/_modules/psi4/driver/driver_nbody.html
index 7a8a1302dab..f82be0322d1 100644
--- a/sphinxman/master/_modules/psi4/driver/driver_nbody.html
+++ b/sphinxman/master/_modules/psi4/driver/driver_nbody.html
@@ -46,7 +46,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../../../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../../../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../../../_static/doctools.js?v=9a2dae69"></script>
     <script src="../../../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script src="../../../_static/tabs.js?v=3030b3cb"></script>
@@ -92,7 +92,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/driver_nbody.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1725,7 +1725,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/driver_nbody.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1739,7 +1739,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/_modules/psi4/driver/frac.html b/sphinxman/master/_modules/psi4/driver/frac.html
index 513a8a9a665..d62457156c6 100644
--- a/sphinxman/master/_modules/psi4/driver/frac.html
+++ b/sphinxman/master/_modules/psi4/driver/frac.html
@@ -46,7 +46,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../../../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../../../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../../../_static/doctools.js?v=9a2dae69"></script>
     <script src="../../../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script src="../../../_static/tabs.js?v=3030b3cb"></script>
@@ -92,7 +92,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/frac.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -978,7 +978,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/frac.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -992,7 +992,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/_modules/psi4/driver/inputparser.html b/sphinxman/master/_modules/psi4/driver/inputparser.html
index 4e4ef94da6d..512f13c921e 100644
--- a/sphinxman/master/_modules/psi4/driver/inputparser.html
+++ b/sphinxman/master/_modules/psi4/driver/inputparser.html
@@ -46,7 +46,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../../../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../../../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../../../_static/doctools.js?v=9a2dae69"></script>
     <script src="../../../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script src="../../../_static/tabs.js?v=3030b3cb"></script>
@@ -92,7 +92,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/inputparser.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -951,7 +951,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/inputparser.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -965,7 +965,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/_modules/psi4/driver/ipi_broker.html b/sphinxman/master/_modules/psi4/driver/ipi_broker.html
index 94ce657f55b..6f97366024e 100644
--- a/sphinxman/master/_modules/psi4/driver/ipi_broker.html
+++ b/sphinxman/master/_modules/psi4/driver/ipi_broker.html
@@ -46,7 +46,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../../../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../../../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../../../_static/doctools.js?v=9a2dae69"></script>
     <script src="../../../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script src="../../../_static/tabs.js?v=3030b3cb"></script>
@@ -92,7 +92,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/ipi_broker.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -346,7 +346,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/ipi_broker.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -360,7 +360,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/_modules/psi4/driver/mdi_engine.html b/sphinxman/master/_modules/psi4/driver/mdi_engine.html
index b64dab142f9..d0e2f5fcb3c 100644
--- a/sphinxman/master/_modules/psi4/driver/mdi_engine.html
+++ b/sphinxman/master/_modules/psi4/driver/mdi_engine.html
@@ -46,7 +46,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../../../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../../../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../../../_static/doctools.js?v=9a2dae69"></script>
     <script src="../../../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script src="../../../_static/tabs.js?v=3030b3cb"></script>
@@ -92,7 +92,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/mdi_engine.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -659,7 +659,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/mdi_engine.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -673,7 +673,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/_modules/psi4/driver/molutil.html b/sphinxman/master/_modules/psi4/driver/molutil.html
index 81c0abe69e9..791caa53878 100644
--- a/sphinxman/master/_modules/psi4/driver/molutil.html
+++ b/sphinxman/master/_modules/psi4/driver/molutil.html
@@ -46,7 +46,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../../../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../../../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../../../_static/doctools.js?v=9a2dae69"></script>
     <script src="../../../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script src="../../../_static/tabs.js?v=3030b3cb"></script>
@@ -92,7 +92,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/molutil.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -491,7 +491,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/molutil.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -505,7 +505,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/_modules/psi4/driver/p4util/exceptions.html b/sphinxman/master/_modules/psi4/driver/p4util/exceptions.html
index c3a08bd6efb..afa54d2de24 100644
--- a/sphinxman/master/_modules/psi4/driver/p4util/exceptions.html
+++ b/sphinxman/master/_modules/psi4/driver/p4util/exceptions.html
@@ -46,7 +46,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../../../../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../../../../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../../../../_static/doctools.js?v=9a2dae69"></script>
     <script src="../../../../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script src="../../../../_static/tabs.js?v=3030b3cb"></script>
@@ -92,7 +92,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/p4util/exceptions.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -745,7 +745,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/p4util/exceptions.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -759,7 +759,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/_modules/psi4/driver/p4util/fchk.html b/sphinxman/master/_modules/psi4/driver/p4util/fchk.html
index e317bcfcc90..665ad08fd4d 100644
--- a/sphinxman/master/_modules/psi4/driver/p4util/fchk.html
+++ b/sphinxman/master/_modules/psi4/driver/p4util/fchk.html
@@ -46,7 +46,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../../../../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../../../../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../../../../_static/doctools.js?v=9a2dae69"></script>
     <script src="../../../../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script src="../../../../_static/tabs.js?v=3030b3cb"></script>
@@ -92,7 +92,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/p4util/fchk.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -430,7 +430,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/p4util/fchk.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -444,7 +444,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/_modules/psi4/driver/p4util/fcidump.html b/sphinxman/master/_modules/psi4/driver/p4util/fcidump.html
index adbefe13734..e5ad5025fce 100644
--- a/sphinxman/master/_modules/psi4/driver/p4util/fcidump.html
+++ b/sphinxman/master/_modules/psi4/driver/p4util/fcidump.html
@@ -46,7 +46,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../../../../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../../../../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../../../../_static/doctools.js?v=9a2dae69"></script>
     <script src="../../../../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script src="../../../../_static/tabs.js?v=3030b3cb"></script>
@@ -92,7 +92,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/p4util/fcidump.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -632,7 +632,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/p4util/fcidump.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -646,7 +646,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/_modules/psi4/driver/p4util/inpsight.html b/sphinxman/master/_modules/psi4/driver/p4util/inpsight.html
index 7c1c92ec7f5..26cf6f7925b 100644
--- a/sphinxman/master/_modules/psi4/driver/p4util/inpsight.html
+++ b/sphinxman/master/_modules/psi4/driver/p4util/inpsight.html
@@ -46,7 +46,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../../../../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../../../../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../../../../_static/doctools.js?v=9a2dae69"></script>
     <script src="../../../../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script src="../../../../_static/tabs.js?v=3030b3cb"></script>
@@ -92,7 +92,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/p4util/inpsight.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -858,7 +858,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/p4util/inpsight.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -872,7 +872,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/_modules/psi4/driver/p4util/numpy_helper.html b/sphinxman/master/_modules/psi4/driver/p4util/numpy_helper.html
index 2faefacdbc2..acc0d567f04 100644
--- a/sphinxman/master/_modules/psi4/driver/p4util/numpy_helper.html
+++ b/sphinxman/master/_modules/psi4/driver/p4util/numpy_helper.html
@@ -46,7 +46,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../../../../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../../../../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../../../../_static/doctools.js?v=9a2dae69"></script>
     <script src="../../../../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script src="../../../../_static/tabs.js?v=3030b3cb"></script>
@@ -92,7 +92,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/p4util/numpy_helper.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -907,7 +907,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/p4util/numpy_helper.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -921,7 +921,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/_modules/psi4/driver/p4util/optproc.html b/sphinxman/master/_modules/psi4/driver/p4util/optproc.html
index 3d907024b83..158876a35e3 100644
--- a/sphinxman/master/_modules/psi4/driver/p4util/optproc.html
+++ b/sphinxman/master/_modules/psi4/driver/p4util/optproc.html
@@ -46,7 +46,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../../../../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../../../../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../../../../_static/doctools.js?v=9a2dae69"></script>
     <script src="../../../../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script src="../../../../_static/tabs.js?v=3030b3cb"></script>
@@ -92,7 +92,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/p4util/optproc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -379,7 +379,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/p4util/optproc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -393,7 +393,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/_modules/psi4/driver/p4util/procutil.html b/sphinxman/master/_modules/psi4/driver/p4util/procutil.html
index 283bdb586df..520f5b8f1f5 100644
--- a/sphinxman/master/_modules/psi4/driver/p4util/procutil.html
+++ b/sphinxman/master/_modules/psi4/driver/p4util/procutil.html
@@ -46,7 +46,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../../../../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../../../../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../../../../_static/doctools.js?v=9a2dae69"></script>
     <script src="../../../../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script src="../../../../_static/tabs.js?v=3030b3cb"></script>
@@ -92,7 +92,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/p4util/procutil.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -945,7 +945,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/p4util/procutil.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -959,7 +959,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/_modules/psi4/driver/p4util/prop_util.html b/sphinxman/master/_modules/psi4/driver/p4util/prop_util.html
index c2a08a35969..09e085b7136 100644
--- a/sphinxman/master/_modules/psi4/driver/p4util/prop_util.html
+++ b/sphinxman/master/_modules/psi4/driver/p4util/prop_util.html
@@ -46,7 +46,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../../../../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../../../../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../../../../_static/doctools.js?v=9a2dae69"></script>
     <script src="../../../../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script src="../../../../_static/tabs.js?v=3030b3cb"></script>
@@ -92,7 +92,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/p4util/prop_util.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -311,7 +311,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/p4util/prop_util.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -325,7 +325,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/_modules/psi4/driver/p4util/python_helpers.html b/sphinxman/master/_modules/psi4/driver/p4util/python_helpers.html
index 60f9ae3ad1f..116b526df29 100644
--- a/sphinxman/master/_modules/psi4/driver/p4util/python_helpers.html
+++ b/sphinxman/master/_modules/psi4/driver/p4util/python_helpers.html
@@ -46,7 +46,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../../../../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../../../../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../../../../_static/doctools.js?v=9a2dae69"></script>
     <script src="../../../../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script src="../../../../_static/tabs.js?v=3030b3cb"></script>
@@ -92,7 +92,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/p4util/python_helpers.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1716,7 +1716,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/p4util/python_helpers.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1730,7 +1730,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/_modules/psi4/driver/p4util/solvers.html b/sphinxman/master/_modules/psi4/driver/p4util/solvers.html
index e70c1f35b3b..215cc08300d 100644
--- a/sphinxman/master/_modules/psi4/driver/p4util/solvers.html
+++ b/sphinxman/master/_modules/psi4/driver/p4util/solvers.html
@@ -46,7 +46,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../../../../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../../../../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../../../../_static/doctools.js?v=9a2dae69"></script>
     <script src="../../../../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script src="../../../../_static/tabs.js?v=3030b3cb"></script>
@@ -92,7 +92,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/p4util/solvers.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1327,7 +1327,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/p4util/solvers.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1341,7 +1341,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/_modules/psi4/driver/p4util/spectrum.html b/sphinxman/master/_modules/psi4/driver/p4util/spectrum.html
index 41ee24aa51b..3ab8b17da7d 100644
--- a/sphinxman/master/_modules/psi4/driver/p4util/spectrum.html
+++ b/sphinxman/master/_modules/psi4/driver/p4util/spectrum.html
@@ -46,7 +46,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../../../../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../../../../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../../../../_static/doctools.js?v=9a2dae69"></script>
     <script src="../../../../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script src="../../../../_static/tabs.js?v=3030b3cb"></script>
@@ -92,7 +92,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/p4util/spectrum.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -608,7 +608,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/p4util/spectrum.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -622,7 +622,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/_modules/psi4/driver/p4util/text.html b/sphinxman/master/_modules/psi4/driver/p4util/text.html
index 59985db4331..fb28e6328ed 100644
--- a/sphinxman/master/_modules/psi4/driver/p4util/text.html
+++ b/sphinxman/master/_modules/psi4/driver/p4util/text.html
@@ -46,7 +46,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../../../../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../../../../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../../../../_static/doctools.js?v=9a2dae69"></script>
     <script src="../../../../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script src="../../../../_static/tabs.js?v=3030b3cb"></script>
@@ -92,7 +92,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/p4util/text.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -353,7 +353,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/p4util/text.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -367,7 +367,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/_modules/psi4/driver/p4util/util.html b/sphinxman/master/_modules/psi4/driver/p4util/util.html
index 6ce13104a16..3694907fe9a 100644
--- a/sphinxman/master/_modules/psi4/driver/p4util/util.html
+++ b/sphinxman/master/_modules/psi4/driver/p4util/util.html
@@ -46,7 +46,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../../../../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../../../../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../../../../_static/doctools.js?v=9a2dae69"></script>
     <script src="../../../../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script src="../../../../_static/tabs.js?v=3030b3cb"></script>
@@ -92,7 +92,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/p4util/util.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -615,7 +615,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/p4util/util.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -629,7 +629,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/_modules/psi4/driver/pluginutil.html b/sphinxman/master/_modules/psi4/driver/pluginutil.html
index ec903ad8643..b5a07518834 100644
--- a/sphinxman/master/_modules/psi4/driver/pluginutil.html
+++ b/sphinxman/master/_modules/psi4/driver/pluginutil.html
@@ -46,7 +46,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../../../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../../../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../../../_static/doctools.js?v=9a2dae69"></script>
     <script src="../../../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script src="../../../_static/tabs.js?v=3030b3cb"></script>
@@ -92,7 +92,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/pluginutil.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -354,7 +354,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/pluginutil.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -368,7 +368,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/_modules/psi4/driver/procrouting/empirical_dispersion.html b/sphinxman/master/_modules/psi4/driver/procrouting/empirical_dispersion.html
index 479e6658d1c..d2bc7b6506c 100644
--- a/sphinxman/master/_modules/psi4/driver/procrouting/empirical_dispersion.html
+++ b/sphinxman/master/_modules/psi4/driver/procrouting/empirical_dispersion.html
@@ -46,7 +46,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../../../../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../../../../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../../../../_static/doctools.js?v=9a2dae69"></script>
     <script src="../../../../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script src="../../../../_static/tabs.js?v=3030b3cb"></script>
@@ -92,7 +92,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/procrouting/empirical_dispersion.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -593,7 +593,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/procrouting/empirical_dispersion.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -607,7 +607,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/_modules/psi4/driver/procrouting/interface_cfour.html b/sphinxman/master/_modules/psi4/driver/procrouting/interface_cfour.html
index f2d5f4d10f4..651084b816c 100644
--- a/sphinxman/master/_modules/psi4/driver/procrouting/interface_cfour.html
+++ b/sphinxman/master/_modules/psi4/driver/procrouting/interface_cfour.html
@@ -46,7 +46,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../../../../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../../../../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../../../../_static/doctools.js?v=9a2dae69"></script>
     <script src="../../../../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script src="../../../../_static/tabs.js?v=3030b3cb"></script>
@@ -92,7 +92,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/procrouting/interface_cfour.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -698,7 +698,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/procrouting/interface_cfour.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -712,7 +712,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/_modules/psi4/driver/procrouting/proc.html b/sphinxman/master/_modules/psi4/driver/procrouting/proc.html
index 88a16f236b2..6e6201ec812 100644
--- a/sphinxman/master/_modules/psi4/driver/procrouting/proc.html
+++ b/sphinxman/master/_modules/psi4/driver/procrouting/proc.html
@@ -46,7 +46,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../../../../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../../../../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../../../../_static/doctools.js?v=9a2dae69"></script>
     <script src="../../../../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script src="../../../../_static/tabs.js?v=3030b3cb"></script>
@@ -92,7 +92,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/procrouting/proc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -5729,7 +5729,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/procrouting/proc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -5743,7 +5743,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/_modules/psi4/driver/qcdb/molecule.html b/sphinxman/master/_modules/psi4/driver/qcdb/molecule.html
index 4241de55eb3..391e4dde5d5 100644
--- a/sphinxman/master/_modules/psi4/driver/qcdb/molecule.html
+++ b/sphinxman/master/_modules/psi4/driver/qcdb/molecule.html
@@ -46,7 +46,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../../../../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../../../../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../../../../_static/doctools.js?v=9a2dae69"></script>
     <script src="../../../../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script src="../../../../_static/tabs.js?v=3030b3cb"></script>
@@ -92,7 +92,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/qcdb/molecule.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -2293,7 +2293,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/qcdb/molecule.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -2307,7 +2307,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/_modules/psi4/driver/qcdb/vib.html b/sphinxman/master/_modules/psi4/driver/qcdb/vib.html
index 406003a6671..b298b938342 100644
--- a/sphinxman/master/_modules/psi4/driver/qcdb/vib.html
+++ b/sphinxman/master/_modules/psi4/driver/qcdb/vib.html
@@ -46,7 +46,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../../../../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../../../../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../../../../_static/doctools.js?v=9a2dae69"></script>
     <script src="../../../../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script src="../../../../_static/tabs.js?v=3030b3cb"></script>
@@ -92,7 +92,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/qcdb/vib.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1440,7 +1440,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/qcdb/vib.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1454,7 +1454,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/_modules/psi4/driver/qmmm.html b/sphinxman/master/_modules/psi4/driver/qmmm.html
index c60a2dddcfc..e9f34c8b913 100644
--- a/sphinxman/master/_modules/psi4/driver/qmmm.html
+++ b/sphinxman/master/_modules/psi4/driver/qmmm.html
@@ -46,7 +46,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../../../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../../../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../../../_static/doctools.js?v=9a2dae69"></script>
     <script src="../../../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script src="../../../_static/tabs.js?v=3030b3cb"></script>
@@ -92,7 +92,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/qmmm.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -376,7 +376,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/qmmm.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -390,7 +390,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/_modules/psi4/driver/task_base.html b/sphinxman/master/_modules/psi4/driver/task_base.html
index 858bd2dec33..1764c2544e6 100644
--- a/sphinxman/master/_modules/psi4/driver/task_base.html
+++ b/sphinxman/master/_modules/psi4/driver/task_base.html
@@ -46,7 +46,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../../../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../../../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../../../_static/doctools.js?v=9a2dae69"></script>
     <script src="../../../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script src="../../../_static/tabs.js?v=3030b3cb"></script>
@@ -92,7 +92,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/task_base.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -464,7 +464,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/task_base.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -478,7 +478,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/_modules/psi4/driver/task_planner.html b/sphinxman/master/_modules/psi4/driver/task_planner.html
index c88370a61ca..77c823c9239 100644
--- a/sphinxman/master/_modules/psi4/driver/task_planner.html
+++ b/sphinxman/master/_modules/psi4/driver/task_planner.html
@@ -46,7 +46,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../../../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../../../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../../../_static/doctools.js?v=9a2dae69"></script>
     <script src="../../../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script src="../../../_static/tabs.js?v=3030b3cb"></script>
@@ -92,7 +92,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/task_planner.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -471,7 +471,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/task_planner.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -485,7 +485,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/_modules/psi4/driver/wrapper_autofrag.html b/sphinxman/master/_modules/psi4/driver/wrapper_autofrag.html
index dbdfc19b846..d25387c26db 100644
--- a/sphinxman/master/_modules/psi4/driver/wrapper_autofrag.html
+++ b/sphinxman/master/_modules/psi4/driver/wrapper_autofrag.html
@@ -46,7 +46,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../../../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../../../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../../../_static/doctools.js?v=9a2dae69"></script>
     <script src="../../../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script src="../../../_static/tabs.js?v=3030b3cb"></script>
@@ -92,7 +92,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/wrapper_autofrag.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -252,7 +252,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/wrapper_autofrag.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -266,7 +266,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/_modules/psi4/driver/wrapper_database.html b/sphinxman/master/_modules/psi4/driver/wrapper_database.html
index 12599742aa2..c06264c4194 100644
--- a/sphinxman/master/_modules/psi4/driver/wrapper_database.html
+++ b/sphinxman/master/_modules/psi4/driver/wrapper_database.html
@@ -46,7 +46,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../../../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../../../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../../../_static/doctools.js?v=9a2dae69"></script>
     <script src="../../../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script src="../../../_static/tabs.js?v=3030b3cb"></script>
@@ -92,7 +92,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/wrapper_database.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -832,7 +832,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/driver/wrapper_database.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -846,7 +846,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/_modules/psi4/extras.html b/sphinxman/master/_modules/psi4/extras.html
index 03972ad8d23..ea32ffdc3b9 100644
--- a/sphinxman/master/_modules/psi4/extras.html
+++ b/sphinxman/master/_modules/psi4/extras.html
@@ -46,7 +46,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../../_static/doctools.js?v=9a2dae69"></script>
     <script src="../../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script src="../../_static/tabs.js?v=3030b3cb"></script>
@@ -92,7 +92,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/extras.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -488,7 +488,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/psi4/extras.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -502,7 +502,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/_modules/qcdb/vib.html b/sphinxman/master/_modules/qcdb/vib.html
index 10e8dbbea86..eecaeac4570 100644
--- a/sphinxman/master/_modules/qcdb/vib.html
+++ b/sphinxman/master/_modules/qcdb/vib.html
@@ -46,7 +46,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../../_static/doctools.js?v=9a2dae69"></script>
     <script src="../../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script src="../../_static/tabs.js?v=3030b3cb"></script>
@@ -92,7 +92,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/qcdb/vib.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1419,7 +1419,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/qcdb/vib.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1433,7 +1433,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/_modules/qcelemental/testing.html b/sphinxman/master/_modules/qcelemental/testing.html
index 073ffd27996..384e2eadc43 100644
--- a/sphinxman/master/_modules/qcelemental/testing.html
+++ b/sphinxman/master/_modules/qcelemental/testing.html
@@ -46,7 +46,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../../_static/doctools.js?v=9a2dae69"></script>
     <script src="../../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script src="../../_static/tabs.js?v=3030b3cb"></script>
@@ -92,7 +92,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/qcelemental/testing.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -776,7 +776,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/_modules/qcelemental/testing.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -790,7 +790,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/_static/documentation_options.js b/sphinxman/master/_static/documentation_options.js
index df9c95b2e48..5614f6d84c6 100644
--- a/sphinxman/master/_static/documentation_options.js
+++ b/sphinxman/master/_static/documentation_options.js
@@ -1,5 +1,5 @@
 const DOCUMENTATION_OPTIONS = {
-    VERSION: '7bfb86a',
+    VERSION: 'dfebe5b',
     LANGUAGE: 'en',
     COLLAPSE_INDEX: false,
     BUILDER: 'html',
diff --git a/sphinxman/master/adc.html b/sphinxman/master/adc.html
index 6f4f1d90443..6e16a923787 100644
--- a/sphinxman/master/adc.html
+++ b/sphinxman/master/adc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/adc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -505,7 +505,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/adc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -519,7 +519,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/adcc.html b/sphinxman/master/adcc.html
index 74852448902..bf03001dd80 100644
--- a/sphinxman/master/adcc.html
+++ b/sphinxman/master/adcc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/adcc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -379,7 +379,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/adcc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -393,7 +393,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/add_tests.html b/sphinxman/master/add_tests.html
index 15be610f2c0..f3d5b8e35bf 100644
--- a/sphinxman/master/add_tests.html
+++ b/sphinxman/master/add_tests.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/add_tests.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -879,7 +879,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/add_tests.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -892,7 +892,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.AOShellCombinationsIterator.html b/sphinxman/master/api/psi4.core.AOShellCombinationsIterator.html
index 766a21d7727..b42118988de 100644
--- a/sphinxman/master/api/psi4.core.AOShellCombinationsIterator.html
+++ b/sphinxman/master/api/psi4.core.AOShellCombinationsIterator.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.AOShellCombinationsIterator.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -288,7 +288,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.AOShellCombinationsIterator.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -302,7 +302,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.AngularMomentumInt.html b/sphinxman/master/api/psi4.core.AngularMomentumInt.html
index de23af36936..aeb7fac927c 100644
--- a/sphinxman/master/api/psi4.core.AngularMomentumInt.html
+++ b/sphinxman/master/api/psi4.core.AngularMomentumInt.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.AngularMomentumInt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -205,7 +205,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.AngularMomentumInt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -219,7 +219,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.BSVec.html b/sphinxman/master/api/psi4.core.BSVec.html
index a800ee1b803..c465d8c6dcb 100644
--- a/sphinxman/master/api/psi4.core.BSVec.html
+++ b/sphinxman/master/api/psi4.core.BSVec.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.BSVec.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -298,7 +298,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.BSVec.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -312,7 +312,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.BasisExtents.html b/sphinxman/master/api/psi4.core.BasisExtents.html
index 51110597918..44a1a1305cc 100644
--- a/sphinxman/master/api/psi4.core.BasisExtents.html
+++ b/sphinxman/master/api/psi4.core.BasisExtents.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.BasisExtents.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -263,7 +263,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.BasisExtents.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -277,7 +277,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.BasisFunctions.html b/sphinxman/master/api/psi4.core.BasisFunctions.html
index fd4e545b176..c212dcca467 100644
--- a/sphinxman/master/api/psi4.core.BasisFunctions.html
+++ b/sphinxman/master/api/psi4.core.BasisFunctions.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.BasisFunctions.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -273,7 +273,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.BasisFunctions.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -287,7 +287,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.BasisSet.html b/sphinxman/master/api/psi4.core.BasisSet.html
index 8019097f27d..4b11d2c9688 100644
--- a/sphinxman/master/api/psi4.core.BasisSet.html
+++ b/sphinxman/master/api/psi4.core.BasisSet.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.BasisSet.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -620,7 +620,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.BasisSet.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -634,7 +634,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.BlockOPoints.html b/sphinxman/master/api/psi4.core.BlockOPoints.html
index e74ebdfd30e..6a2069f2e52 100644
--- a/sphinxman/master/api/psi4.core.BlockOPoints.html
+++ b/sphinxman/master/api/psi4.core.BlockOPoints.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.BlockOPoints.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -309,7 +309,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.BlockOPoints.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -323,7 +323,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.BoysLocalizer.html b/sphinxman/master/api/psi4.core.BoysLocalizer.html
index 87524efca56..56640496f3d 100644
--- a/sphinxman/master/api/psi4.core.BoysLocalizer.html
+++ b/sphinxman/master/api/psi4.core.BoysLocalizer.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.BoysLocalizer.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -205,7 +205,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.BoysLocalizer.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -219,7 +219,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.CCWavefunction.html b/sphinxman/master/api/psi4.core.CCWavefunction.html
index 301b6ddf8bf..ef8c2671a4f 100644
--- a/sphinxman/master/api/psi4.core.CCWavefunction.html
+++ b/sphinxman/master/api/psi4.core.CCWavefunction.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.CCWavefunction.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -271,7 +271,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.CCWavefunction.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -285,7 +285,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.CIVector.html b/sphinxman/master/api/psi4.core.CIVector.html
index 1029d9f20c5..6576ac53467 100644
--- a/sphinxman/master/api/psi4.core.CIVector.html
+++ b/sphinxman/master/api/psi4.core.CIVector.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.CIVector.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -389,7 +389,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.CIVector.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -403,7 +403,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.CIWavefunction.html b/sphinxman/master/api/psi4.core.CIWavefunction.html
index 1da16b8c888..ee99a674102 100644
--- a/sphinxman/master/api/psi4.core.CIWavefunction.html
+++ b/sphinxman/master/api/psi4.core.CIWavefunction.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.CIWavefunction.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -566,7 +566,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.CIWavefunction.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -580,7 +580,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.CUHF.html b/sphinxman/master/api/psi4.core.CUHF.html
index 1cc79a91dac..5746e699860 100644
--- a/sphinxman/master/api/psi4.core.CUHF.html
+++ b/sphinxman/master/api/psi4.core.CUHF.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.CUHF.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -264,7 +264,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.CUHF.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -278,7 +278,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.CdSalc.html b/sphinxman/master/api/psi4.core.CdSalc.html
index 9b91ac7225a..340228623a0 100644
--- a/sphinxman/master/api/psi4.core.CdSalc.html
+++ b/sphinxman/master/api/psi4.core.CdSalc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.CdSalc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -243,7 +243,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.CdSalc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -257,7 +257,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.CdSalcList.html b/sphinxman/master/api/psi4.core.CdSalcList.html
index 05adacb9444..aca6bb9be46 100644
--- a/sphinxman/master/api/psi4.core.CdSalcList.html
+++ b/sphinxman/master/api/psi4.core.CdSalcList.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.CdSalcList.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -283,7 +283,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.CdSalcList.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -297,7 +297,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.CharacterTable.html b/sphinxman/master/api/psi4.core.CharacterTable.html
index eeffe9240e8..c23f1fd0970 100644
--- a/sphinxman/master/api/psi4.core.CharacterTable.html
+++ b/sphinxman/master/api/psi4.core.CharacterTable.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.CharacterTable.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -243,7 +243,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.CharacterTable.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -257,7 +257,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.CompositeJK.html b/sphinxman/master/api/psi4.core.CompositeJK.html
index 101c9134bb5..bb3a2cea30b 100644
--- a/sphinxman/master/api/psi4.core.CompositeJK.html
+++ b/sphinxman/master/api/psi4.core.CompositeJK.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.CompositeJK.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -263,7 +263,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.CompositeJK.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -277,7 +277,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.CorrelationFactor.html b/sphinxman/master/api/psi4.core.CorrelationFactor.html
index 72dbe1b3a7b..2af3cc5008f 100644
--- a/sphinxman/master/api/psi4.core.CorrelationFactor.html
+++ b/sphinxman/master/api/psi4.core.CorrelationFactor.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.CorrelationFactor.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -223,7 +223,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.CorrelationFactor.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -237,7 +237,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.CorrelationTable.html b/sphinxman/master/api/psi4.core.CorrelationTable.html
index 6e41db3fd2f..19a5812b92d 100644
--- a/sphinxman/master/api/psi4.core.CorrelationTable.html
+++ b/sphinxman/master/api/psi4.core.CorrelationTable.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.CorrelationTable.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -291,7 +291,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.CorrelationTable.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -305,7 +305,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.CubeProperties.html b/sphinxman/master/api/psi4.core.CubeProperties.html
index e907a48a291..adf84c75e09 100644
--- a/sphinxman/master/api/psi4.core.CubeProperties.html
+++ b/sphinxman/master/api/psi4.core.CubeProperties.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.CubeProperties.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -263,7 +263,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.CubeProperties.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -277,7 +277,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.DASUM.html b/sphinxman/master/api/psi4.core.DASUM.html
index ff7866ea919..449498886ee 100644
--- a/sphinxman/master/api/psi4.core.DASUM.html
+++ b/sphinxman/master/api/psi4.core.DASUM.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DASUM.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DASUM.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.DAXPY.html b/sphinxman/master/api/psi4.core.DAXPY.html
index 9141f045d31..871badc1402 100644
--- a/sphinxman/master/api/psi4.core.DAXPY.html
+++ b/sphinxman/master/api/psi4.core.DAXPY.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DAXPY.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DAXPY.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.DCOPY.html b/sphinxman/master/api/psi4.core.DCOPY.html
index f08d636ef31..32d9ed1a346 100644
--- a/sphinxman/master/api/psi4.core.DCOPY.html
+++ b/sphinxman/master/api/psi4.core.DCOPY.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DCOPY.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DCOPY.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.DDOT.html b/sphinxman/master/api/psi4.core.DDOT.html
index f57b976a20b..5686b2774a3 100644
--- a/sphinxman/master/api/psi4.core.DDOT.html
+++ b/sphinxman/master/api/psi4.core.DDOT.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DDOT.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DDOT.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.DFEP2Wavefunction.html b/sphinxman/master/api/psi4.core.DFEP2Wavefunction.html
index d2e956e237f..38d3c62dbb6 100644
--- a/sphinxman/master/api/psi4.core.DFEP2Wavefunction.html
+++ b/sphinxman/master/api/psi4.core.DFEP2Wavefunction.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DFEP2Wavefunction.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -223,7 +223,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DFEP2Wavefunction.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -237,7 +237,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.DFHelper.html b/sphinxman/master/api/psi4.core.DFHelper.html
index 5988d9a8b5e..8fe0918c1be 100644
--- a/sphinxman/master/api/psi4.core.DFHelper.html
+++ b/sphinxman/master/api/psi4.core.DFHelper.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DFHelper.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -452,7 +452,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DFHelper.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -466,7 +466,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.DFSOMCSCF.html b/sphinxman/master/api/psi4.core.DFSOMCSCF.html
index 6d8b61ef9fb..5a7b9d43110 100644
--- a/sphinxman/master/api/psi4.core.DFSOMCSCF.html
+++ b/sphinxman/master/api/psi4.core.DFSOMCSCF.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DFSOMCSCF.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -205,7 +205,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DFSOMCSCF.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -219,7 +219,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.DFTGrid.html b/sphinxman/master/api/psi4.core.DFTGrid.html
index ad508a1a8e3..a23c42e62b7 100644
--- a/sphinxman/master/api/psi4.core.DFTGrid.html
+++ b/sphinxman/master/api/psi4.core.DFTGrid.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DFTGrid.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -227,7 +227,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DFTGrid.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -241,7 +241,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.DFTensor.html b/sphinxman/master/api/psi4.core.DFTensor.html
index b0662cb69de..2c01181b882 100644
--- a/sphinxman/master/api/psi4.core.DFTensor.html
+++ b/sphinxman/master/api/psi4.core.DFTensor.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DFTensor.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -283,7 +283,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DFTensor.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -297,7 +297,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.DGBMV.html b/sphinxman/master/api/psi4.core.DGBMV.html
index a5f5ce2760f..03cb32effd5 100644
--- a/sphinxman/master/api/psi4.core.DGBMV.html
+++ b/sphinxman/master/api/psi4.core.DGBMV.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DGBMV.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DGBMV.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.DGEEV.html b/sphinxman/master/api/psi4.core.DGEEV.html
index 46d0ffad491..1dae667041f 100644
--- a/sphinxman/master/api/psi4.core.DGEEV.html
+++ b/sphinxman/master/api/psi4.core.DGEEV.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DGEEV.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DGEEV.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.DGEMM.html b/sphinxman/master/api/psi4.core.DGEMM.html
index db8bd024523..c431cd006f6 100644
--- a/sphinxman/master/api/psi4.core.DGEMM.html
+++ b/sphinxman/master/api/psi4.core.DGEMM.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DGEMM.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DGEMM.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.DGEMV.html b/sphinxman/master/api/psi4.core.DGEMV.html
index c7ea01e23d2..5c9f064e029 100644
--- a/sphinxman/master/api/psi4.core.DGEMV.html
+++ b/sphinxman/master/api/psi4.core.DGEMV.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DGEMV.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DGEMV.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.DGER.html b/sphinxman/master/api/psi4.core.DGER.html
index 30c74f0007e..fe140f02934 100644
--- a/sphinxman/master/api/psi4.core.DGER.html
+++ b/sphinxman/master/api/psi4.core.DGER.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DGER.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DGER.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.DGETRF.html b/sphinxman/master/api/psi4.core.DGETRF.html
index 2d7157797b4..a0d8e7a0aec 100644
--- a/sphinxman/master/api/psi4.core.DGETRF.html
+++ b/sphinxman/master/api/psi4.core.DGETRF.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DGETRF.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DGETRF.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.DGETRI.html b/sphinxman/master/api/psi4.core.DGETRI.html
index e3095896f1e..36a2ee8580d 100644
--- a/sphinxman/master/api/psi4.core.DGETRI.html
+++ b/sphinxman/master/api/psi4.core.DGETRI.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DGETRI.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DGETRI.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.DGETRS.html b/sphinxman/master/api/psi4.core.DGETRS.html
index 1d5f15c83fb..f716b2921b1 100644
--- a/sphinxman/master/api/psi4.core.DGETRS.html
+++ b/sphinxman/master/api/psi4.core.DGETRS.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DGETRS.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DGETRS.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.DNRM2.html b/sphinxman/master/api/psi4.core.DNRM2.html
index 6fb3bb47ade..1c4ae9a6b55 100644
--- a/sphinxman/master/api/psi4.core.DNRM2.html
+++ b/sphinxman/master/api/psi4.core.DNRM2.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DNRM2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DNRM2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.DPOTRF.html b/sphinxman/master/api/psi4.core.DPOTRF.html
index c82520abd2a..a52857412e7 100644
--- a/sphinxman/master/api/psi4.core.DPOTRF.html
+++ b/sphinxman/master/api/psi4.core.DPOTRF.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DPOTRF.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DPOTRF.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.DPOTRI.html b/sphinxman/master/api/psi4.core.DPOTRI.html
index 37017b9b77b..255dbe98dcb 100644
--- a/sphinxman/master/api/psi4.core.DPOTRI.html
+++ b/sphinxman/master/api/psi4.core.DPOTRI.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DPOTRI.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DPOTRI.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.DPOTRS.html b/sphinxman/master/api/psi4.core.DPOTRS.html
index d0f4647b059..de24a9eae7f 100644
--- a/sphinxman/master/api/psi4.core.DPOTRS.html
+++ b/sphinxman/master/api/psi4.core.DPOTRS.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DPOTRS.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DPOTRS.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.DROT.html b/sphinxman/master/api/psi4.core.DROT.html
index eae13bd492d..5e95bb196b5 100644
--- a/sphinxman/master/api/psi4.core.DROT.html
+++ b/sphinxman/master/api/psi4.core.DROT.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DROT.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DROT.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.DSBMV.html b/sphinxman/master/api/psi4.core.DSBMV.html
index d8456e1b655..06c8c9df178 100644
--- a/sphinxman/master/api/psi4.core.DSBMV.html
+++ b/sphinxman/master/api/psi4.core.DSBMV.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DSBMV.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DSBMV.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.DSCAL.html b/sphinxman/master/api/psi4.core.DSCAL.html
index 86fe8d9beed..99fad81ac67 100644
--- a/sphinxman/master/api/psi4.core.DSCAL.html
+++ b/sphinxman/master/api/psi4.core.DSCAL.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DSCAL.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DSCAL.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.DSWAP.html b/sphinxman/master/api/psi4.core.DSWAP.html
index 90f26956c33..0212b3cd68f 100644
--- a/sphinxman/master/api/psi4.core.DSWAP.html
+++ b/sphinxman/master/api/psi4.core.DSWAP.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DSWAP.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DSWAP.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.DSYEV.html b/sphinxman/master/api/psi4.core.DSYEV.html
index 19746deeadd..eb6aca3bb4e 100644
--- a/sphinxman/master/api/psi4.core.DSYEV.html
+++ b/sphinxman/master/api/psi4.core.DSYEV.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DSYEV.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DSYEV.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.DSYMM.html b/sphinxman/master/api/psi4.core.DSYMM.html
index 43e865c71f7..cabaa9b6e05 100644
--- a/sphinxman/master/api/psi4.core.DSYMM.html
+++ b/sphinxman/master/api/psi4.core.DSYMM.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DSYMM.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DSYMM.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.DSYMV.html b/sphinxman/master/api/psi4.core.DSYMV.html
index f55d1c62b98..8fd6b251ea4 100644
--- a/sphinxman/master/api/psi4.core.DSYMV.html
+++ b/sphinxman/master/api/psi4.core.DSYMV.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DSYMV.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DSYMV.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.DSYR.html b/sphinxman/master/api/psi4.core.DSYR.html
index 827fbff404e..c98da34d854 100644
--- a/sphinxman/master/api/psi4.core.DSYR.html
+++ b/sphinxman/master/api/psi4.core.DSYR.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DSYR.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DSYR.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.DSYR2.html b/sphinxman/master/api/psi4.core.DSYR2.html
index 1f7634e5e94..26d5f30372e 100644
--- a/sphinxman/master/api/psi4.core.DSYR2.html
+++ b/sphinxman/master/api/psi4.core.DSYR2.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DSYR2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DSYR2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.DSYR2K.html b/sphinxman/master/api/psi4.core.DSYR2K.html
index db0672d6d2d..fc38c4eede4 100644
--- a/sphinxman/master/api/psi4.core.DSYR2K.html
+++ b/sphinxman/master/api/psi4.core.DSYR2K.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DSYR2K.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DSYR2K.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.DSYRK.html b/sphinxman/master/api/psi4.core.DSYRK.html
index 19d1b92f1eb..b7e84aa1e69 100644
--- a/sphinxman/master/api/psi4.core.DSYRK.html
+++ b/sphinxman/master/api/psi4.core.DSYRK.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DSYRK.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DSYRK.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.DSYSV.html b/sphinxman/master/api/psi4.core.DSYSV.html
index 0aa654f1119..7994235d726 100644
--- a/sphinxman/master/api/psi4.core.DSYSV.html
+++ b/sphinxman/master/api/psi4.core.DSYSV.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DSYSV.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DSYSV.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.DTBMV.html b/sphinxman/master/api/psi4.core.DTBMV.html
index 90418390c16..ab2dc2e5f13 100644
--- a/sphinxman/master/api/psi4.core.DTBMV.html
+++ b/sphinxman/master/api/psi4.core.DTBMV.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DTBMV.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DTBMV.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.DTBSV.html b/sphinxman/master/api/psi4.core.DTBSV.html
index 0250098c9ea..29975197345 100644
--- a/sphinxman/master/api/psi4.core.DTBSV.html
+++ b/sphinxman/master/api/psi4.core.DTBSV.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DTBSV.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DTBSV.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.DTRMM.html b/sphinxman/master/api/psi4.core.DTRMM.html
index 0b1fced4598..ad4838bddff 100644
--- a/sphinxman/master/api/psi4.core.DTRMM.html
+++ b/sphinxman/master/api/psi4.core.DTRMM.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DTRMM.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DTRMM.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.DTRMV.html b/sphinxman/master/api/psi4.core.DTRMV.html
index ecb013f38cd..66298414c1e 100644
--- a/sphinxman/master/api/psi4.core.DTRMV.html
+++ b/sphinxman/master/api/psi4.core.DTRMV.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DTRMV.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DTRMV.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.DTRSM.html b/sphinxman/master/api/psi4.core.DTRSM.html
index 2a017f3587a..9a68bda5668 100644
--- a/sphinxman/master/api/psi4.core.DTRSM.html
+++ b/sphinxman/master/api/psi4.core.DTRSM.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DTRSM.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DTRSM.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.DTRSV.html b/sphinxman/master/api/psi4.core.DTRSV.html
index f19391668e6..c016d3cd1eb 100644
--- a/sphinxman/master/api/psi4.core.DTRSV.html
+++ b/sphinxman/master/api/psi4.core.DTRSV.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DTRSV.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DTRSV.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.Deriv.html b/sphinxman/master/api/psi4.core.Deriv.html
index d5a74741843..8cd16e90882 100644
--- a/sphinxman/master/api/psi4.core.Deriv.html
+++ b/sphinxman/master/api/psi4.core.Deriv.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.Deriv.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -263,7 +263,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.Deriv.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -277,7 +277,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.DerivCalcType.html b/sphinxman/master/api/psi4.core.DerivCalcType.html
index fca8e8f663f..6a09889fd56 100644
--- a/sphinxman/master/api/psi4.core.DerivCalcType.html
+++ b/sphinxman/master/api/psi4.core.DerivCalcType.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DerivCalcType.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -251,7 +251,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DerivCalcType.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -265,7 +265,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.DiagonalizeOrder.html b/sphinxman/master/api/psi4.core.DiagonalizeOrder.html
index c0c50ebdd19..8224597500f 100644
--- a/sphinxman/master/api/psi4.core.DiagonalizeOrder.html
+++ b/sphinxman/master/api/psi4.core.DiagonalizeOrder.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DiagonalizeOrder.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -254,7 +254,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DiagonalizeOrder.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -268,7 +268,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.Dimension.html b/sphinxman/master/api/psi4.core.Dimension.html
index 713f027c269..89a9c8e1e8e 100644
--- a/sphinxman/master/api/psi4.core.Dimension.html
+++ b/sphinxman/master/api/psi4.core.Dimension.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.Dimension.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -362,7 +362,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.Dimension.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -376,7 +376,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.DipoleInt.html b/sphinxman/master/api/psi4.core.DipoleInt.html
index 313c824f909..6d1d44bd301 100644
--- a/sphinxman/master/api/psi4.core.DipoleInt.html
+++ b/sphinxman/master/api/psi4.core.DipoleInt.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DipoleInt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -205,7 +205,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DipoleInt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -219,7 +219,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.DirectJK.html b/sphinxman/master/api/psi4.core.DirectJK.html
index 8eef107b8f7..ef24932c52f 100644
--- a/sphinxman/master/api/psi4.core.DirectJK.html
+++ b/sphinxman/master/api/psi4.core.DirectJK.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DirectJK.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -223,7 +223,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DirectJK.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -237,7 +237,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.DiskSOMCSCF.html b/sphinxman/master/api/psi4.core.DiskSOMCSCF.html
index a6d0cc3d6fe..3d1de65f8a2 100644
--- a/sphinxman/master/api/psi4.core.DiskSOMCSCF.html
+++ b/sphinxman/master/api/psi4.core.DiskSOMCSCF.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DiskSOMCSCF.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -205,7 +205,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.DiskSOMCSCF.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -219,7 +219,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.Dispersion.html b/sphinxman/master/api/psi4.core.Dispersion.html
index 7f43de0877f..2c0f531f399 100644
--- a/sphinxman/master/api/psi4.core.Dispersion.html
+++ b/sphinxman/master/api/psi4.core.Dispersion.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.Dispersion.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -433,7 +433,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.Dispersion.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -447,7 +447,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.ERI.html b/sphinxman/master/api/psi4.core.ERI.html
index f1915c13606..d30e4fe8743 100644
--- a/sphinxman/master/api/psi4.core.ERI.html
+++ b/sphinxman/master/api/psi4.core.ERI.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.ERI.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -205,7 +205,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.ERI.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -219,7 +219,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.ESPPropCalc.html b/sphinxman/master/api/psi4.core.ESPPropCalc.html
index 9196ef8a52c..78d2e3fc781 100644
--- a/sphinxman/master/api/psi4.core.ESPPropCalc.html
+++ b/sphinxman/master/api/psi4.core.ESPPropCalc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.ESPPropCalc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -233,7 +233,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.ESPPropCalc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -247,7 +247,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.ElectricFieldInt.html b/sphinxman/master/api/psi4.core.ElectricFieldInt.html
index 3a12a11bc90..b4ca45090b8 100644
--- a/sphinxman/master/api/psi4.core.ElectricFieldInt.html
+++ b/sphinxman/master/api/psi4.core.ElectricFieldInt.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.ElectricFieldInt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -205,7 +205,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.ElectricFieldInt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -219,7 +219,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.ElectrostaticInt.html b/sphinxman/master/api/psi4.core.ElectrostaticInt.html
index cc64a97b10d..dff1e0fc40c 100644
--- a/sphinxman/master/api/psi4.core.ElectrostaticInt.html
+++ b/sphinxman/master/api/psi4.core.ElectrostaticInt.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.ElectrostaticInt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -205,7 +205,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.ElectrostaticInt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -219,7 +219,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.ExternalPotential.html b/sphinxman/master/api/psi4.core.ExternalPotential.html
index 1f3a5475625..34ebd3b38e3 100644
--- a/sphinxman/master/api/psi4.core.ExternalPotential.html
+++ b/sphinxman/master/api/psi4.core.ExternalPotential.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.ExternalPotential.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -323,7 +323,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.ExternalPotential.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -337,7 +337,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.FCHKWriter.html b/sphinxman/master/api/psi4.core.FCHKWriter.html
index fa8a4a68223..1d1db47444f 100644
--- a/sphinxman/master/api/psi4.core.FCHKWriter.html
+++ b/sphinxman/master/api/psi4.core.FCHKWriter.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.FCHKWriter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -242,7 +242,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.FCHKWriter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -256,7 +256,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.FDDS_Dispersion.html b/sphinxman/master/api/psi4.core.FDDS_Dispersion.html
index 3de60e4ac5f..6ec0095a070 100644
--- a/sphinxman/master/api/psi4.core.FDDS_Dispersion.html
+++ b/sphinxman/master/api/psi4.core.FDDS_Dispersion.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.FDDS_Dispersion.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -313,7 +313,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.FDDS_Dispersion.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -327,7 +327,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.FISAPT.html b/sphinxman/master/api/psi4.core.FISAPT.html
index 85bf7e7fc8d..5d0466786f8 100644
--- a/sphinxman/master/api/psi4.core.FISAPT.html
+++ b/sphinxman/master/api/psi4.core.FISAPT.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.FISAPT.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -503,7 +503,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.FISAPT.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -517,7 +517,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.FittedSlaterCorrelationFactor.html b/sphinxman/master/api/psi4.core.FittedSlaterCorrelationFactor.html
index 4ec2f4a8e98..7cfe2a8d5e5 100644
--- a/sphinxman/master/api/psi4.core.FittedSlaterCorrelationFactor.html
+++ b/sphinxman/master/api/psi4.core.FittedSlaterCorrelationFactor.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.FittedSlaterCorrelationFactor.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -222,7 +222,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.FittedSlaterCorrelationFactor.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -236,7 +236,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.FittingMetric.html b/sphinxman/master/api/psi4.core.FittingMetric.html
index 68e01f31c5c..d714543d6dc 100644
--- a/sphinxman/master/api/psi4.core.FittingMetric.html
+++ b/sphinxman/master/api/psi4.core.FittingMetric.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.FittingMetric.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -323,7 +323,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.FittingMetric.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -337,7 +337,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.FragmentType.html b/sphinxman/master/api/psi4.core.FragmentType.html
index 6a9ca391229..96c8175fca7 100644
--- a/sphinxman/master/api/psi4.core.FragmentType.html
+++ b/sphinxman/master/api/psi4.core.FragmentType.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.FragmentType.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -264,7 +264,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.FragmentType.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -278,7 +278,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.Functional.html b/sphinxman/master/api/psi4.core.Functional.html
index 625282618b2..1dcf520b10a 100644
--- a/sphinxman/master/api/psi4.core.Functional.html
+++ b/sphinxman/master/api/psi4.core.Functional.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.Functional.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -473,7 +473,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.Functional.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -487,7 +487,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.GaussianShell.html b/sphinxman/master/api/psi4.core.GaussianShell.html
index cb090670b94..4c5ab4fac4a 100644
--- a/sphinxman/master/api/psi4.core.GaussianShell.html
+++ b/sphinxman/master/api/psi4.core.GaussianShell.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.GaussianShell.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -369,7 +369,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.GaussianShell.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -383,7 +383,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.GaussianType.html b/sphinxman/master/api/psi4.core.GaussianType.html
index d8dc2a8bda9..d15986cbaaa 100644
--- a/sphinxman/master/api/psi4.core.GaussianType.html
+++ b/sphinxman/master/api/psi4.core.GaussianType.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.GaussianType.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -254,7 +254,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.GaussianType.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -268,7 +268,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.GeometryUnits.html b/sphinxman/master/api/psi4.core.GeometryUnits.html
index ad81f7ebfd6..02d0c8af6e9 100644
--- a/sphinxman/master/api/psi4.core.GeometryUnits.html
+++ b/sphinxman/master/api/psi4.core.GeometryUnits.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.GeometryUnits.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -254,7 +254,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.GeometryUnits.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -268,7 +268,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.HF.html b/sphinxman/master/api/psi4.core.HF.html
index 46f78384698..d7a60f3961a 100644
--- a/sphinxman/master/api/psi4.core.HF.html
+++ b/sphinxman/master/api/psi4.core.HF.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.HF.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -990,7 +990,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.HF.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1004,7 +1004,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.IDAMAX.html b/sphinxman/master/api/psi4.core.IDAMAX.html
index 2172316d0c4..cd79c013c58 100644
--- a/sphinxman/master/api/psi4.core.IDAMAX.html
+++ b/sphinxman/master/api/psi4.core.IDAMAX.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.IDAMAX.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.IDAMAX.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.IO.html b/sphinxman/master/api/psi4.core.IO.html
index 4302a185c77..c1a18ee3285 100644
--- a/sphinxman/master/api/psi4.core.IO.html
+++ b/sphinxman/master/api/psi4.core.IO.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.IO.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -383,7 +383,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.IO.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -397,7 +397,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.IOManager.html b/sphinxman/master/api/psi4.core.IOManager.html
index e7dd56d4189..e67c25994da 100644
--- a/sphinxman/master/api/psi4.core.IOManager.html
+++ b/sphinxman/master/api/psi4.core.IOManager.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.IOManager.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -323,7 +323,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.IOManager.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -337,7 +337,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.IntVector.html b/sphinxman/master/api/psi4.core.IntVector.html
index 569774b059c..4a595c65a1a 100644
--- a/sphinxman/master/api/psi4.core.IntVector.html
+++ b/sphinxman/master/api/psi4.core.IntVector.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.IntVector.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -392,7 +392,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.IntVector.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -406,7 +406,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.IntegralFactory.html b/sphinxman/master/api/psi4.core.IntegralFactory.html
index 253e41ba544..5eb37ecbce3 100644
--- a/sphinxman/master/api/psi4.core.IntegralFactory.html
+++ b/sphinxman/master/api/psi4.core.IntegralFactory.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.IntegralFactory.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -513,7 +513,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.IntegralFactory.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -527,7 +527,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.IntegralTransform.html b/sphinxman/master/api/psi4.core.IntegralTransform.html
index e31106b3751..8863bb9caee 100644
--- a/sphinxman/master/api/psi4.core.IntegralTransform.html
+++ b/sphinxman/master/api/psi4.core.IntegralTransform.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.IntegralTransform.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -601,7 +601,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.IntegralTransform.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -615,7 +615,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.IrreducibleRepresentation.html b/sphinxman/master/api/psi4.core.IrreducibleRepresentation.html
index c11e8261571..5eb537bdefb 100644
--- a/sphinxman/master/api/psi4.core.IrreducibleRepresentation.html
+++ b/sphinxman/master/api/psi4.core.IrreducibleRepresentation.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.IrreducibleRepresentation.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -233,7 +233,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.IrreducibleRepresentation.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -247,7 +247,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.JK.html b/sphinxman/master/api/psi4.core.JK.html
index 336e9cf5e1e..68b8136894b 100644
--- a/sphinxman/master/api/psi4.core.JK.html
+++ b/sphinxman/master/api/psi4.core.JK.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.JK.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -567,7 +567,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.JK.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -581,7 +581,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.KineticInt.html b/sphinxman/master/api/psi4.core.KineticInt.html
index 60b1c8bb66e..46b7dd07acc 100644
--- a/sphinxman/master/api/psi4.core.KineticInt.html
+++ b/sphinxman/master/api/psi4.core.KineticInt.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.KineticInt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -205,7 +205,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.KineticInt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -219,7 +219,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.LS_THC_Computer.html b/sphinxman/master/api/psi4.core.LS_THC_Computer.html
index 8f403c5f4dc..e55d16ca53c 100644
--- a/sphinxman/master/api/psi4.core.LS_THC_Computer.html
+++ b/sphinxman/master/api/psi4.core.LS_THC_Computer.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.LS_THC_Computer.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -273,7 +273,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.LS_THC_Computer.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -287,7 +287,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.LaplaceDenominator.html b/sphinxman/master/api/psi4.core.LaplaceDenominator.html
index 28118ad2173..73d99f4b26e 100644
--- a/sphinxman/master/api/psi4.core.LaplaceDenominator.html
+++ b/sphinxman/master/api/psi4.core.LaplaceDenominator.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.LaplaceDenominator.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -233,7 +233,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.LaplaceDenominator.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -247,7 +247,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.LibXCFunctional.html b/sphinxman/master/api/psi4.core.LibXCFunctional.html
index 6078fe295c4..4a0e6a10aac 100644
--- a/sphinxman/master/api/psi4.core.LibXCFunctional.html
+++ b/sphinxman/master/api/psi4.core.LibXCFunctional.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.LibXCFunctional.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -291,7 +291,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.LibXCFunctional.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -305,7 +305,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.Localizer.html b/sphinxman/master/api/psi4.core.Localizer.html
index 8ba9151456e..1129b212b26 100644
--- a/sphinxman/master/api/psi4.core.Localizer.html
+++ b/sphinxman/master/api/psi4.core.Localizer.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.Localizer.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -269,7 +269,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.Localizer.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -283,7 +283,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.MOSpace.html b/sphinxman/master/api/psi4.core.MOSpace.html
index 10b34fcb4d6..42c683fb5f7 100644
--- a/sphinxman/master/api/psi4.core.MOSpace.html
+++ b/sphinxman/master/api/psi4.core.MOSpace.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.MOSpace.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -326,7 +326,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.MOSpace.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -340,7 +340,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.MOWriter.html b/sphinxman/master/api/psi4.core.MOWriter.html
index 62e92ce91b4..7bed64a03fa 100644
--- a/sphinxman/master/api/psi4.core.MOWriter.html
+++ b/sphinxman/master/api/psi4.core.MOWriter.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.MOWriter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -223,7 +223,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.MOWriter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -237,7 +237,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.Matrix.html b/sphinxman/master/api/psi4.core.Matrix.html
index 738ea9079d6..a16a5159e9b 100644
--- a/sphinxman/master/api/psi4.core.Matrix.html
+++ b/sphinxman/master/api/psi4.core.Matrix.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.Matrix.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1131,7 +1131,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.Matrix.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1145,7 +1145,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.MatrixFactory.html b/sphinxman/master/api/psi4.core.MatrixFactory.html
index 9217fe3a94f..ec92d87477c 100644
--- a/sphinxman/master/api/psi4.core.MatrixFactory.html
+++ b/sphinxman/master/api/psi4.core.MatrixFactory.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.MatrixFactory.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -231,7 +231,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.MatrixFactory.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -245,7 +245,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.MemDFJK.html b/sphinxman/master/api/psi4.core.MemDFJK.html
index b9f04ac439d..f011fe95379 100644
--- a/sphinxman/master/api/psi4.core.MemDFJK.html
+++ b/sphinxman/master/api/psi4.core.MemDFJK.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.MemDFJK.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -223,7 +223,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.MemDFJK.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -237,7 +237,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.MintsHelper.html b/sphinxman/master/api/psi4.core.MintsHelper.html
index 49596bbd796..891eb7667f8 100644
--- a/sphinxman/master/api/psi4.core.MintsHelper.html
+++ b/sphinxman/master/api/psi4.core.MintsHelper.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.MintsHelper.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1103,7 +1103,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.MintsHelper.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1117,7 +1117,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.MoldenWriter.html b/sphinxman/master/api/psi4.core.MoldenWriter.html
index 150baebc053..96d676a42de 100644
--- a/sphinxman/master/api/psi4.core.MoldenWriter.html
+++ b/sphinxman/master/api/psi4.core.MoldenWriter.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.MoldenWriter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -223,7 +223,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.MoldenWriter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -237,7 +237,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.MolecularGrid.html b/sphinxman/master/api/psi4.core.MolecularGrid.html
index d70f985077e..3bb04c96cc9 100644
--- a/sphinxman/master/api/psi4.core.MolecularGrid.html
+++ b/sphinxman/master/api/psi4.core.MolecularGrid.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.MolecularGrid.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -293,7 +293,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.MolecularGrid.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -307,7 +307,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.Molecule.html b/sphinxman/master/api/psi4.core.Molecule.html
index bf62ed4d5e9..67858dbb0ef 100644
--- a/sphinxman/master/api/psi4.core.Molecule.html
+++ b/sphinxman/master/api/psi4.core.Molecule.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.Molecule.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1782,7 +1782,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.Molecule.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1796,7 +1796,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.MultipoleInt.html b/sphinxman/master/api/psi4.core.MultipoleInt.html
index d4125815c4b..ecfdccbceb4 100644
--- a/sphinxman/master/api/psi4.core.MultipoleInt.html
+++ b/sphinxman/master/api/psi4.core.MultipoleInt.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.MultipoleInt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -205,7 +205,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.MultipoleInt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -219,7 +219,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.MultipoleSymmetry.html b/sphinxman/master/api/psi4.core.MultipoleSymmetry.html
index 1a125371f93..4ab952ec62a 100644
--- a/sphinxman/master/api/psi4.core.MultipoleSymmetry.html
+++ b/sphinxman/master/api/psi4.core.MultipoleSymmetry.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.MultipoleSymmetry.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -223,7 +223,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.MultipoleSymmetry.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -237,7 +237,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.NablaInt.html b/sphinxman/master/api/psi4.core.NablaInt.html
index 8a15875a440..6ff7a97ca50 100644
--- a/sphinxman/master/api/psi4.core.NablaInt.html
+++ b/sphinxman/master/api/psi4.core.NablaInt.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.NablaInt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -205,7 +205,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.NablaInt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -219,7 +219,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.NumIntHelper.html b/sphinxman/master/api/psi4.core.NumIntHelper.html
index 52bfcc154ce..f3b61cd101a 100644
--- a/sphinxman/master/api/psi4.core.NumIntHelper.html
+++ b/sphinxman/master/api/psi4.core.NumIntHelper.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.NumIntHelper.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -252,7 +252,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.NumIntHelper.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -266,7 +266,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.OEProp.html b/sphinxman/master/api/psi4.core.OEProp.html
index 6990fd019b3..f2e29b6ac27 100644
--- a/sphinxman/master/api/psi4.core.OEProp.html
+++ b/sphinxman/master/api/psi4.core.OEProp.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.OEProp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -378,7 +378,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.OEProp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -392,7 +392,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.OneBodyAOInt.html b/sphinxman/master/api/psi4.core.OneBodyAOInt.html
index 3e86b355862..43b99e3c203 100644
--- a/sphinxman/master/api/psi4.core.OneBodyAOInt.html
+++ b/sphinxman/master/api/psi4.core.OneBodyAOInt.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.OneBodyAOInt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -279,7 +279,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.OneBodyAOInt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -293,7 +293,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.OneBodySOInt.html b/sphinxman/master/api/psi4.core.OneBodySOInt.html
index 1808ce6a9eb..68382f34239 100644
--- a/sphinxman/master/api/psi4.core.OneBodySOInt.html
+++ b/sphinxman/master/api/psi4.core.OneBodySOInt.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.OneBodySOInt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -242,7 +242,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.OneBodySOInt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -256,7 +256,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.Options.html b/sphinxman/master/api/psi4.core.Options.html
index e9cf78e2f66..98e1e37deaa 100644
--- a/sphinxman/master/api/psi4.core.Options.html
+++ b/sphinxman/master/api/psi4.core.Options.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.Options.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -451,7 +451,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.Options.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -465,7 +465,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.OrbitalSpace.html b/sphinxman/master/api/psi4.core.OrbitalSpace.html
index e18eb2fcbf4..27eab690f8b 100644
--- a/sphinxman/master/api/psi4.core.OrbitalSpace.html
+++ b/sphinxman/master/api/psi4.core.OrbitalSpace.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.OrbitalSpace.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -323,7 +323,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.OrbitalSpace.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -337,7 +337,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.OverlapInt.html b/sphinxman/master/api/psi4.core.OverlapInt.html
index a0e65c4bf26..65418ce661b 100644
--- a/sphinxman/master/api/psi4.core.OverlapInt.html
+++ b/sphinxman/master/api/psi4.core.OverlapInt.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.OverlapInt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -205,7 +205,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.OverlapInt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -219,7 +219,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.PMLocalizer.html b/sphinxman/master/api/psi4.core.PMLocalizer.html
index de5c43ac06b..d7368d6406c 100644
--- a/sphinxman/master/api/psi4.core.PMLocalizer.html
+++ b/sphinxman/master/api/psi4.core.PMLocalizer.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.PMLocalizer.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -205,7 +205,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.PMLocalizer.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -219,7 +219,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.PetiteList.html b/sphinxman/master/api/psi4.core.PetiteList.html
index 723a3e31dfd..2838623d484 100644
--- a/sphinxman/master/api/psi4.core.PetiteList.html
+++ b/sphinxman/master/api/psi4.core.PetiteList.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.PetiteList.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -243,7 +243,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.PetiteList.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -257,7 +257,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.PointFunctions.html b/sphinxman/master/api/psi4.core.PointFunctions.html
index 7dd0e1663fd..1d3a387bae1 100644
--- a/sphinxman/master/api/psi4.core.PointFunctions.html
+++ b/sphinxman/master/api/psi4.core.PointFunctions.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.PointFunctions.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -291,7 +291,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.PointFunctions.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -305,7 +305,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.PointGroup.html b/sphinxman/master/api/psi4.core.PointGroup.html
index 35a05fec29f..38539bc633c 100644
--- a/sphinxman/master/api/psi4.core.PointGroup.html
+++ b/sphinxman/master/api/psi4.core.PointGroup.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.PointGroup.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -263,7 +263,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.PointGroup.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -277,7 +277,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.PotentialInt.html b/sphinxman/master/api/psi4.core.PotentialInt.html
index 324f052f8b5..bd819632715 100644
--- a/sphinxman/master/api/psi4.core.PotentialInt.html
+++ b/sphinxman/master/api/psi4.core.PotentialInt.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.PotentialInt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -205,7 +205,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.PotentialInt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -219,7 +219,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.PrimitiveType.html b/sphinxman/master/api/psi4.core.PrimitiveType.html
index 81ee3a6c891..3398ac66439 100644
--- a/sphinxman/master/api/psi4.core.PrimitiveType.html
+++ b/sphinxman/master/api/psi4.core.PrimitiveType.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.PrimitiveType.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -254,7 +254,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.PrimitiveType.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -268,7 +268,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.Prop.html b/sphinxman/master/api/psi4.core.Prop.html
index cc8a00c4865..42df4eb5957 100644
--- a/sphinxman/master/api/psi4.core.Prop.html
+++ b/sphinxman/master/api/psi4.core.Prop.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.Prop.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -205,7 +205,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.Prop.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -219,7 +219,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.ProtoIntVector.html b/sphinxman/master/api/psi4.core.ProtoIntVector.html
index dad3a80e49e..867ae8f9aca 100644
--- a/sphinxman/master/api/psi4.core.ProtoIntVector.html
+++ b/sphinxman/master/api/psi4.core.ProtoIntVector.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.ProtoIntVector.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.ProtoIntVector.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.ProtoVector.html b/sphinxman/master/api/psi4.core.ProtoVector.html
index acb51928860..0fc21e85fe0 100644
--- a/sphinxman/master/api/psi4.core.ProtoVector.html
+++ b/sphinxman/master/api/psi4.core.ProtoVector.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.ProtoVector.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.ProtoVector.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.PsiReturnType.html b/sphinxman/master/api/psi4.core.PsiReturnType.html
index bff2cdfb5f3..2d95ffb7e48 100644
--- a/sphinxman/master/api/psi4.core.PsiReturnType.html
+++ b/sphinxman/master/api/psi4.core.PsiReturnType.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.PsiReturnType.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -254,7 +254,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.PsiReturnType.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -268,7 +268,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.QuadrupoleInt.html b/sphinxman/master/api/psi4.core.QuadrupoleInt.html
index d7c13a98380..836b7907013 100644
--- a/sphinxman/master/api/psi4.core.QuadrupoleInt.html
+++ b/sphinxman/master/api/psi4.core.QuadrupoleInt.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.QuadrupoleInt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -205,7 +205,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.QuadrupoleInt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -219,7 +219,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.RHF.html b/sphinxman/master/api/psi4.core.RHF.html
index 8ecb6b80f31..461f61d49dc 100644
--- a/sphinxman/master/api/psi4.core.RHF.html
+++ b/sphinxman/master/api/psi4.core.RHF.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.RHF.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -274,7 +274,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.RHF.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -288,7 +288,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.RKSFunctions.html b/sphinxman/master/api/psi4.core.RKSFunctions.html
index cc202cc70f3..baf14e095d0 100644
--- a/sphinxman/master/api/psi4.core.RKSFunctions.html
+++ b/sphinxman/master/api/psi4.core.RKSFunctions.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.RKSFunctions.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -205,7 +205,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.RKSFunctions.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -219,7 +219,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.ROHF.html b/sphinxman/master/api/psi4.core.ROHF.html
index 386b763e4ae..0bc482ffef0 100644
--- a/sphinxman/master/api/psi4.core.ROHF.html
+++ b/sphinxman/master/api/psi4.core.ROHF.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.ROHF.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -314,7 +314,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.ROHF.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -328,7 +328,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.SADGuess.html b/sphinxman/master/api/psi4.core.SADGuess.html
index 9049f142c01..baa261dbb9c 100644
--- a/sphinxman/master/api/psi4.core.SADGuess.html
+++ b/sphinxman/master/api/psi4.core.SADGuess.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.SADGuess.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -294,7 +294,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.SADGuess.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -308,7 +308,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.SOBasisSet.html b/sphinxman/master/api/psi4.core.SOBasisSet.html
index 9bc11d576ba..eae977e0243 100644
--- a/sphinxman/master/api/psi4.core.SOBasisSet.html
+++ b/sphinxman/master/api/psi4.core.SOBasisSet.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.SOBasisSet.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -223,7 +223,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.SOBasisSet.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -237,7 +237,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.SOMCSCF.html b/sphinxman/master/api/psi4.core.SOMCSCF.html
index e28e75aa92a..39ab9bf14ad 100644
--- a/sphinxman/master/api/psi4.core.SOMCSCF.html
+++ b/sphinxman/master/api/psi4.core.SOMCSCF.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.SOMCSCF.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -384,7 +384,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.SOMCSCF.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -398,7 +398,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.SalcComponent.html b/sphinxman/master/api/psi4.core.SalcComponent.html
index 2bcc19e0bce..078d23abddb 100644
--- a/sphinxman/master/api/psi4.core.SalcComponent.html
+++ b/sphinxman/master/api/psi4.core.SalcComponent.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.SalcComponent.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -243,7 +243,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.SalcComponent.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -257,7 +257,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.SaveType.html b/sphinxman/master/api/psi4.core.SaveType.html
index cd02fe88458..3c392141cbe 100644
--- a/sphinxman/master/api/psi4.core.SaveType.html
+++ b/sphinxman/master/api/psi4.core.SaveType.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.SaveType.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -264,7 +264,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.SaveType.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -278,7 +278,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.ShellInfo.html b/sphinxman/master/api/psi4.core.ShellInfo.html
index 6cf0755c948..ebf6ebd6bfc 100644
--- a/sphinxman/master/api/psi4.core.ShellInfo.html
+++ b/sphinxman/master/api/psi4.core.ShellInfo.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.ShellInfo.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.ShellInfo.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.Slice.html b/sphinxman/master/api/psi4.core.Slice.html
index f9308a63408..dc248a93367 100644
--- a/sphinxman/master/api/psi4.core.Slice.html
+++ b/sphinxman/master/api/psi4.core.Slice.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.Slice.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -233,7 +233,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.Slice.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -247,7 +247,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.SuperFunctional.html b/sphinxman/master/api/psi4.core.SuperFunctional.html
index e5bc094f6d2..bf75d12ebc0 100644
--- a/sphinxman/master/api/psi4.core.SuperFunctional.html
+++ b/sphinxman/master/api/psi4.core.SuperFunctional.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.SuperFunctional.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -893,7 +893,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.SuperFunctional.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -907,7 +907,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.SymmetryOperation.html b/sphinxman/master/api/psi4.core.SymmetryOperation.html
index f1442f4deee..90b5e0fad77 100644
--- a/sphinxman/master/api/psi4.core.SymmetryOperation.html
+++ b/sphinxman/master/api/psi4.core.SymmetryOperation.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.SymmetryOperation.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -383,7 +383,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.SymmetryOperation.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -397,7 +397,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.TLaplaceDenominator.html b/sphinxman/master/api/psi4.core.TLaplaceDenominator.html
index d23c6452be2..729f9fcda8c 100644
--- a/sphinxman/master/api/psi4.core.TLaplaceDenominator.html
+++ b/sphinxman/master/api/psi4.core.TLaplaceDenominator.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.TLaplaceDenominator.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -233,7 +233,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.TLaplaceDenominator.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -247,7 +247,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.ThreeCenterOverlapInt.html b/sphinxman/master/api/psi4.core.ThreeCenterOverlapInt.html
index f3c757926ef..cae7218ab8e 100644
--- a/sphinxman/master/api/psi4.core.ThreeCenterOverlapInt.html
+++ b/sphinxman/master/api/psi4.core.ThreeCenterOverlapInt.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.ThreeCenterOverlapInt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -223,7 +223,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.ThreeCenterOverlapInt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -237,7 +237,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.TracelessQuadrupoleInt.html b/sphinxman/master/api/psi4.core.TracelessQuadrupoleInt.html
index e75454c0c24..c0f213553d3 100644
--- a/sphinxman/master/api/psi4.core.TracelessQuadrupoleInt.html
+++ b/sphinxman/master/api/psi4.core.TracelessQuadrupoleInt.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.TracelessQuadrupoleInt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -205,7 +205,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.TracelessQuadrupoleInt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -219,7 +219,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.TwoBodyAOInt.html b/sphinxman/master/api/psi4.core.TwoBodyAOInt.html
index c9665b48a8e..5f376b17660 100644
--- a/sphinxman/master/api/psi4.core.TwoBodyAOInt.html
+++ b/sphinxman/master/api/psi4.core.TwoBodyAOInt.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.TwoBodyAOInt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -243,7 +243,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.TwoBodyAOInt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -257,7 +257,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.TwoElectronInt.html b/sphinxman/master/api/psi4.core.TwoElectronInt.html
index f8eb3b339aa..b6d477ace32 100644
--- a/sphinxman/master/api/psi4.core.TwoElectronInt.html
+++ b/sphinxman/master/api/psi4.core.TwoElectronInt.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.TwoElectronInt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -233,7 +233,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.TwoElectronInt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -247,7 +247,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.UHF.html b/sphinxman/master/api/psi4.core.UHF.html
index be6ef5151eb..bb6a46d9ee1 100644
--- a/sphinxman/master/api/psi4.core.UHF.html
+++ b/sphinxman/master/api/psi4.core.UHF.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.UHF.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -274,7 +274,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.UHF.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -288,7 +288,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.UKSFunctions.html b/sphinxman/master/api/psi4.core.UKSFunctions.html
index 9d81a383944..36668047d16 100644
--- a/sphinxman/master/api/psi4.core.UKSFunctions.html
+++ b/sphinxman/master/api/psi4.core.UKSFunctions.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.UKSFunctions.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -205,7 +205,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.UKSFunctions.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -219,7 +219,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.VBase.html b/sphinxman/master/api/psi4.core.VBase.html
index de6a9c278f9..c6e83971825 100644
--- a/sphinxman/master/api/psi4.core.VBase.html
+++ b/sphinxman/master/api/psi4.core.VBase.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.VBase.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -456,7 +456,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.VBase.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -470,7 +470,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.Vector.html b/sphinxman/master/api/psi4.core.Vector.html
index c1ffdaee886..1ef3c4e7afa 100644
--- a/sphinxman/master/api/psi4.core.Vector.html
+++ b/sphinxman/master/api/psi4.core.Vector.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.Vector.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -672,7 +672,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.Vector.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -686,7 +686,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.Vector3.html b/sphinxman/master/api/psi4.core.Vector3.html
index f5d2dab6e5f..1468078c945 100644
--- a/sphinxman/master/api/psi4.core.Vector3.html
+++ b/sphinxman/master/api/psi4.core.Vector3.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.Vector3.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -263,7 +263,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.Vector3.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -277,7 +277,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.Wavefunction.html b/sphinxman/master/api/psi4.core.Wavefunction.html
index 62606afa001..48770b8274b 100644
--- a/sphinxman/master/api/psi4.core.Wavefunction.html
+++ b/sphinxman/master/api/psi4.core.Wavefunction.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.Wavefunction.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1646,7 +1646,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.Wavefunction.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1660,7 +1660,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.array_variable.html b/sphinxman/master/api/psi4.core.array_variable.html
index 26950d57e86..72fdb556865 100644
--- a/sphinxman/master/api/psi4.core.array_variable.html
+++ b/sphinxman/master/api/psi4.core.array_variable.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.array_variable.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.array_variable.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.array_variables.html b/sphinxman/master/api/psi4.core.array_variables.html
index dc09febb685..2d68b337c1d 100644
--- a/sphinxman/master/api/psi4.core.array_variables.html
+++ b/sphinxman/master/api/psi4.core.array_variables.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.array_variables.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.array_variables.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.be_quiet.html b/sphinxman/master/api/psi4.core.be_quiet.html
index 7204cea5eae..5f9821872e0 100644
--- a/sphinxman/master/api/psi4.core.be_quiet.html
+++ b/sphinxman/master/api/psi4.core.be_quiet.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.be_quiet.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.be_quiet.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.benchmark_blas1.html b/sphinxman/master/api/psi4.core.benchmark_blas1.html
index cbe6ce07851..09d803f66c7 100644
--- a/sphinxman/master/api/psi4.core.benchmark_blas1.html
+++ b/sphinxman/master/api/psi4.core.benchmark_blas1.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.benchmark_blas1.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.benchmark_blas1.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.benchmark_blas2.html b/sphinxman/master/api/psi4.core.benchmark_blas2.html
index 19f97c374c6..5a7c86de912 100644
--- a/sphinxman/master/api/psi4.core.benchmark_blas2.html
+++ b/sphinxman/master/api/psi4.core.benchmark_blas2.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.benchmark_blas2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.benchmark_blas2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.benchmark_blas3.html b/sphinxman/master/api/psi4.core.benchmark_blas3.html
index 38aa11fdccf..1c22c12a6bb 100644
--- a/sphinxman/master/api/psi4.core.benchmark_blas3.html
+++ b/sphinxman/master/api/psi4.core.benchmark_blas3.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.benchmark_blas3.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.benchmark_blas3.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.benchmark_disk.html b/sphinxman/master/api/psi4.core.benchmark_disk.html
index e867bc0bc1f..c09f10f565f 100644
--- a/sphinxman/master/api/psi4.core.benchmark_disk.html
+++ b/sphinxman/master/api/psi4.core.benchmark_disk.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.benchmark_disk.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.benchmark_disk.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.benchmark_integrals.html b/sphinxman/master/api/psi4.core.benchmark_integrals.html
index d3c03220f8f..444bf232859 100644
--- a/sphinxman/master/api/psi4.core.benchmark_integrals.html
+++ b/sphinxman/master/api/psi4.core.benchmark_integrals.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.benchmark_integrals.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.benchmark_integrals.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.benchmark_math.html b/sphinxman/master/api/psi4.core.benchmark_math.html
index 6f9f34cada0..518a200e073 100644
--- a/sphinxman/master/api/psi4.core.benchmark_math.html
+++ b/sphinxman/master/api/psi4.core.benchmark_math.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.benchmark_math.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.benchmark_math.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.ccdensity.html b/sphinxman/master/api/psi4.core.ccdensity.html
index df64a9ed71d..21473d26af1 100644
--- a/sphinxman/master/api/psi4.core.ccdensity.html
+++ b/sphinxman/master/api/psi4.core.ccdensity.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.ccdensity.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.ccdensity.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.ccenergy.html b/sphinxman/master/api/psi4.core.ccenergy.html
index 1e63f4cc968..f0454e3228c 100644
--- a/sphinxman/master/api/psi4.core.ccenergy.html
+++ b/sphinxman/master/api/psi4.core.ccenergy.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.ccenergy.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.ccenergy.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.cceom.html b/sphinxman/master/api/psi4.core.cceom.html
index 3dd235df1f7..375fa4d75bf 100644
--- a/sphinxman/master/api/psi4.core.cceom.html
+++ b/sphinxman/master/api/psi4.core.cceom.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.cceom.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.cceom.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.cchbar.html b/sphinxman/master/api/psi4.core.cchbar.html
index bec99e7fef7..f6f4e5d1ea7 100644
--- a/sphinxman/master/api/psi4.core.cchbar.html
+++ b/sphinxman/master/api/psi4.core.cchbar.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.cchbar.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.cchbar.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.cclambda.html b/sphinxman/master/api/psi4.core.cclambda.html
index 9f25e8c3a27..75f90a1e27c 100644
--- a/sphinxman/master/api/psi4.core.cclambda.html
+++ b/sphinxman/master/api/psi4.core.cclambda.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.cclambda.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.cclambda.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.ccresponse.html b/sphinxman/master/api/psi4.core.ccresponse.html
index ddbd88e50bb..df9852b1d8d 100644
--- a/sphinxman/master/api/psi4.core.ccresponse.html
+++ b/sphinxman/master/api/psi4.core.ccresponse.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.ccresponse.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.ccresponse.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.cctransort.html b/sphinxman/master/api/psi4.core.cctransort.html
index edb9ad1df19..a4dda81ff96 100644
--- a/sphinxman/master/api/psi4.core.cctransort.html
+++ b/sphinxman/master/api/psi4.core.cctransort.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.cctransort.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.cctransort.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.cctriples.html b/sphinxman/master/api/psi4.core.cctriples.html
index bd7b25ba2e1..fe8113f5cb6 100644
--- a/sphinxman/master/api/psi4.core.cctriples.html
+++ b/sphinxman/master/api/psi4.core.cctriples.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.cctriples.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.cctriples.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.clean.html b/sphinxman/master/api/psi4.core.clean.html
index cd9d4c60661..a2985ac4cce 100644
--- a/sphinxman/master/api/psi4.core.clean.html
+++ b/sphinxman/master/api/psi4.core.clean.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.clean.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.clean.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.clean_options.html b/sphinxman/master/api/psi4.core.clean_options.html
index 48fc29ce55c..60b44cc7ea4 100644
--- a/sphinxman/master/api/psi4.core.clean_options.html
+++ b/sphinxman/master/api/psi4.core.clean_options.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.clean_options.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.clean_options.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.clean_timers.html b/sphinxman/master/api/psi4.core.clean_timers.html
index c16458fb2ab..21718cab3e9 100644
--- a/sphinxman/master/api/psi4.core.clean_timers.html
+++ b/sphinxman/master/api/psi4.core.clean_timers.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.clean_timers.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.clean_timers.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.clean_variables.html b/sphinxman/master/api/psi4.core.clean_variables.html
index de7fb99dec0..d460860b162 100644
--- a/sphinxman/master/api/psi4.core.clean_variables.html
+++ b/sphinxman/master/api/psi4.core.clean_variables.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.clean_variables.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.clean_variables.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.close_outfile.html b/sphinxman/master/api/psi4.core.close_outfile.html
index ee3615404fa..7410cd1587b 100644
--- a/sphinxman/master/api/psi4.core.close_outfile.html
+++ b/sphinxman/master/api/psi4.core.close_outfile.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.close_outfile.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.close_outfile.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.dct.html b/sphinxman/master/api/psi4.core.dct.html
index f76a725901a..f49c7add8e3 100644
--- a/sphinxman/master/api/psi4.core.dct.html
+++ b/sphinxman/master/api/psi4.core.dct.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.dct.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.dct.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.del_array_variable.html b/sphinxman/master/api/psi4.core.del_array_variable.html
index 6cf4b8d06c2..a972b508570 100644
--- a/sphinxman/master/api/psi4.core.del_array_variable.html
+++ b/sphinxman/master/api/psi4.core.del_array_variable.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.del_array_variable.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.del_array_variable.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.del_scalar_variable.html b/sphinxman/master/api/psi4.core.del_scalar_variable.html
index 0abedaf95d4..022f00dea03 100644
--- a/sphinxman/master/api/psi4.core.del_scalar_variable.html
+++ b/sphinxman/master/api/psi4.core.del_scalar_variable.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.del_scalar_variable.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.del_scalar_variable.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.del_variable.html b/sphinxman/master/api/psi4.core.del_variable.html
index b68ee5221a4..25aa23ccb81 100644
--- a/sphinxman/master/api/psi4.core.del_variable.html
+++ b/sphinxman/master/api/psi4.core.del_variable.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.del_variable.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -213,7 +213,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.del_variable.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -227,7 +227,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.detci.html b/sphinxman/master/api/psi4.core.detci.html
index 11991c444ee..5d2e55e0f29 100644
--- a/sphinxman/master/api/psi4.core.detci.html
+++ b/sphinxman/master/api/psi4.core.detci.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.detci.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.detci.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.dfmp2.html b/sphinxman/master/api/psi4.core.dfmp2.html
index ecd72f45067..b4d4c81b89b 100644
--- a/sphinxman/master/api/psi4.core.dfmp2.html
+++ b/sphinxman/master/api/psi4.core.dfmp2.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.dfmp2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.dfmp2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.dfocc.html b/sphinxman/master/api/psi4.core.dfocc.html
index db91ee34836..c0d82ad8714 100644
--- a/sphinxman/master/api/psi4.core.dfocc.html
+++ b/sphinxman/master/api/psi4.core.dfocc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.dfocc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.dfocc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.dlpno.html b/sphinxman/master/api/psi4.core.dlpno.html
index fc9f75150d5..9f9d1274b11 100644
--- a/sphinxman/master/api/psi4.core.dlpno.html
+++ b/sphinxman/master/api/psi4.core.dlpno.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.dlpno.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.dlpno.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.dmrg.html b/sphinxman/master/api/psi4.core.dmrg.html
index f501ca0fefd..940dea8e42e 100644
--- a/sphinxman/master/api/psi4.core.dmrg.html
+++ b/sphinxman/master/api/psi4.core.dmrg.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.dmrg.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.dmrg.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.doublet.html b/sphinxman/master/api/psi4.core.doublet.html
index 226bf720e92..ec1f9a86770 100644
--- a/sphinxman/master/api/psi4.core.doublet.html
+++ b/sphinxman/master/api/psi4.core.doublet.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.doublet.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.doublet.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.dpdbuf4.html b/sphinxman/master/api/psi4.core.dpdbuf4.html
index 1df9fa2e52c..5a809716b13 100644
--- a/sphinxman/master/api/psi4.core.dpdbuf4.html
+++ b/sphinxman/master/api/psi4.core.dpdbuf4.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.dpdbuf4.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -253,7 +253,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.dpdbuf4.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -267,7 +267,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.dpdfile2.html b/sphinxman/master/api/psi4.core.dpdfile2.html
index fa027f773bb..76e987efa71 100644
--- a/sphinxman/master/api/psi4.core.dpdfile2.html
+++ b/sphinxman/master/api/psi4.core.dpdfile2.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.dpdfile2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -253,7 +253,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.dpdfile2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -267,7 +267,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.dummy_einsums.html b/sphinxman/master/api/psi4.core.dummy_einsums.html
index ec85a9bcf30..927959ea445 100644
--- a/sphinxman/master/api/psi4.core.dummy_einsums.html
+++ b/sphinxman/master/api/psi4.core.dummy_einsums.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.dummy_einsums.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.dummy_einsums.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.dummy_integratorxx.html b/sphinxman/master/api/psi4.core.dummy_integratorxx.html
index 0e0a8413058..65fb281fee1 100644
--- a/sphinxman/master/api/psi4.core.dummy_integratorxx.html
+++ b/sphinxman/master/api/psi4.core.dummy_integratorxx.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.dummy_integratorxx.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.dummy_integratorxx.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.fcidump_tei_helper.html b/sphinxman/master/api/psi4.core.fcidump_tei_helper.html
index 13468a028d7..b1d4f45c257 100644
--- a/sphinxman/master/api/psi4.core.fcidump_tei_helper.html
+++ b/sphinxman/master/api/psi4.core.fcidump_tei_helper.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.fcidump_tei_helper.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.fcidump_tei_helper.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.finalize.html b/sphinxman/master/api/psi4.core.finalize.html
index c0c164ba1b9..d427d6f048a 100644
--- a/sphinxman/master/api/psi4.core.finalize.html
+++ b/sphinxman/master/api/psi4.core.finalize.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.finalize.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.finalize.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.flush_outfile.html b/sphinxman/master/api/psi4.core.flush_outfile.html
index 653a03dc330..1439692518a 100644
--- a/sphinxman/master/api/psi4.core.flush_outfile.html
+++ b/sphinxman/master/api/psi4.core.flush_outfile.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.flush_outfile.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.flush_outfile.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.fnocc.html b/sphinxman/master/api/psi4.core.fnocc.html
index 8c21e8588bd..6b369f3604e 100644
--- a/sphinxman/master/api/psi4.core.fnocc.html
+++ b/sphinxman/master/api/psi4.core.fnocc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.fnocc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.fnocc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.get_active_molecule.html b/sphinxman/master/api/psi4.core.get_active_molecule.html
index d250a1e3961..e08f65bcb1b 100644
--- a/sphinxman/master/api/psi4.core.get_active_molecule.html
+++ b/sphinxman/master/api/psi4.core.get_active_molecule.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.get_active_molecule.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.get_active_molecule.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.get_array_variable.html b/sphinxman/master/api/psi4.core.get_array_variable.html
index 77c00335062..0153f60149d 100644
--- a/sphinxman/master/api/psi4.core.get_array_variable.html
+++ b/sphinxman/master/api/psi4.core.get_array_variable.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.get_array_variable.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -209,7 +209,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.get_array_variable.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -223,7 +223,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.get_array_variables.html b/sphinxman/master/api/psi4.core.get_array_variables.html
index 1c6c6ddd2d4..5dcb9964f3b 100644
--- a/sphinxman/master/api/psi4.core.get_array_variables.html
+++ b/sphinxman/master/api/psi4.core.get_array_variables.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.get_array_variables.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -209,7 +209,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.get_array_variables.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -223,7 +223,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.get_datadir.html b/sphinxman/master/api/psi4.core.get_datadir.html
index 4341d45d14a..3321dfea986 100644
--- a/sphinxman/master/api/psi4.core.get_datadir.html
+++ b/sphinxman/master/api/psi4.core.get_datadir.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.get_datadir.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.get_datadir.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.get_global_option.html b/sphinxman/master/api/psi4.core.get_global_option.html
index a55505fc3a6..8d362aa189d 100644
--- a/sphinxman/master/api/psi4.core.get_global_option.html
+++ b/sphinxman/master/api/psi4.core.get_global_option.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.get_global_option.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.get_global_option.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.get_global_option_list.html b/sphinxman/master/api/psi4.core.get_global_option_list.html
index daf4e7d39a8..5a7e558b52c 100644
--- a/sphinxman/master/api/psi4.core.get_global_option_list.html
+++ b/sphinxman/master/api/psi4.core.get_global_option_list.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.get_global_option_list.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.get_global_option_list.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.get_local_option.html b/sphinxman/master/api/psi4.core.get_local_option.html
index 37e61bcb9ce..a5ace0d8e30 100644
--- a/sphinxman/master/api/psi4.core.get_local_option.html
+++ b/sphinxman/master/api/psi4.core.get_local_option.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.get_local_option.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.get_local_option.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.get_memory.html b/sphinxman/master/api/psi4.core.get_memory.html
index 9260c9bbf3d..49eb99ec40f 100644
--- a/sphinxman/master/api/psi4.core.get_memory.html
+++ b/sphinxman/master/api/psi4.core.get_memory.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.get_memory.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.get_memory.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.get_num_threads.html b/sphinxman/master/api/psi4.core.get_num_threads.html
index 27692f1af05..5903d7a5558 100644
--- a/sphinxman/master/api/psi4.core.get_num_threads.html
+++ b/sphinxman/master/api/psi4.core.get_num_threads.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.get_num_threads.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.get_num_threads.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.get_option.html b/sphinxman/master/api/psi4.core.get_option.html
index b1022c49c9c..3a43cafff4f 100644
--- a/sphinxman/master/api/psi4.core.get_option.html
+++ b/sphinxman/master/api/psi4.core.get_option.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.get_option.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.get_option.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.get_options.html b/sphinxman/master/api/psi4.core.get_options.html
index d1d08c6ce71..f003f531657 100644
--- a/sphinxman/master/api/psi4.core.get_options.html
+++ b/sphinxman/master/api/psi4.core.get_options.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.get_options.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.get_options.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.get_output_file.html b/sphinxman/master/api/psi4.core.get_output_file.html
index c148cbf185b..cb981fdb4ba 100644
--- a/sphinxman/master/api/psi4.core.get_output_file.html
+++ b/sphinxman/master/api/psi4.core.get_output_file.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.get_output_file.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.get_output_file.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.get_variable.html b/sphinxman/master/api/psi4.core.get_variable.html
index 72d79a2a199..e0502c833ee 100644
--- a/sphinxman/master/api/psi4.core.get_variable.html
+++ b/sphinxman/master/api/psi4.core.get_variable.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.get_variable.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -209,7 +209,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.get_variable.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -223,7 +223,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.get_variables.html b/sphinxman/master/api/psi4.core.get_variables.html
index 16c241c22d6..700a4f85707 100644
--- a/sphinxman/master/api/psi4.core.get_variables.html
+++ b/sphinxman/master/api/psi4.core.get_variables.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.get_variables.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -209,7 +209,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.get_variables.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -223,7 +223,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.get_writer_file_prefix.html b/sphinxman/master/api/psi4.core.get_writer_file_prefix.html
index 2495fc1e0d4..ef5f45cb6df 100644
--- a/sphinxman/master/api/psi4.core.get_writer_file_prefix.html
+++ b/sphinxman/master/api/psi4.core.get_writer_file_prefix.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.get_writer_file_prefix.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.get_writer_file_prefix.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.git_version.html b/sphinxman/master/api/psi4.core.git_version.html
index af86466dea6..3fce4198802 100644
--- a/sphinxman/master/api/psi4.core.git_version.html
+++ b/sphinxman/master/api/psi4.core.git_version.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.git_version.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -206,7 +206,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.git_version.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -220,7 +220,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.has_array_variable.html b/sphinxman/master/api/psi4.core.has_array_variable.html
index 50b58a1d4b4..29b7889461f 100644
--- a/sphinxman/master/api/psi4.core.has_array_variable.html
+++ b/sphinxman/master/api/psi4.core.has_array_variable.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.has_array_variable.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.has_array_variable.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.has_global_option_changed.html b/sphinxman/master/api/psi4.core.has_global_option_changed.html
index 3fd99e67544..9153aedcac1 100644
--- a/sphinxman/master/api/psi4.core.has_global_option_changed.html
+++ b/sphinxman/master/api/psi4.core.has_global_option_changed.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.has_global_option_changed.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.has_global_option_changed.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.has_local_option_changed.html b/sphinxman/master/api/psi4.core.has_local_option_changed.html
index c918fbf4e15..288354338e8 100644
--- a/sphinxman/master/api/psi4.core.has_local_option_changed.html
+++ b/sphinxman/master/api/psi4.core.has_local_option_changed.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.has_local_option_changed.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.has_local_option_changed.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.has_option_changed.html b/sphinxman/master/api/psi4.core.has_option_changed.html
index cd3eda115b5..9eb617f2e99 100644
--- a/sphinxman/master/api/psi4.core.has_option_changed.html
+++ b/sphinxman/master/api/psi4.core.has_option_changed.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.has_option_changed.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.has_option_changed.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.has_scalar_variable.html b/sphinxman/master/api/psi4.core.has_scalar_variable.html
index d85a9af9af6..737d8485c0a 100644
--- a/sphinxman/master/api/psi4.core.has_scalar_variable.html
+++ b/sphinxman/master/api/psi4.core.has_scalar_variable.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.has_scalar_variable.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.has_scalar_variable.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.has_variable.html b/sphinxman/master/api/psi4.core.has_variable.html
index 47a4d506660..8f98dcb68d9 100644
--- a/sphinxman/master/api/psi4.core.has_variable.html
+++ b/sphinxman/master/api/psi4.core.has_variable.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.has_variable.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -213,7 +213,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.has_variable.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -227,7 +227,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.initialize.html b/sphinxman/master/api/psi4.core.initialize.html
index 829cf418bfc..3c83f01442e 100644
--- a/sphinxman/master/api/psi4.core.initialize.html
+++ b/sphinxman/master/api/psi4.core.initialize.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.initialize.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.initialize.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.libint2_solid_harmonics_ordering.html b/sphinxman/master/api/psi4.core.libint2_solid_harmonics_ordering.html
index 7c7b1f1f4bd..6ad39ef5daf 100644
--- a/sphinxman/master/api/psi4.core.libint2_solid_harmonics_ordering.html
+++ b/sphinxman/master/api/psi4.core.libint2_solid_harmonics_ordering.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.libint2_solid_harmonics_ordering.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.libint2_solid_harmonics_ordering.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.mcscf.html b/sphinxman/master/api/psi4.core.mcscf.html
index 964fd04bb78..34a4d458dbd 100644
--- a/sphinxman/master/api/psi4.core.mcscf.html
+++ b/sphinxman/master/api/psi4.core.mcscf.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.mcscf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.mcscf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.mrcc_generate_input.html b/sphinxman/master/api/psi4.core.mrcc_generate_input.html
index ee14b15c309..2706f87c17f 100644
--- a/sphinxman/master/api/psi4.core.mrcc_generate_input.html
+++ b/sphinxman/master/api/psi4.core.mrcc_generate_input.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.mrcc_generate_input.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.mrcc_generate_input.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.mrcc_load_densities.html b/sphinxman/master/api/psi4.core.mrcc_load_densities.html
index 865dbdd1b9c..f0c15c1e4a7 100644
--- a/sphinxman/master/api/psi4.core.mrcc_load_densities.html
+++ b/sphinxman/master/api/psi4.core.mrcc_load_densities.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.mrcc_load_densities.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.mrcc_load_densities.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.occ.html b/sphinxman/master/api/psi4.core.occ.html
index e493334a624..96df95c8ee6 100644
--- a/sphinxman/master/api/psi4.core.occ.html
+++ b/sphinxman/master/api/psi4.core.occ.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.occ.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.occ.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.option_exists_in_module.html b/sphinxman/master/api/psi4.core.option_exists_in_module.html
index a15ab02e919..0f6e6e3f8e3 100644
--- a/sphinxman/master/api/psi4.core.option_exists_in_module.html
+++ b/sphinxman/master/api/psi4.core.option_exists_in_module.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.option_exists_in_module.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.option_exists_in_module.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.options_to_python.html b/sphinxman/master/api/psi4.core.options_to_python.html
index a948a25622f..a7b575389bc 100644
--- a/sphinxman/master/api/psi4.core.options_to_python.html
+++ b/sphinxman/master/api/psi4.core.options_to_python.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.options_to_python.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.options_to_python.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.outfile_name.html b/sphinxman/master/api/psi4.core.outfile_name.html
index b3707c14f74..0dc196a6e65 100644
--- a/sphinxman/master/api/psi4.core.outfile_name.html
+++ b/sphinxman/master/api/psi4.core.outfile_name.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.outfile_name.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.outfile_name.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.plugin.html b/sphinxman/master/api/psi4.core.plugin.html
index 222afadf584..3f5c833aa53 100644
--- a/sphinxman/master/api/psi4.core.plugin.html
+++ b/sphinxman/master/api/psi4.core.plugin.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.plugin.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.plugin.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.plugin_close.html b/sphinxman/master/api/psi4.core.plugin_close.html
index 080f4d477d6..59b58cec682 100644
--- a/sphinxman/master/api/psi4.core.plugin_close.html
+++ b/sphinxman/master/api/psi4.core.plugin_close.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.plugin_close.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.plugin_close.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.plugin_close_all.html b/sphinxman/master/api/psi4.core.plugin_close_all.html
index ac1739d6c4a..74ad99723d4 100644
--- a/sphinxman/master/api/psi4.core.plugin_close_all.html
+++ b/sphinxman/master/api/psi4.core.plugin_close_all.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.plugin_close_all.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.plugin_close_all.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.plugin_load.html b/sphinxman/master/api/psi4.core.plugin_load.html
index acef6523493..9e60c281115 100644
--- a/sphinxman/master/api/psi4.core.plugin_load.html
+++ b/sphinxman/master/api/psi4.core.plugin_load.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.plugin_load.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.plugin_load.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.prepare_options_for_module.html b/sphinxman/master/api/psi4.core.prepare_options_for_module.html
index f7497a65b23..35ed83df0fb 100644
--- a/sphinxman/master/api/psi4.core.prepare_options_for_module.html
+++ b/sphinxman/master/api/psi4.core.prepare_options_for_module.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.prepare_options_for_module.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.prepare_options_for_module.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.print_global_options.html b/sphinxman/master/api/psi4.core.print_global_options.html
index 942bb6c9830..82ec58af82d 100644
--- a/sphinxman/master/api/psi4.core.print_global_options.html
+++ b/sphinxman/master/api/psi4.core.print_global_options.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.print_global_options.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.print_global_options.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.print_options.html b/sphinxman/master/api/psi4.core.print_options.html
index 676993c0581..13fb5471e52 100644
--- a/sphinxman/master/api/psi4.core.print_options.html
+++ b/sphinxman/master/api/psi4.core.print_options.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.print_options.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.print_options.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.print_out.html b/sphinxman/master/api/psi4.core.print_out.html
index 67a68fca582..796602d5dbc 100644
--- a/sphinxman/master/api/psi4.core.print_out.html
+++ b/sphinxman/master/api/psi4.core.print_out.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.print_out.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.print_out.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.print_variables.html b/sphinxman/master/api/psi4.core.print_variables.html
index 0a0316753cc..ed3048936b0 100644
--- a/sphinxman/master/api/psi4.core.print_variables.html
+++ b/sphinxman/master/api/psi4.core.print_variables.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.print_variables.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.print_variables.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.psi_top_srcdir.html b/sphinxman/master/api/psi4.core.psi_top_srcdir.html
index 0fed347f323..15004514e96 100644
--- a/sphinxman/master/api/psi4.core.psi_top_srcdir.html
+++ b/sphinxman/master/api/psi4.core.psi_top_srcdir.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.psi_top_srcdir.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.psi_top_srcdir.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.psimrcc.html b/sphinxman/master/api/psi4.core.psimrcc.html
index e572cda6bd9..e9aab2b5f19 100644
--- a/sphinxman/master/api/psi4.core.psimrcc.html
+++ b/sphinxman/master/api/psi4.core.psimrcc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.psimrcc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.psimrcc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.psio_entry.html b/sphinxman/master/api/psi4.core.psio_entry.html
index a556a6b8189..3db39679b09 100644
--- a/sphinxman/master/api/psi4.core.psio_entry.html
+++ b/sphinxman/master/api/psi4.core.psio_entry.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.psio_entry.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -205,7 +205,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.psio_entry.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -219,7 +219,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.reopen_outfile.html b/sphinxman/master/api/psi4.core.reopen_outfile.html
index 82a462ca29b..e41002ba257 100644
--- a/sphinxman/master/api/psi4.core.reopen_outfile.html
+++ b/sphinxman/master/api/psi4.core.reopen_outfile.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.reopen_outfile.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.reopen_outfile.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.revoke_global_option_changed.html b/sphinxman/master/api/psi4.core.revoke_global_option_changed.html
index 6ff8d3ab781..dfeab6c8780 100644
--- a/sphinxman/master/api/psi4.core.revoke_global_option_changed.html
+++ b/sphinxman/master/api/psi4.core.revoke_global_option_changed.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.revoke_global_option_changed.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.revoke_global_option_changed.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.revoke_local_option_changed.html b/sphinxman/master/api/psi4.core.revoke_local_option_changed.html
index ff86db594d2..2d5361ad6a2 100644
--- a/sphinxman/master/api/psi4.core.revoke_local_option_changed.html
+++ b/sphinxman/master/api/psi4.core.revoke_local_option_changed.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.revoke_local_option_changed.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.revoke_local_option_changed.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.sapt.html b/sphinxman/master/api/psi4.core.sapt.html
index 07b7de53876..d3bd8823513 100644
--- a/sphinxman/master/api/psi4.core.sapt.html
+++ b/sphinxman/master/api/psi4.core.sapt.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.sapt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.sapt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.scalar_variable.html b/sphinxman/master/api/psi4.core.scalar_variable.html
index 8bdf3a7ae76..b48f5ffcd97 100644
--- a/sphinxman/master/api/psi4.core.scalar_variable.html
+++ b/sphinxman/master/api/psi4.core.scalar_variable.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.scalar_variable.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.scalar_variable.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.scalar_variables.html b/sphinxman/master/api/psi4.core.scalar_variables.html
index 15a8ebac09f..7b3519e25a9 100644
--- a/sphinxman/master/api/psi4.core.scalar_variables.html
+++ b/sphinxman/master/api/psi4.core.scalar_variables.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.scalar_variables.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.scalar_variables.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.scatter.html b/sphinxman/master/api/psi4.core.scatter.html
index 108dd6f3b29..668c00ab60f 100644
--- a/sphinxman/master/api/psi4.core.scatter.html
+++ b/sphinxman/master/api/psi4.core.scatter.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.scatter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.scatter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.scfgrad.html b/sphinxman/master/api/psi4.core.scfgrad.html
index 5ea6a573883..929ea636166 100644
--- a/sphinxman/master/api/psi4.core.scfgrad.html
+++ b/sphinxman/master/api/psi4.core.scfgrad.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.scfgrad.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.scfgrad.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.scfhess.html b/sphinxman/master/api/psi4.core.scfhess.html
index 22bf44b03f7..8fe16fee849 100644
--- a/sphinxman/master/api/psi4.core.scfhess.html
+++ b/sphinxman/master/api/psi4.core.scfhess.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.scfhess.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.scfhess.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.set_active_molecule.html b/sphinxman/master/api/psi4.core.set_active_molecule.html
index dc70c5272f0..66a5a5d38fd 100644
--- a/sphinxman/master/api/psi4.core.set_active_molecule.html
+++ b/sphinxman/master/api/psi4.core.set_active_molecule.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.set_active_molecule.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.set_active_molecule.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.set_array_variable.html b/sphinxman/master/api/psi4.core.set_array_variable.html
index 91e5555a24c..05d6955339d 100644
--- a/sphinxman/master/api/psi4.core.set_array_variable.html
+++ b/sphinxman/master/api/psi4.core.set_array_variable.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.set_array_variable.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.set_array_variable.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.set_datadir.html b/sphinxman/master/api/psi4.core.set_datadir.html
index 0768c1057a4..7aa228a27fc 100644
--- a/sphinxman/master/api/psi4.core.set_datadir.html
+++ b/sphinxman/master/api/psi4.core.set_datadir.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.set_datadir.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.set_datadir.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.set_global_option.html b/sphinxman/master/api/psi4.core.set_global_option.html
index 41cb7301ae5..787a8d87b38 100644
--- a/sphinxman/master/api/psi4.core.set_global_option.html
+++ b/sphinxman/master/api/psi4.core.set_global_option.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.set_global_option.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -220,7 +220,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.set_global_option.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -234,7 +234,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.set_global_option_python.html b/sphinxman/master/api/psi4.core.set_global_option_python.html
index 7a046958a26..2e8601a2320 100644
--- a/sphinxman/master/api/psi4.core.set_global_option_python.html
+++ b/sphinxman/master/api/psi4.core.set_global_option_python.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.set_global_option_python.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.set_global_option_python.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.set_local_option.html b/sphinxman/master/api/psi4.core.set_local_option.html
index a89ec92e565..b887320a17a 100644
--- a/sphinxman/master/api/psi4.core.set_local_option.html
+++ b/sphinxman/master/api/psi4.core.set_local_option.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.set_local_option.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -220,7 +220,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.set_local_option.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -234,7 +234,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.set_local_option_python.html b/sphinxman/master/api/psi4.core.set_local_option_python.html
index 5d3ab2546e8..fa34d213ebf 100644
--- a/sphinxman/master/api/psi4.core.set_local_option_python.html
+++ b/sphinxman/master/api/psi4.core.set_local_option_python.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.set_local_option_python.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.set_local_option_python.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.set_memory_bytes.html b/sphinxman/master/api/psi4.core.set_memory_bytes.html
index c568a320b2e..3aca03ea1be 100644
--- a/sphinxman/master/api/psi4.core.set_memory_bytes.html
+++ b/sphinxman/master/api/psi4.core.set_memory_bytes.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.set_memory_bytes.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.set_memory_bytes.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.set_num_threads.html b/sphinxman/master/api/psi4.core.set_num_threads.html
index 1c6b239e01a..9323354dee2 100644
--- a/sphinxman/master/api/psi4.core.set_num_threads.html
+++ b/sphinxman/master/api/psi4.core.set_num_threads.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.set_num_threads.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.set_num_threads.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.set_output_file.html b/sphinxman/master/api/psi4.core.set_output_file.html
index ecdfa3fd2e4..0bb78e907bc 100644
--- a/sphinxman/master/api/psi4.core.set_output_file.html
+++ b/sphinxman/master/api/psi4.core.set_output_file.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.set_output_file.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -209,7 +209,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.set_output_file.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -223,7 +223,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.set_psi_file_prefix.html b/sphinxman/master/api/psi4.core.set_psi_file_prefix.html
index b87362371fc..778e92b849d 100644
--- a/sphinxman/master/api/psi4.core.set_psi_file_prefix.html
+++ b/sphinxman/master/api/psi4.core.set_psi_file_prefix.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.set_psi_file_prefix.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -206,7 +206,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.set_psi_file_prefix.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -220,7 +220,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.set_scalar_variable.html b/sphinxman/master/api/psi4.core.set_scalar_variable.html
index f23f37ae660..af994c7cf4d 100644
--- a/sphinxman/master/api/psi4.core.set_scalar_variable.html
+++ b/sphinxman/master/api/psi4.core.set_scalar_variable.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.set_scalar_variable.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.set_scalar_variable.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.set_variable.html b/sphinxman/master/api/psi4.core.set_variable.html
index 4d4ed48aea6..09c665aaa77 100644
--- a/sphinxman/master/api/psi4.core.set_variable.html
+++ b/sphinxman/master/api/psi4.core.set_variable.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.set_variable.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -223,7 +223,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.set_variable.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -237,7 +237,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.test_matrix_dpd_interface.html b/sphinxman/master/api/psi4.core.test_matrix_dpd_interface.html
index 486299f9f58..44d5890bda8 100644
--- a/sphinxman/master/api/psi4.core.test_matrix_dpd_interface.html
+++ b/sphinxman/master/api/psi4.core.test_matrix_dpd_interface.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.test_matrix_dpd_interface.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -203,7 +203,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.test_matrix_dpd_interface.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -217,7 +217,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.timer_off.html b/sphinxman/master/api/psi4.core.timer_off.html
index 6823f8a9821..8e92e6f3a58 100644
--- a/sphinxman/master/api/psi4.core.timer_off.html
+++ b/sphinxman/master/api/psi4.core.timer_off.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.timer_off.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.timer_off.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.timer_on.html b/sphinxman/master/api/psi4.core.timer_on.html
index 656020e2698..9e009edf5ed 100644
--- a/sphinxman/master/api/psi4.core.timer_on.html
+++ b/sphinxman/master/api/psi4.core.timer_on.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.timer_on.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.timer_on.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.triplet.html b/sphinxman/master/api/psi4.core.triplet.html
index 0089edebc41..f87c9588f49 100644
--- a/sphinxman/master/api/psi4.core.triplet.html
+++ b/sphinxman/master/api/psi4.core.triplet.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.triplet.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -227,7 +227,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.triplet.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -241,7 +241,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.tstart.html b/sphinxman/master/api/psi4.core.tstart.html
index 68454f71b58..e4a341778a2 100644
--- a/sphinxman/master/api/psi4.core.tstart.html
+++ b/sphinxman/master/api/psi4.core.tstart.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.tstart.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.tstart.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.tstop.html b/sphinxman/master/api/psi4.core.tstop.html
index e2b018382ed..d4d73550904 100644
--- a/sphinxman/master/api/psi4.core.tstop.html
+++ b/sphinxman/master/api/psi4.core.tstop.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.tstop.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.tstop.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.variable.html b/sphinxman/master/api/psi4.core.variable.html
index 55d50d6cad7..131800213c0 100644
--- a/sphinxman/master/api/psi4.core.variable.html
+++ b/sphinxman/master/api/psi4.core.variable.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.variable.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -241,7 +241,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.variable.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -255,7 +255,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.variables.html b/sphinxman/master/api/psi4.core.variables.html
index 6b6a47f8cd1..a1ec648d717 100644
--- a/sphinxman/master/api/psi4.core.variables.html
+++ b/sphinxman/master/api/psi4.core.variables.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.variables.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -224,7 +224,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.variables.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -238,7 +238,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.core.version.html b/sphinxman/master/api/psi4.core.version.html
index b69a41828b7..2c057e691ae 100644
--- a/sphinxman/master/api/psi4.core.version.html
+++ b/sphinxman/master/api/psi4.core.version.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.version.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -206,7 +206,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.core.version.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -220,7 +220,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.AtomicComputer.html b/sphinxman/master/api/psi4.driver.AtomicComputer.html
index f89f2b1ba3a..0e9e900c9a8 100644
--- a/sphinxman/master/api/psi4.driver.AtomicComputer.html
+++ b/sphinxman/master/api/psi4.driver.AtomicComputer.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.AtomicComputer.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -581,7 +581,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.AtomicComputer.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -595,7 +595,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.ConvergenceError.html b/sphinxman/master/api/psi4.driver.ConvergenceError.html
index dce1021f00d..86bb472d9b5 100644
--- a/sphinxman/master/api/psi4.driver.ConvergenceError.html
+++ b/sphinxman/master/api/psi4.driver.ConvergenceError.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.ConvergenceError.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -229,7 +229,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.ConvergenceError.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -243,7 +243,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.EmpiricalDispersion.html b/sphinxman/master/api/psi4.driver.EmpiricalDispersion.html
index 9c5f14f8c4d..691cb88660b 100644
--- a/sphinxman/master/api/psi4.driver.EmpiricalDispersion.html
+++ b/sphinxman/master/api/psi4.driver.EmpiricalDispersion.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.EmpiricalDispersion.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -469,7 +469,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.EmpiricalDispersion.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -483,7 +483,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.ManagedMethodError.html b/sphinxman/master/api/psi4.driver.ManagedMethodError.html
index 6760fc91acb..2afbeed3b47 100644
--- a/sphinxman/master/api/psi4.driver.ManagedMethodError.html
+++ b/sphinxman/master/api/psi4.driver.ManagedMethodError.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.ManagedMethodError.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -241,7 +241,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.ManagedMethodError.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -255,7 +255,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.MissingMethodError.html b/sphinxman/master/api/psi4.driver.MissingMethodError.html
index d3c6887b64c..b4081132320 100644
--- a/sphinxman/master/api/psi4.driver.MissingMethodError.html
+++ b/sphinxman/master/api/psi4.driver.MissingMethodError.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.MissingMethodError.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -219,7 +219,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.MissingMethodError.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -233,7 +233,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.OptimizationConvergenceError.html b/sphinxman/master/api/psi4.driver.OptimizationConvergenceError.html
index e18482b2166..23d1afbeb0a 100644
--- a/sphinxman/master/api/psi4.driver.OptimizationConvergenceError.html
+++ b/sphinxman/master/api/psi4.driver.OptimizationConvergenceError.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.OptimizationConvergenceError.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -236,7 +236,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.OptimizationConvergenceError.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -250,7 +250,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.ParsingError.html b/sphinxman/master/api/psi4.driver.ParsingError.html
index b2a28380421..05d84499f9d 100644
--- a/sphinxman/master/api/psi4.driver.ParsingError.html
+++ b/sphinxman/master/api/psi4.driver.ParsingError.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.ParsingError.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -206,7 +206,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.ParsingError.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -220,7 +220,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.PastureRequiredError.html b/sphinxman/master/api/psi4.driver.PastureRequiredError.html
index 0ab9bb2c0c6..f306fc0aa05 100644
--- a/sphinxman/master/api/psi4.driver.PastureRequiredError.html
+++ b/sphinxman/master/api/psi4.driver.PastureRequiredError.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.PastureRequiredError.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -205,7 +205,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.PastureRequiredError.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -219,7 +219,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.PsiException.html b/sphinxman/master/api/psi4.driver.PsiException.html
index ea16ff1c573..2486a73e2a9 100644
--- a/sphinxman/master/api/psi4.driver.PsiException.html
+++ b/sphinxman/master/api/psi4.driver.PsiException.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.PsiException.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.PsiException.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.QMMM.html b/sphinxman/master/api/psi4.driver.QMMM.html
index d30dd2d733b..bac5778a9df 100644
--- a/sphinxman/master/api/psi4.driver.QMMM.html
+++ b/sphinxman/master/api/psi4.driver.QMMM.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.QMMM.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -205,7 +205,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.QMMM.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -219,7 +219,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.QMMMbohr.html b/sphinxman/master/api/psi4.driver.QMMMbohr.html
index 622af911e74..4d38c798b0d 100644
--- a/sphinxman/master/api/psi4.driver.QMMMbohr.html
+++ b/sphinxman/master/api/psi4.driver.QMMMbohr.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.QMMMbohr.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -257,7 +257,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.QMMMbohr.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -271,7 +271,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.SCFConvergenceError.html b/sphinxman/master/api/psi4.driver.SCFConvergenceError.html
index e1e4c0ffa12..8d9cacfda45 100644
--- a/sphinxman/master/api/psi4.driver.SCFConvergenceError.html
+++ b/sphinxman/master/api/psi4.driver.SCFConvergenceError.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.SCFConvergenceError.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -252,7 +252,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.SCFConvergenceError.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -266,7 +266,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.TDSCFConvergenceError.html b/sphinxman/master/api/psi4.driver.TDSCFConvergenceError.html
index bb81d94baa2..069d9e1e523 100644
--- a/sphinxman/master/api/psi4.driver.TDSCFConvergenceError.html
+++ b/sphinxman/master/api/psi4.driver.TDSCFConvergenceError.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.TDSCFConvergenceError.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -265,7 +265,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.TDSCFConvergenceError.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -279,7 +279,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.TestComparisonError.html b/sphinxman/master/api/psi4.driver.TestComparisonError.html
index 6bad935f5c6..ec8109b2fa7 100644
--- a/sphinxman/master/api/psi4.driver.TestComparisonError.html
+++ b/sphinxman/master/api/psi4.driver.TestComparisonError.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.TestComparisonError.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -232,7 +232,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.TestComparisonError.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -246,7 +246,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.UpgradeHelper.html b/sphinxman/master/api/psi4.driver.UpgradeHelper.html
index ddaafa7c2dc..9136e5d4247 100644
--- a/sphinxman/master/api/psi4.driver.UpgradeHelper.html
+++ b/sphinxman/master/api/psi4.driver.UpgradeHelper.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.UpgradeHelper.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -224,7 +224,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.UpgradeHelper.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -238,7 +238,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.ValidationError.html b/sphinxman/master/api/psi4.driver.ValidationError.html
index a6342d020fb..8be8244c502 100644
--- a/sphinxman/master/api/psi4.driver.ValidationError.html
+++ b/sphinxman/master/api/psi4.driver.ValidationError.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.ValidationError.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -219,7 +219,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.ValidationError.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -233,7 +233,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.activate.html b/sphinxman/master/api/psi4.driver.activate.html
index 60773bf7906..1890668e49d 100644
--- a/sphinxman/master/api/psi4.driver.activate.html
+++ b/sphinxman/master/api/psi4.driver.activate.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.activate.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -211,7 +211,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.activate.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -225,7 +225,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.banner.html b/sphinxman/master/api/psi4.driver.banner.html
index 54a0772de6f..db2980ae0b2 100644
--- a/sphinxman/master/api/psi4.driver.banner.html
+++ b/sphinxman/master/api/psi4.driver.banner.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.banner.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -225,7 +225,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.banner.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -239,7 +239,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.basis_helper.html b/sphinxman/master/api/psi4.driver.basis_helper.html
index d44046f5ba7..7cdfe24a063 100644
--- a/sphinxman/master/api/psi4.driver.basis_helper.html
+++ b/sphinxman/master/api/psi4.driver.basis_helper.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.basis_helper.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -219,7 +219,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.basis_helper.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -233,7 +233,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.cbs.html b/sphinxman/master/api/psi4.driver.cbs.html
index 6505eeabdcb..4d7d3559ebe 100644
--- a/sphinxman/master/api/psi4.driver.cbs.html
+++ b/sphinxman/master/api/psi4.driver.cbs.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.cbs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -566,7 +566,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.cbs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -580,7 +580,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.compare_fchkfiles.html b/sphinxman/master/api/psi4.driver.compare_fchkfiles.html
index f1ad532bb0a..9f090da9a83 100644
--- a/sphinxman/master/api/psi4.driver.compare_fchkfiles.html
+++ b/sphinxman/master/api/psi4.driver.compare_fchkfiles.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.compare_fchkfiles.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -225,7 +225,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.compare_fchkfiles.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -239,7 +239,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.compare_fcidumps.html b/sphinxman/master/api/psi4.driver.compare_fcidumps.html
index 8016bfa6fd5..72032b17fea 100644
--- a/sphinxman/master/api/psi4.driver.compare_fcidumps.html
+++ b/sphinxman/master/api/psi4.driver.compare_fcidumps.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.compare_fcidumps.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -228,7 +228,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.compare_fcidumps.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -242,7 +242,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.compare_moldenfiles.html b/sphinxman/master/api/psi4.driver.compare_moldenfiles.html
index 304aa75a6c8..b4eed2e5a60 100644
--- a/sphinxman/master/api/psi4.driver.compare_moldenfiles.html
+++ b/sphinxman/master/api/psi4.driver.compare_moldenfiles.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.compare_moldenfiles.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -220,7 +220,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.compare_moldenfiles.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -234,7 +234,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.copy_file_from_scratch.html b/sphinxman/master/api/psi4.driver.copy_file_from_scratch.html
index 632848ab725..f5d8ac7c982 100644
--- a/sphinxman/master/api/psi4.driver.copy_file_from_scratch.html
+++ b/sphinxman/master/api/psi4.driver.copy_file_from_scratch.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.copy_file_from_scratch.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -227,7 +227,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.copy_file_from_scratch.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -241,7 +241,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.copy_file_to_scratch.html b/sphinxman/master/api/psi4.driver.copy_file_to_scratch.html
index 06074004803..789284b32a7 100644
--- a/sphinxman/master/api/psi4.driver.copy_file_to_scratch.html
+++ b/sphinxman/master/api/psi4.driver.copy_file_to_scratch.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.copy_file_to_scratch.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -227,7 +227,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.copy_file_to_scratch.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -241,7 +241,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.create_plugin.html b/sphinxman/master/api/psi4.driver.create_plugin.html
index 16e388a0d19..3b8ba67e02a 100644
--- a/sphinxman/master/api/psi4.driver.create_plugin.html
+++ b/sphinxman/master/api/psi4.driver.create_plugin.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.create_plugin.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.create_plugin.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -228,7 +228,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.cubeprop.html b/sphinxman/master/api/psi4.driver.cubeprop.html
index 4db08434b26..e931961f3b1 100644
--- a/sphinxman/master/api/psi4.driver.cubeprop.html
+++ b/sphinxman/master/api/psi4.driver.cubeprop.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.cubeprop.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -230,7 +230,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.cubeprop.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -244,7 +244,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.docs_table_link.html b/sphinxman/master/api/psi4.driver.docs_table_link.html
index a534bb864be..1a8b4aa7683 100644
--- a/sphinxman/master/api/psi4.driver.docs_table_link.html
+++ b/sphinxman/master/api/psi4.driver.docs_table_link.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.docs_table_link.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -217,7 +217,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.docs_table_link.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -231,7 +231,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.dynamic_variable_bind.html b/sphinxman/master/api/psi4.driver.dynamic_variable_bind.html
index 6d53c3d6dac..13721ef0609 100644
--- a/sphinxman/master/api/psi4.driver.dynamic_variable_bind.html
+++ b/sphinxman/master/api/psi4.driver.dynamic_variable_bind.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.dynamic_variable_bind.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -205,7 +205,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.dynamic_variable_bind.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -219,7 +219,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.energies_from_fcidump.html b/sphinxman/master/api/psi4.driver.energies_from_fcidump.html
index 592f842be9d..4376bda34ff 100644
--- a/sphinxman/master/api/psi4.driver.energies_from_fcidump.html
+++ b/sphinxman/master/api/psi4.driver.energies_from_fcidump.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.energies_from_fcidump.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -221,7 +221,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.energies_from_fcidump.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -235,7 +235,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.energy.html b/sphinxman/master/api/psi4.driver.energy.html
index 2ffee259efb..851b3340620 100644
--- a/sphinxman/master/api/psi4.driver.energy.html
+++ b/sphinxman/master/api/psi4.driver.energy.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.energy.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -2768,7 +2768,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.energy.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -2782,7 +2782,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.fchk.html b/sphinxman/master/api/psi4.driver.fchk.html
index 664f5df6a74..ade1b6e49ed 100644
--- a/sphinxman/master/api/psi4.driver.fchk.html
+++ b/sphinxman/master/api/psi4.driver.fchk.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.fchk.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -258,7 +258,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.fchk.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -272,7 +272,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.fcidump.html b/sphinxman/master/api/psi4.driver.fcidump.html
index 7da4857258e..5384a3f8da3 100644
--- a/sphinxman/master/api/psi4.driver.fcidump.html
+++ b/sphinxman/master/api/psi4.driver.fcidump.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.fcidump.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -231,7 +231,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.fcidump.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -245,7 +245,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.fcidump_from_file.html b/sphinxman/master/api/psi4.driver.fcidump_from_file.html
index 449df4ecaea..c4e41b6d5e5 100644
--- a/sphinxman/master/api/psi4.driver.fcidump_from_file.html
+++ b/sphinxman/master/api/psi4.driver.fcidump_from_file.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.fcidump_from_file.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -228,7 +228,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.fcidump_from_file.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -242,7 +242,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.find_approximate_string_matches.html b/sphinxman/master/api/psi4.driver.find_approximate_string_matches.html
index 165ef439d6d..5cd2cdb3410 100644
--- a/sphinxman/master/api/psi4.driver.find_approximate_string_matches.html
+++ b/sphinxman/master/api/psi4.driver.find_approximate_string_matches.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.find_approximate_string_matches.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -216,7 +216,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.find_approximate_string_matches.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -230,7 +230,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.freq.html b/sphinxman/master/api/psi4.driver.freq.html
index d9f1c291c8e..5d2c12430ae 100644
--- a/sphinxman/master/api/psi4.driver.freq.html
+++ b/sphinxman/master/api/psi4.driver.freq.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.freq.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -293,7 +293,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.freq.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -307,7 +307,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.frequencies.html b/sphinxman/master/api/psi4.driver.frequencies.html
index 38287805ebb..83f8e0cd964 100644
--- a/sphinxman/master/api/psi4.driver.frequencies.html
+++ b/sphinxman/master/api/psi4.driver.frequencies.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.frequencies.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -293,7 +293,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.frequencies.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -307,7 +307,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.frequency.html b/sphinxman/master/api/psi4.driver.frequency.html
index 8f6136b0084..b895426980d 100644
--- a/sphinxman/master/api/psi4.driver.frequency.html
+++ b/sphinxman/master/api/psi4.driver.frequency.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.frequency.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -293,7 +293,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.frequency.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -307,7 +307,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.gdma.html b/sphinxman/master/api/psi4.driver.gdma.html
index c9149f8f7fb..04aac3658c2 100644
--- a/sphinxman/master/api/psi4.driver.gdma.html
+++ b/sphinxman/master/api/psi4.driver.gdma.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.gdma.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -228,7 +228,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.gdma.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -242,7 +242,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.geometry.html b/sphinxman/master/api/psi4.driver.geometry.html
index 1a8865a2dd4..774dca85a09 100644
--- a/sphinxman/master/api/psi4.driver.geometry.html
+++ b/sphinxman/master/api/psi4.driver.geometry.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.geometry.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.geometry.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -232,7 +232,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.get_memory.html b/sphinxman/master/api/psi4.driver.get_memory.html
index 26a9d71c4d1..7eb0496c115 100644
--- a/sphinxman/master/api/psi4.driver.get_memory.html
+++ b/sphinxman/master/api/psi4.driver.get_memory.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.get_memory.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -209,7 +209,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.get_memory.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -223,7 +223,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.gradient.html b/sphinxman/master/api/psi4.driver.gradient.html
index 99de6b69d52..f92c614581a 100644
--- a/sphinxman/master/api/psi4.driver.gradient.html
+++ b/sphinxman/master/api/psi4.driver.gradient.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.gradient.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -223,7 +223,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.gradient.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -237,7 +237,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.hessian.html b/sphinxman/master/api/psi4.driver.hessian.html
index d7d6195675f..592ca59a5aa 100644
--- a/sphinxman/master/api/psi4.driver.hessian.html
+++ b/sphinxman/master/api/psi4.driver.hessian.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.hessian.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -228,7 +228,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.hessian.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -242,7 +242,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.ipi_broker.html b/sphinxman/master/api/psi4.driver.ipi_broker.html
index ac95e80b050..29fa44b27fd 100644
--- a/sphinxman/master/api/psi4.driver.ipi_broker.html
+++ b/sphinxman/master/api/psi4.driver.ipi_broker.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.ipi_broker.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -217,7 +217,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.ipi_broker.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -231,7 +231,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.levenshtein.html b/sphinxman/master/api/psi4.driver.levenshtein.html
index 83c7b2a255c..5281c03539b 100644
--- a/sphinxman/master/api/psi4.driver.levenshtein.html
+++ b/sphinxman/master/api/psi4.driver.levenshtein.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.levenshtein.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.levenshtein.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -229,7 +229,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.libint2_configuration.html b/sphinxman/master/api/psi4.driver.libint2_configuration.html
index 8ddcda24031..6f74941517e 100644
--- a/sphinxman/master/api/psi4.driver.libint2_configuration.html
+++ b/sphinxman/master/api/psi4.driver.libint2_configuration.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.libint2_configuration.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -216,7 +216,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.libint2_configuration.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -230,7 +230,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.libint2_print_out.html b/sphinxman/master/api/psi4.driver.libint2_print_out.html
index 821f2a33cb5..708d2136df5 100644
--- a/sphinxman/master/api/psi4.driver.libint2_print_out.html
+++ b/sphinxman/master/api/psi4.driver.libint2_print_out.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.libint2_print_out.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -208,7 +208,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.libint2_print_out.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -222,7 +222,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.mdi_run.html b/sphinxman/master/api/psi4.driver.mdi_run.html
index 9ffb7858e18..43553442c3e 100644
--- a/sphinxman/master/api/psi4.driver.mdi_run.html
+++ b/sphinxman/master/api/psi4.driver.mdi_run.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.mdi_run.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.mdi_run.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -228,7 +228,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.message_box.html b/sphinxman/master/api/psi4.driver.message_box.html
index 99f619713b4..ce9b7ca2080 100644
--- a/sphinxman/master/api/psi4.driver.message_box.html
+++ b/sphinxman/master/api/psi4.driver.message_box.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.message_box.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -219,7 +219,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.message_box.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -233,7 +233,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.molden.html b/sphinxman/master/api/psi4.driver.molden.html
index de5419f30d6..b548962e447 100644
--- a/sphinxman/master/api/psi4.driver.molden.html
+++ b/sphinxman/master/api/psi4.driver.molden.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.molden.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -267,7 +267,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.molden.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -281,7 +281,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.molecule_get_attr.html b/sphinxman/master/api/psi4.driver.molecule_get_attr.html
index 23c5cd436e7..a4e290dbf36 100644
--- a/sphinxman/master/api/psi4.driver.molecule_get_attr.html
+++ b/sphinxman/master/api/psi4.driver.molecule_get_attr.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.molecule_get_attr.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.molecule_get_attr.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.molecule_set_attr.html b/sphinxman/master/api/psi4.driver.molecule_set_attr.html
index b85e046ce75..9ff87013e33 100644
--- a/sphinxman/master/api/psi4.driver.molecule_set_attr.html
+++ b/sphinxman/master/api/psi4.driver.molecule_set_attr.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.molecule_set_attr.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.molecule_set_attr.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.oeprop.html b/sphinxman/master/api/psi4.driver.oeprop.html
index 7907e09ce01..f0482a7f7ea 100644
--- a/sphinxman/master/api/psi4.driver.oeprop.html
+++ b/sphinxman/master/api/psi4.driver.oeprop.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.oeprop.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -224,7 +224,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.oeprop.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -238,7 +238,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.opt.html b/sphinxman/master/api/psi4.driver.opt.html
index dbb6845a111..c28204827da 100644
--- a/sphinxman/master/api/psi4.driver.opt.html
+++ b/sphinxman/master/api/psi4.driver.opt.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.opt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1535,7 +1535,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.opt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1549,7 +1549,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.optimize.html b/sphinxman/master/api/psi4.driver.optimize.html
index f4a5efd18a2..260851671ac 100644
--- a/sphinxman/master/api/psi4.driver.optimize.html
+++ b/sphinxman/master/api/psi4.driver.optimize.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.optimize.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1535,7 +1535,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.optimize.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1549,7 +1549,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.optimize_geometric.html b/sphinxman/master/api/psi4.driver.optimize_geometric.html
index 4aec8432867..59f8f05e4eb 100644
--- a/sphinxman/master/api/psi4.driver.optimize_geometric.html
+++ b/sphinxman/master/api/psi4.driver.optimize_geometric.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.optimize_geometric.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -203,7 +203,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.optimize_geometric.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -217,7 +217,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.DIIS.html b/sphinxman/master/api/psi4.driver.p4util.DIIS.html
index 3c4ebffd6e5..698af097630 100644
--- a/sphinxman/master/api/psi4.driver.p4util.DIIS.html
+++ b/sphinxman/master/api/psi4.driver.p4util.DIIS.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.DIIS.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -262,7 +262,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.DIIS.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -276,7 +276,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.Gaussian.html b/sphinxman/master/api/psi4.driver.p4util.Gaussian.html
index a5c4ec83955..7d980c6b989 100644
--- a/sphinxman/master/api/psi4.driver.p4util.Gaussian.html
+++ b/sphinxman/master/api/psi4.driver.p4util.Gaussian.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.Gaussian.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -263,7 +263,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.Gaussian.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -277,7 +277,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.InPsight.html b/sphinxman/master/api/psi4.driver.p4util.InPsight.html
index a3bd1ba34c1..fddb1beb2ef 100644
--- a/sphinxman/master/api/psi4.driver.p4util.InPsight.html
+++ b/sphinxman/master/api/psi4.driver.p4util.InPsight.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.InPsight.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -498,7 +498,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.InPsight.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -512,7 +512,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.Lineshape.html b/sphinxman/master/api/psi4.driver.p4util.Lineshape.html
index 57e38487e3a..b5957fdc5a6 100644
--- a/sphinxman/master/api/psi4.driver.p4util.Lineshape.html
+++ b/sphinxman/master/api/psi4.driver.p4util.Lineshape.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.Lineshape.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -272,7 +272,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.Lineshape.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -286,7 +286,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.Lorentzian.html b/sphinxman/master/api/psi4.driver.p4util.Lorentzian.html
index ae65e2d7641..c7707d6e235 100644
--- a/sphinxman/master/api/psi4.driver.p4util.Lorentzian.html
+++ b/sphinxman/master/api/psi4.driver.p4util.Lorentzian.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.Lorentzian.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -263,7 +263,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.Lorentzian.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -277,7 +277,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.OptionState.html b/sphinxman/master/api/psi4.driver.p4util.OptionState.html
index 0168d9413be..7618df94f6b 100644
--- a/sphinxman/master/api/psi4.driver.p4util.OptionState.html
+++ b/sphinxman/master/api/psi4.driver.p4util.OptionState.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.OptionState.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -241,7 +241,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.OptionState.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -255,7 +255,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.OptionsState.html b/sphinxman/master/api/psi4.driver.p4util.OptionsState.html
index 2ebc736c0e6..ad52e23ee94 100644
--- a/sphinxman/master/api/psi4.driver.p4util.OptionsState.html
+++ b/sphinxman/master/api/psi4.driver.p4util.OptionsState.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.OptionsState.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -259,7 +259,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.OptionsState.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -273,7 +273,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.OptionsStateCM.html b/sphinxman/master/api/psi4.driver.p4util.OptionsStateCM.html
index 0524bcca11b..0c0fbc17ee4 100644
--- a/sphinxman/master/api/psi4.driver.p4util.OptionsStateCM.html
+++ b/sphinxman/master/api/psi4.driver.p4util.OptionsStateCM.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.OptionsStateCM.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -212,7 +212,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.OptionsStateCM.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -226,7 +226,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.SolverEngine.html b/sphinxman/master/api/psi4.driver.p4util.SolverEngine.html
index 122b90fc341..f0ce13e8777 100644
--- a/sphinxman/master/api/psi4.driver.p4util.SolverEngine.html
+++ b/sphinxman/master/api/psi4.driver.p4util.SolverEngine.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.SolverEngine.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -436,7 +436,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.SolverEngine.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -450,7 +450,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.all_casings.html b/sphinxman/master/api/psi4.driver.p4util.all_casings.html
index 1b4ee712841..dcacdc586d3 100644
--- a/sphinxman/master/api/psi4.driver.p4util.all_casings.html
+++ b/sphinxman/master/api/psi4.driver.p4util.all_casings.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.all_casings.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -212,7 +212,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.all_casings.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -226,7 +226,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.array_to_matrix.html b/sphinxman/master/api/psi4.driver.p4util.array_to_matrix.html
index a4914021529..6f04bf9c549 100644
--- a/sphinxman/master/api/psi4.driver.p4util.array_to_matrix.html
+++ b/sphinxman/master/api/psi4.driver.p4util.array_to_matrix.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.array_to_matrix.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -240,7 +240,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.array_to_matrix.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -254,7 +254,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.banner.html b/sphinxman/master/api/psi4.driver.p4util.banner.html
index 60ac9a18fbd..bd69f20f528 100644
--- a/sphinxman/master/api/psi4.driver.p4util.banner.html
+++ b/sphinxman/master/api/psi4.driver.p4util.banner.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.banner.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -225,7 +225,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.banner.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -239,7 +239,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.basis_helper.html b/sphinxman/master/api/psi4.driver.p4util.basis_helper.html
index 6b501b8611a..e8693977b5f 100644
--- a/sphinxman/master/api/psi4.driver.p4util.basis_helper.html
+++ b/sphinxman/master/api/psi4.driver.p4util.basis_helper.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.basis_helper.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -219,7 +219,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.basis_helper.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -233,7 +233,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.block_diagonal_array.html b/sphinxman/master/api/psi4.driver.p4util.block_diagonal_array.html
index 9f64bde315e..5458582f7d4 100644
--- a/sphinxman/master/api/psi4.driver.p4util.block_diagonal_array.html
+++ b/sphinxman/master/api/psi4.driver.p4util.block_diagonal_array.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.block_diagonal_array.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -212,7 +212,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.block_diagonal_array.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -226,7 +226,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.cg_solver.html b/sphinxman/master/api/psi4.driver.p4util.cg_solver.html
index d0492fdcee0..c23c547274c 100644
--- a/sphinxman/master/api/psi4.driver.p4util.cg_solver.html
+++ b/sphinxman/master/api/psi4.driver.p4util.cg_solver.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.cg_solver.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -228,7 +228,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.cg_solver.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -242,7 +242,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.compare_fchkfiles.html b/sphinxman/master/api/psi4.driver.p4util.compare_fchkfiles.html
index f55302ce442..7d7e1860135 100644
--- a/sphinxman/master/api/psi4.driver.p4util.compare_fchkfiles.html
+++ b/sphinxman/master/api/psi4.driver.p4util.compare_fchkfiles.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.compare_fchkfiles.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -225,7 +225,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.compare_fchkfiles.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -239,7 +239,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.compare_fcidumps.html b/sphinxman/master/api/psi4.driver.p4util.compare_fcidumps.html
index b2da8ca2753..10a01fd8269 100644
--- a/sphinxman/master/api/psi4.driver.p4util.compare_fcidumps.html
+++ b/sphinxman/master/api/psi4.driver.p4util.compare_fcidumps.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.compare_fcidumps.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -228,7 +228,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.compare_fcidumps.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -242,7 +242,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.compare_moldenfiles.html b/sphinxman/master/api/psi4.driver.p4util.compare_moldenfiles.html
index 1cf3389a3f9..2d46e855507 100644
--- a/sphinxman/master/api/psi4.driver.p4util.compare_moldenfiles.html
+++ b/sphinxman/master/api/psi4.driver.p4util.compare_moldenfiles.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.compare_moldenfiles.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -220,7 +220,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.compare_moldenfiles.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -234,7 +234,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.copy_file_from_scratch.html b/sphinxman/master/api/psi4.driver.p4util.copy_file_from_scratch.html
index 1ee23ad9d83..1f85af9cf1c 100644
--- a/sphinxman/master/api/psi4.driver.p4util.copy_file_from_scratch.html
+++ b/sphinxman/master/api/psi4.driver.p4util.copy_file_from_scratch.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.copy_file_from_scratch.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -227,7 +227,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.copy_file_from_scratch.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -241,7 +241,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.copy_file_to_scratch.html b/sphinxman/master/api/psi4.driver.p4util.copy_file_to_scratch.html
index bcf4b7ded6d..3216717e07b 100644
--- a/sphinxman/master/api/psi4.driver.p4util.copy_file_to_scratch.html
+++ b/sphinxman/master/api/psi4.driver.p4util.copy_file_to_scratch.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.copy_file_to_scratch.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -227,7 +227,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.copy_file_to_scratch.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -241,7 +241,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.cubeprop.html b/sphinxman/master/api/psi4.driver.p4util.cubeprop.html
index b21066887b6..876d16ae463 100644
--- a/sphinxman/master/api/psi4.driver.p4util.cubeprop.html
+++ b/sphinxman/master/api/psi4.driver.p4util.cubeprop.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.cubeprop.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -230,7 +230,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.cubeprop.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -244,7 +244,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.davidson_solver.html b/sphinxman/master/api/psi4.driver.p4util.davidson_solver.html
index edeaf2980dd..8921167f882 100644
--- a/sphinxman/master/api/psi4.driver.p4util.davidson_solver.html
+++ b/sphinxman/master/api/psi4.driver.p4util.davidson_solver.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.davidson_solver.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -254,7 +254,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.davidson_solver.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -268,7 +268,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.docs_table_link.html b/sphinxman/master/api/psi4.driver.p4util.docs_table_link.html
index ba608e6501e..ea28a3bfd4c 100644
--- a/sphinxman/master/api/psi4.driver.p4util.docs_table_link.html
+++ b/sphinxman/master/api/psi4.driver.p4util.docs_table_link.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.docs_table_link.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -217,7 +217,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.docs_table_link.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -231,7 +231,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.drop_duplicates.html b/sphinxman/master/api/psi4.driver.p4util.drop_duplicates.html
index e3fddb5ce98..f83f01f1af8 100644
--- a/sphinxman/master/api/psi4.driver.p4util.drop_duplicates.html
+++ b/sphinxman/master/api/psi4.driver.p4util.drop_duplicates.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.drop_duplicates.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -213,7 +213,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.drop_duplicates.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -227,7 +227,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.energies_from_fcidump.html b/sphinxman/master/api/psi4.driver.p4util.energies_from_fcidump.html
index 406a2d5587a..ac324fe3156 100644
--- a/sphinxman/master/api/psi4.driver.p4util.energies_from_fcidump.html
+++ b/sphinxman/master/api/psi4.driver.p4util.energies_from_fcidump.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.energies_from_fcidump.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -221,7 +221,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.energies_from_fcidump.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -235,7 +235,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.expand_psivars.html b/sphinxman/master/api/psi4.driver.p4util.expand_psivars.html
index 534924e2e6f..3313bf3b168 100644
--- a/sphinxman/master/api/psi4.driver.p4util.expand_psivars.html
+++ b/sphinxman/master/api/psi4.driver.p4util.expand_psivars.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.expand_psivars.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -225,7 +225,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.expand_psivars.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -239,7 +239,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.fcidump.html b/sphinxman/master/api/psi4.driver.p4util.fcidump.html
index 6fb08a5ed1d..1c5a4afa8d0 100644
--- a/sphinxman/master/api/psi4.driver.p4util.fcidump.html
+++ b/sphinxman/master/api/psi4.driver.p4util.fcidump.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.fcidump.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -231,7 +231,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.fcidump.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -245,7 +245,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.fcidump_from_file.html b/sphinxman/master/api/psi4.driver.p4util.fcidump_from_file.html
index 28e12ac34d7..ca3aabbab40 100644
--- a/sphinxman/master/api/psi4.driver.p4util.fcidump_from_file.html
+++ b/sphinxman/master/api/psi4.driver.p4util.fcidump_from_file.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.fcidump_from_file.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -228,7 +228,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.fcidump_from_file.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -242,7 +242,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.find_approximate_string_matches.html b/sphinxman/master/api/psi4.driver.p4util.find_approximate_string_matches.html
index 4c042eb083d..fa8bf54c78e 100644
--- a/sphinxman/master/api/psi4.driver.p4util.find_approximate_string_matches.html
+++ b/sphinxman/master/api/psi4.driver.p4util.find_approximate_string_matches.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.find_approximate_string_matches.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -216,7 +216,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.find_approximate_string_matches.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -230,7 +230,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.format_molecule_for_input.html b/sphinxman/master/api/psi4.driver.p4util.format_molecule_for_input.html
index ba3508a2bf8..5e11bab8678 100644
--- a/sphinxman/master/api/psi4.driver.p4util.format_molecule_for_input.html
+++ b/sphinxman/master/api/psi4.driver.p4util.format_molecule_for_input.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.format_molecule_for_input.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -223,7 +223,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.format_molecule_for_input.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -237,7 +237,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.format_options_for_input.html b/sphinxman/master/api/psi4.driver.p4util.format_options_for_input.html
index 3d8d1088606..b3f472ee071 100644
--- a/sphinxman/master/api/psi4.driver.p4util.format_options_for_input.html
+++ b/sphinxman/master/api/psi4.driver.p4util.format_options_for_input.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.format_options_for_input.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -222,7 +222,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.format_options_for_input.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -236,7 +236,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.free_atom_volumes.html b/sphinxman/master/api/psi4.driver.p4util.free_atom_volumes.html
index 578ba672d10..b7e993a8468 100644
--- a/sphinxman/master/api/psi4.driver.p4util.free_atom_volumes.html
+++ b/sphinxman/master/api/psi4.driver.p4util.free_atom_volumes.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.free_atom_volumes.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.free_atom_volumes.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -229,7 +229,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.get_memory.html b/sphinxman/master/api/psi4.driver.p4util.get_memory.html
index 824fd889ea7..5c5049e6ef3 100644
--- a/sphinxman/master/api/psi4.driver.p4util.get_memory.html
+++ b/sphinxman/master/api/psi4.driver.p4util.get_memory.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.get_memory.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -209,7 +209,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.get_memory.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -223,7 +223,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.get_psifile.html b/sphinxman/master/api/psi4.driver.p4util.get_psifile.html
index 274eb068397..caa69c1c357 100644
--- a/sphinxman/master/api/psi4.driver.p4util.get_psifile.html
+++ b/sphinxman/master/api/psi4.driver.p4util.get_psifile.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.get_psifile.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -124,7 +124,7 @@ <h3>Navigation</h3>
 <h1>get_psifile<a class="headerlink" href="#get-psifile" title="Link to this heading">¶</a></h1>
 <dl class="py function">
 <dt class="sig sig-object py" id="psi4.driver.p4util.get_psifile">
-<span class="sig-prename descclassname"><span class="pre">psi4.driver.p4util.</span></span><span class="sig-name descname"><span class="pre">get_psifile</span></span><span class="sig-paren">(</span><em class="sig-param"><span class="n"><span class="pre">fileno</span></span></em>, <em class="sig-param"><span class="n"><span class="pre">pidspace</span></span><span class="o"><span class="pre">=</span></span><span class="default_value"><span class="pre">'11528'</span></span></em><span class="sig-paren">)</span><a class="reference internal" href="../_modules/psi4/driver/p4util/procutil.html#get_psifile"><span class="viewcode-link"><span class="pre">[source]</span></span></a><a class="headerlink" href="#psi4.driver.p4util.get_psifile" title="Link to this definition">¶</a></dt>
+<span class="sig-prename descclassname"><span class="pre">psi4.driver.p4util.</span></span><span class="sig-name descname"><span class="pre">get_psifile</span></span><span class="sig-paren">(</span><em class="sig-param"><span class="n"><span class="pre">fileno</span></span></em>, <em class="sig-param"><span class="n"><span class="pre">pidspace</span></span><span class="o"><span class="pre">=</span></span><span class="default_value"><span class="pre">'11659'</span></span></em><span class="sig-paren">)</span><a class="reference internal" href="../_modules/psi4/driver/p4util/procutil.html#get_psifile"><span class="viewcode-link"><span class="pre">[source]</span></span></a><a class="headerlink" href="#psi4.driver.p4util.get_psifile" title="Link to this definition">¶</a></dt>
 <dd><p>Form full path and filename for psi scratch file.</p>
 <dl class="field-list simple">
 <dt class="field-odd">Parameters<span class="colon">:</span></dt>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.get_psifile.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -232,7 +232,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.getattr_ignorecase.html b/sphinxman/master/api/psi4.driver.p4util.getattr_ignorecase.html
index 0156df477bc..c0030d6f71d 100644
--- a/sphinxman/master/api/psi4.driver.p4util.getattr_ignorecase.html
+++ b/sphinxman/master/api/psi4.driver.p4util.getattr_ignorecase.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.getattr_ignorecase.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -219,7 +219,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.getattr_ignorecase.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -233,7 +233,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.hamiltonian_solver.html b/sphinxman/master/api/psi4.driver.p4util.hamiltonian_solver.html
index ce4ada7d423..1f425b90d74 100644
--- a/sphinxman/master/api/psi4.driver.p4util.hamiltonian_solver.html
+++ b/sphinxman/master/api/psi4.driver.p4util.hamiltonian_solver.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.hamiltonian_solver.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -270,7 +270,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.hamiltonian_solver.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -284,7 +284,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.hold_options_state.html b/sphinxman/master/api/psi4.driver.p4util.hold_options_state.html
index 52df4834f68..344e11ebf1f 100644
--- a/sphinxman/master/api/psi4.driver.p4util.hold_options_state.html
+++ b/sphinxman/master/api/psi4.driver.p4util.hold_options_state.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.hold_options_state.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -211,7 +211,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.hold_options_state.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -225,7 +225,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.import_ignorecase.html b/sphinxman/master/api/psi4.driver.p4util.import_ignorecase.html
index ef737edd310..6aee9a3bcff 100644
--- a/sphinxman/master/api/psi4.driver.p4util.import_ignorecase.html
+++ b/sphinxman/master/api/psi4.driver.p4util.import_ignorecase.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.import_ignorecase.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.import_ignorecase.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -229,7 +229,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.kwargs_lower.html b/sphinxman/master/api/psi4.driver.p4util.kwargs_lower.html
index 83faa0d98bc..67cdc7cbaeb 100644
--- a/sphinxman/master/api/psi4.driver.p4util.kwargs_lower.html
+++ b/sphinxman/master/api/psi4.driver.p4util.kwargs_lower.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.kwargs_lower.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -217,7 +217,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.kwargs_lower.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -231,7 +231,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.levenshtein.html b/sphinxman/master/api/psi4.driver.p4util.levenshtein.html
index 2932abeb71f..4153f23c0e0 100644
--- a/sphinxman/master/api/psi4.driver.p4util.levenshtein.html
+++ b/sphinxman/master/api/psi4.driver.p4util.levenshtein.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.levenshtein.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.levenshtein.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -229,7 +229,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.libint2_configuration.html b/sphinxman/master/api/psi4.driver.p4util.libint2_configuration.html
index 4246c384765..e77d4a2297b 100644
--- a/sphinxman/master/api/psi4.driver.p4util.libint2_configuration.html
+++ b/sphinxman/master/api/psi4.driver.p4util.libint2_configuration.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.libint2_configuration.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -216,7 +216,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.libint2_configuration.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -230,7 +230,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.libint2_print_out.html b/sphinxman/master/api/psi4.driver.p4util.libint2_print_out.html
index 08df44d8590..64800b79c98 100644
--- a/sphinxman/master/api/psi4.driver.p4util.libint2_print_out.html
+++ b/sphinxman/master/api/psi4.driver.p4util.libint2_print_out.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.libint2_print_out.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -208,7 +208,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.libint2_print_out.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -222,7 +222,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.mat2arr.html b/sphinxman/master/api/psi4.driver.p4util.mat2arr.html
index b2515febd8d..88d671c49f3 100644
--- a/sphinxman/master/api/psi4.driver.p4util.mat2arr.html
+++ b/sphinxman/master/api/psi4.driver.p4util.mat2arr.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.mat2arr.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.mat2arr.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -229,7 +229,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.message_box.html b/sphinxman/master/api/psi4.driver.p4util.message_box.html
index 45fb02a7add..6850a42d9dc 100644
--- a/sphinxman/master/api/psi4.driver.p4util.message_box.html
+++ b/sphinxman/master/api/psi4.driver.p4util.message_box.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.message_box.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -219,7 +219,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.message_box.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -233,7 +233,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.oeprop.html b/sphinxman/master/api/psi4.driver.p4util.oeprop.html
index 40284ae329e..921dc6e34b0 100644
--- a/sphinxman/master/api/psi4.driver.p4util.oeprop.html
+++ b/sphinxman/master/api/psi4.driver.p4util.oeprop.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.oeprop.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -224,7 +224,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.oeprop.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -238,7 +238,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.pcm_helper.html b/sphinxman/master/api/psi4.driver.p4util.pcm_helper.html
index 3f089f4a864..a1966cb98f1 100644
--- a/sphinxman/master/api/psi4.driver.p4util.pcm_helper.html
+++ b/sphinxman/master/api/psi4.driver.p4util.pcm_helper.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.pcm_helper.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -210,7 +210,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.pcm_helper.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -224,7 +224,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.plump_qcvar.html b/sphinxman/master/api/psi4.driver.p4util.plump_qcvar.html
index a220625f30c..2fbae10f747 100644
--- a/sphinxman/master/api/psi4.driver.p4util.plump_qcvar.html
+++ b/sphinxman/master/api/psi4.driver.p4util.plump_qcvar.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.plump_qcvar.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -221,7 +221,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.plump_qcvar.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -235,7 +235,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.prefactor_ecd.html b/sphinxman/master/api/psi4.driver.p4util.prefactor_ecd.html
index 507fb62e7e0..c502ff89630 100644
--- a/sphinxman/master/api/psi4.driver.p4util.prefactor_ecd.html
+++ b/sphinxman/master/api/psi4.driver.p4util.prefactor_ecd.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.prefactor_ecd.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -219,7 +219,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.prefactor_ecd.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -233,7 +233,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.prefactor_opa.html b/sphinxman/master/api/psi4.driver.p4util.prefactor_opa.html
index 13ccd34c282..e4377c2ae3a 100644
--- a/sphinxman/master/api/psi4.driver.p4util.prefactor_opa.html
+++ b/sphinxman/master/api/psi4.driver.p4util.prefactor_opa.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.prefactor_opa.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -219,7 +219,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.prefactor_opa.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -233,7 +233,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.prepare_options_for_modules.html b/sphinxman/master/api/psi4.driver.p4util.prepare_options_for_modules.html
index e23edd15481..6cf48798000 100644
--- a/sphinxman/master/api/psi4.driver.p4util.prepare_options_for_modules.html
+++ b/sphinxman/master/api/psi4.driver.p4util.prepare_options_for_modules.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.prepare_options_for_modules.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -241,7 +241,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.prepare_options_for_modules.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -255,7 +255,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.prepare_options_for_set_options.html b/sphinxman/master/api/psi4.driver.p4util.prepare_options_for_set_options.html
index f7336347bca..9b9b4cf5a4f 100644
--- a/sphinxman/master/api/psi4.driver.p4util.prepare_options_for_set_options.html
+++ b/sphinxman/master/api/psi4.driver.p4util.prepare_options_for_set_options.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.prepare_options_for_set_options.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.prepare_options_for_set_options.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -229,7 +229,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.provenance_stamp.html b/sphinxman/master/api/psi4.driver.p4util.provenance_stamp.html
index d46622ac55c..01a2dd53b03 100644
--- a/sphinxman/master/api/psi4.driver.p4util.provenance_stamp.html
+++ b/sphinxman/master/api/psi4.driver.p4util.provenance_stamp.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.provenance_stamp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -220,7 +220,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.provenance_stamp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -234,7 +234,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.sanitize_method.html b/sphinxman/master/api/psi4.driver.p4util.sanitize_method.html
index 5b795b14344..f079987b9fe 100644
--- a/sphinxman/master/api/psi4.driver.p4util.sanitize_method.html
+++ b/sphinxman/master/api/psi4.driver.p4util.sanitize_method.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.sanitize_method.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -213,7 +213,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.sanitize_method.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -227,7 +227,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.set_memory.html b/sphinxman/master/api/psi4.driver.p4util.set_memory.html
index 89b21885d50..983ee2d886d 100644
--- a/sphinxman/master/api/psi4.driver.p4util.set_memory.html
+++ b/sphinxman/master/api/psi4.driver.p4util.set_memory.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.set_memory.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -258,7 +258,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.set_memory.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -272,7 +272,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.set_module_options.html b/sphinxman/master/api/psi4.driver.p4util.set_module_options.html
index 4b61119f823..6bf37ffee41 100644
--- a/sphinxman/master/api/psi4.driver.p4util.set_module_options.html
+++ b/sphinxman/master/api/psi4.driver.p4util.set_module_options.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.set_module_options.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -219,7 +219,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.set_module_options.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -233,7 +233,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.set_options.html b/sphinxman/master/api/psi4.driver.p4util.set_options.html
index 6db45bbe0c0..674be048fa3 100644
--- a/sphinxman/master/api/psi4.driver.p4util.set_options.html
+++ b/sphinxman/master/api/psi4.driver.p4util.set_options.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.set_options.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -230,7 +230,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.set_options.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -244,7 +244,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.spectrum.html b/sphinxman/master/api/psi4.driver.p4util.spectrum.html
index 2e5f8d685db..0237b3d623c 100644
--- a/sphinxman/master/api/psi4.driver.p4util.spectrum.html
+++ b/sphinxman/master/api/psi4.driver.p4util.spectrum.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.spectrum.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -281,7 +281,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.spectrum.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -295,7 +295,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.p4util.state_to_atomicinput.html b/sphinxman/master/api/psi4.driver.p4util.state_to_atomicinput.html
index 567c0ffb031..0ea702b7312 100644
--- a/sphinxman/master/api/psi4.driver.p4util.state_to_atomicinput.html
+++ b/sphinxman/master/api/psi4.driver.p4util.state_to_atomicinput.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.state_to_atomicinput.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -223,7 +223,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.p4util.state_to_atomicinput.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -237,7 +237,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.pcm_helper.html b/sphinxman/master/api/psi4.driver.pcm_helper.html
index 0d9852cb385..6259b165040 100644
--- a/sphinxman/master/api/psi4.driver.pcm_helper.html
+++ b/sphinxman/master/api/psi4.driver.pcm_helper.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.pcm_helper.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -210,7 +210,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.pcm_helper.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -224,7 +224,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.process_input.html b/sphinxman/master/api/psi4.driver.process_input.html
index 2e108451d39..4cd6beb1ec8 100644
--- a/sphinxman/master/api/psi4.driver.process_input.html
+++ b/sphinxman/master/api/psi4.driver.process_input.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.process_input.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -220,7 +220,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.process_input.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -234,7 +234,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.prop.html b/sphinxman/master/api/psi4.driver.prop.html
index f8acbc119a2..60dc732bb10 100644
--- a/sphinxman/master/api/psi4.driver.prop.html
+++ b/sphinxman/master/api/psi4.driver.prop.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.prop.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -348,7 +348,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.prop.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -362,7 +362,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.properties.html b/sphinxman/master/api/psi4.driver.properties.html
index 333b9b3080e..46d8e3e578e 100644
--- a/sphinxman/master/api/psi4.driver.properties.html
+++ b/sphinxman/master/api/psi4.driver.properties.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.properties.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -348,7 +348,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.properties.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -362,7 +362,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.qcdb.vib.compare_vibinfos.html b/sphinxman/master/api/psi4.driver.qcdb.vib.compare_vibinfos.html
index 911dc6236b5..eeabfbb2d33 100644
--- a/sphinxman/master/api/psi4.driver.qcdb.vib.compare_vibinfos.html
+++ b/sphinxman/master/api/psi4.driver.qcdb.vib.compare_vibinfos.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.qcdb.vib.compare_vibinfos.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -225,7 +225,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.qcdb.vib.compare_vibinfos.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -240,7 +240,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.qcdb.vib.filter_nonvib.html b/sphinxman/master/api/psi4.driver.qcdb.vib.filter_nonvib.html
index ea59e86b7c5..d4ed53abbf2 100644
--- a/sphinxman/master/api/psi4.driver.qcdb.vib.filter_nonvib.html
+++ b/sphinxman/master/api/psi4.driver.qcdb.vib.filter_nonvib.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.qcdb.vib.filter_nonvib.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -229,7 +229,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.qcdb.vib.filter_nonvib.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -244,7 +244,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.qcdb.vib.filter_omega_to_real.html b/sphinxman/master/api/psi4.driver.qcdb.vib.filter_omega_to_real.html
index a0621df07a3..82d08f2a9cb 100644
--- a/sphinxman/master/api/psi4.driver.qcdb.vib.filter_omega_to_real.html
+++ b/sphinxman/master/api/psi4.driver.qcdb.vib.filter_omega_to_real.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.qcdb.vib.filter_omega_to_real.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -213,7 +213,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.qcdb.vib.filter_omega_to_real.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -228,7 +228,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.qcdb.vib.harmonic_analysis.html b/sphinxman/master/api/psi4.driver.qcdb.vib.harmonic_analysis.html
index 1fdab57ebfa..f813e88f042 100644
--- a/sphinxman/master/api/psi4.driver.qcdb.vib.harmonic_analysis.html
+++ b/sphinxman/master/api/psi4.driver.qcdb.vib.harmonic_analysis.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.qcdb.vib.harmonic_analysis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -317,7 +317,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.qcdb.vib.harmonic_analysis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -332,7 +332,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.qcdb.vib.hessian_symmetrize.html b/sphinxman/master/api/psi4.driver.qcdb.vib.hessian_symmetrize.html
index de91abfedaf..6fbd3851901 100644
--- a/sphinxman/master/api/psi4.driver.qcdb.vib.hessian_symmetrize.html
+++ b/sphinxman/master/api/psi4.driver.qcdb.vib.hessian_symmetrize.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.qcdb.vib.hessian_symmetrize.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -219,7 +219,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.qcdb.vib.hessian_symmetrize.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -234,7 +234,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.qcdb.vib.print_molden_vibs.html b/sphinxman/master/api/psi4.driver.qcdb.vib.print_molden_vibs.html
index 6261965c817..b1ff4b3c435 100644
--- a/sphinxman/master/api/psi4.driver.qcdb.vib.print_molden_vibs.html
+++ b/sphinxman/master/api/psi4.driver.qcdb.vib.print_molden_vibs.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.qcdb.vib.print_molden_vibs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -225,7 +225,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.qcdb.vib.print_molden_vibs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -240,7 +240,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.qcdb.vib.print_vibs.html b/sphinxman/master/api/psi4.driver.qcdb.vib.print_vibs.html
index 1347c57158d..0df4048604a 100644
--- a/sphinxman/master/api/psi4.driver.qcdb.vib.print_vibs.html
+++ b/sphinxman/master/api/psi4.driver.qcdb.vib.print_vibs.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.qcdb.vib.print_vibs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -233,7 +233,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.qcdb.vib.print_vibs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -248,7 +248,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.qcdb.vib.thermo.html b/sphinxman/master/api/psi4.driver.qcdb.vib.thermo.html
index 0cfc3b85662..e054215c573 100644
--- a/sphinxman/master/api/psi4.driver.qcdb.vib.thermo.html
+++ b/sphinxman/master/api/psi4.driver.qcdb.vib.thermo.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.qcdb.vib.thermo.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -226,7 +226,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.qcdb.vib.thermo.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -241,7 +241,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.sanitize_method.html b/sphinxman/master/api/psi4.driver.sanitize_method.html
index 981f163f813..8bb3cd2f63a 100644
--- a/sphinxman/master/api/psi4.driver.sanitize_method.html
+++ b/sphinxman/master/api/psi4.driver.sanitize_method.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.sanitize_method.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -213,7 +213,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.sanitize_method.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -227,7 +227,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.sanitize_name.html b/sphinxman/master/api/psi4.driver.sanitize_name.html
index 0a20c5cfd54..703d1af8d85 100644
--- a/sphinxman/master/api/psi4.driver.sanitize_name.html
+++ b/sphinxman/master/api/psi4.driver.sanitize_name.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.sanitize_name.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -216,7 +216,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.sanitize_name.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -230,7 +230,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.scf_helper.html b/sphinxman/master/api/psi4.driver.scf_helper.html
index 3bccec2cbe1..a43b8527597 100644
--- a/sphinxman/master/api/psi4.driver.scf_helper.html
+++ b/sphinxman/master/api/psi4.driver.scf_helper.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.scf_helper.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -209,7 +209,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.scf_helper.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -223,7 +223,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.scf_wavefunction_factory.html b/sphinxman/master/api/psi4.driver.scf_wavefunction_factory.html
index f4caad3727c..295a242242a 100644
--- a/sphinxman/master/api/psi4.driver.scf_wavefunction_factory.html
+++ b/sphinxman/master/api/psi4.driver.scf_wavefunction_factory.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.scf_wavefunction_factory.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -206,7 +206,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.scf_wavefunction_factory.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -220,7 +220,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.set_memory.html b/sphinxman/master/api/psi4.driver.set_memory.html
index d57d6a1118d..9e6607334f2 100644
--- a/sphinxman/master/api/psi4.driver.set_memory.html
+++ b/sphinxman/master/api/psi4.driver.set_memory.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.set_memory.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -258,7 +258,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.set_memory.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -272,7 +272,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.set_module_options.html b/sphinxman/master/api/psi4.driver.set_module_options.html
index 5fcc1050469..0564f056a32 100644
--- a/sphinxman/master/api/psi4.driver.set_module_options.html
+++ b/sphinxman/master/api/psi4.driver.set_module_options.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.set_module_options.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -219,7 +219,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.set_module_options.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -233,7 +233,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.set_options.html b/sphinxman/master/api/psi4.driver.set_options.html
index 054a478904d..374dc512509 100644
--- a/sphinxman/master/api/psi4.driver.set_options.html
+++ b/sphinxman/master/api/psi4.driver.set_options.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.set_options.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -230,7 +230,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.set_options.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -244,7 +244,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.tdscf.html b/sphinxman/master/api/psi4.driver.tdscf.html
index 17e21659635..f7ae76bb3b8 100644
--- a/sphinxman/master/api/psi4.driver.tdscf.html
+++ b/sphinxman/master/api/psi4.driver.tdscf.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.tdscf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -203,7 +203,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.tdscf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -217,7 +217,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/api/psi4.driver.vibanal_wfn.html b/sphinxman/master/api/psi4.driver.vibanal_wfn.html
index 5f6977df1c7..551a1a15203 100644
--- a/sphinxman/master/api/psi4.driver.vibanal_wfn.html
+++ b/sphinxman/master/api/psi4.driver.vibanal_wfn.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.vibanal_wfn.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -228,7 +228,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/api/psi4.driver.vibanal_wfn.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -242,7 +242,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/appendices.html b/sphinxman/master/appendices.html
index 4214b113978..3a9f328223d 100644
--- a/sphinxman/master/appendices.html
+++ b/sphinxman/master/appendices.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/appendices.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -335,7 +335,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/appendices.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -348,7 +348,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/adc__cutoff_amps_print.html b/sphinxman/master/autodir_options_c/adc__cutoff_amps_print.html
index 29eb10c2006..23f095a222d 100644
--- a/sphinxman/master/autodir_options_c/adc__cutoff_amps_print.html
+++ b/sphinxman/master/autodir_options_c/adc__cutoff_amps_print.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/adc__cutoff_amps_print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/adc__cutoff_amps_print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/adc__gauge.html b/sphinxman/master/autodir_options_c/adc__gauge.html
index 7045ed0f66d..0e350a72a3a 100644
--- a/sphinxman/master/autodir_options_c/adc__gauge.html
+++ b/sphinxman/master/autodir_options_c/adc__gauge.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/adc__gauge.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/adc__gauge.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/adc__kind.html b/sphinxman/master/autodir_options_c/adc__kind.html
index d7f8bd0a3fb..0feb2a4ae56 100644
--- a/sphinxman/master/autodir_options_c/adc__kind.html
+++ b/sphinxman/master/autodir_options_c/adc__kind.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/adc__kind.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/adc__kind.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/adc__max_num_vecs.html b/sphinxman/master/autodir_options_c/adc__max_num_vecs.html
index a8c3587baae..7edd198f821 100644
--- a/sphinxman/master/autodir_options_c/adc__max_num_vecs.html
+++ b/sphinxman/master/autodir_options_c/adc__max_num_vecs.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/adc__max_num_vecs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/adc__max_num_vecs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/adc__maxiter.html b/sphinxman/master/autodir_options_c/adc__maxiter.html
index cfc6a224f72..cb5b9111d3a 100644
--- a/sphinxman/master/autodir_options_c/adc__maxiter.html
+++ b/sphinxman/master/autodir_options_c/adc__maxiter.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/adc__maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/adc__maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/adc__num_core_orbitals.html b/sphinxman/master/autodir_options_c/adc__num_core_orbitals.html
index 526d2713780..a7c0e7051ed 100644
--- a/sphinxman/master/autodir_options_c/adc__num_core_orbitals.html
+++ b/sphinxman/master/autodir_options_c/adc__num_core_orbitals.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/adc__num_core_orbitals.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/adc__num_core_orbitals.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/adc__num_guesses.html b/sphinxman/master/autodir_options_c/adc__num_guesses.html
index e9406ab0f63..9db40dbf837 100644
--- a/sphinxman/master/autodir_options_c/adc__num_guesses.html
+++ b/sphinxman/master/autodir_options_c/adc__num_guesses.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/adc__num_guesses.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/adc__num_guesses.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/adc__r_convergence.html b/sphinxman/master/autodir_options_c/adc__r_convergence.html
index 1064395ce37..95bd0ce07d6 100644
--- a/sphinxman/master/autodir_options_c/adc__r_convergence.html
+++ b/sphinxman/master/autodir_options_c/adc__r_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/adc__r_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/adc__r_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/adc__reference.html b/sphinxman/master/autodir_options_c/adc__reference.html
index 556f4fdf8b3..638f06400c4 100644
--- a/sphinxman/master/autodir_options_c/adc__reference.html
+++ b/sphinxman/master/autodir_options_c/adc__reference.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/adc__reference.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/adc__reference.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/adc__roots_per_irrep.html b/sphinxman/master/autodir_options_c/adc__roots_per_irrep.html
index 0809c794985..1136c8ce2d9 100644
--- a/sphinxman/master/autodir_options_c/adc__roots_per_irrep.html
+++ b/sphinxman/master/autodir_options_c/adc__roots_per_irrep.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/adc__roots_per_irrep.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/adc__roots_per_irrep.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccdensity__ao_basis.html b/sphinxman/master/autodir_options_c/ccdensity__ao_basis.html
index 4a7f1f4cf58..b7e2ab103ad 100644
--- a/sphinxman/master/autodir_options_c/ccdensity__ao_basis.html
+++ b/sphinxman/master/autodir_options_c/ccdensity__ao_basis.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccdensity__ao_basis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccdensity__ao_basis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccdensity__cachelevel.html b/sphinxman/master/autodir_options_c/ccdensity__cachelevel.html
index dbcc3f49d57..63c7aa15832 100644
--- a/sphinxman/master/autodir_options_c/ccdensity__cachelevel.html
+++ b/sphinxman/master/autodir_options_c/ccdensity__cachelevel.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccdensity__cachelevel.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccdensity__cachelevel.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccdensity__debug.html b/sphinxman/master/autodir_options_c/ccdensity__debug.html
index 64ece4cccd0..3ee31ca4c7a 100644
--- a/sphinxman/master/autodir_options_c/ccdensity__debug.html
+++ b/sphinxman/master/autodir_options_c/ccdensity__debug.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccdensity__debug.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccdensity__debug.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccdensity__gauge.html b/sphinxman/master/autodir_options_c/ccdensity__gauge.html
index b859f2d0412..495d4192f9b 100644
--- a/sphinxman/master/autodir_options_c/ccdensity__gauge.html
+++ b/sphinxman/master/autodir_options_c/ccdensity__gauge.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccdensity__gauge.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccdensity__gauge.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccdensity__ints_tolerance.html b/sphinxman/master/autodir_options_c/ccdensity__ints_tolerance.html
index 5044d5f470c..7d1df2f704b 100644
--- a/sphinxman/master/autodir_options_c/ccdensity__ints_tolerance.html
+++ b/sphinxman/master/autodir_options_c/ccdensity__ints_tolerance.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccdensity__ints_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccdensity__ints_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccdensity__opdm_only.html b/sphinxman/master/autodir_options_c/ccdensity__opdm_only.html
index b4330733448..1ac420e32c0 100644
--- a/sphinxman/master/autodir_options_c/ccdensity__opdm_only.html
+++ b/sphinxman/master/autodir_options_c/ccdensity__opdm_only.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccdensity__opdm_only.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccdensity__opdm_only.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccdensity__opdm_relax.html b/sphinxman/master/autodir_options_c/ccdensity__opdm_relax.html
index 08d18f99ce4..62f04152a93 100644
--- a/sphinxman/master/autodir_options_c/ccdensity__opdm_relax.html
+++ b/sphinxman/master/autodir_options_c/ccdensity__opdm_relax.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccdensity__opdm_relax.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccdensity__opdm_relax.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccdensity__prop_all.html b/sphinxman/master/autodir_options_c/ccdensity__prop_all.html
index 4b8d8de3ee0..83c0358e593 100644
--- a/sphinxman/master/autodir_options_c/ccdensity__prop_all.html
+++ b/sphinxman/master/autodir_options_c/ccdensity__prop_all.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccdensity__prop_all.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccdensity__prop_all.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccdensity__prop_root.html b/sphinxman/master/autodir_options_c/ccdensity__prop_root.html
index faef4df60e9..268f4a3276b 100644
--- a/sphinxman/master/autodir_options_c/ccdensity__prop_root.html
+++ b/sphinxman/master/autodir_options_c/ccdensity__prop_root.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccdensity__prop_root.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccdensity__prop_root.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccdensity__prop_sym.html b/sphinxman/master/autodir_options_c/ccdensity__prop_sym.html
index 0414084e5ad..abe59ed6a81 100644
--- a/sphinxman/master/autodir_options_c/ccdensity__prop_sym.html
+++ b/sphinxman/master/autodir_options_c/ccdensity__prop_sym.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccdensity__prop_sym.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccdensity__prop_sym.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccdensity__reference.html b/sphinxman/master/autodir_options_c/ccdensity__reference.html
index a8308f64048..9b8dd3eb159 100644
--- a/sphinxman/master/autodir_options_c/ccdensity__reference.html
+++ b/sphinxman/master/autodir_options_c/ccdensity__reference.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccdensity__reference.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccdensity__reference.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccdensity__roots_per_irrep.html b/sphinxman/master/autodir_options_c/ccdensity__roots_per_irrep.html
index f4f06eb0870..f67b08b35f8 100644
--- a/sphinxman/master/autodir_options_c/ccdensity__roots_per_irrep.html
+++ b/sphinxman/master/autodir_options_c/ccdensity__roots_per_irrep.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccdensity__roots_per_irrep.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccdensity__roots_per_irrep.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccdensity__wfn.html b/sphinxman/master/autodir_options_c/ccdensity__wfn.html
index e0c5de16c3c..23e8296efe5 100644
--- a/sphinxman/master/autodir_options_c/ccdensity__wfn.html
+++ b/sphinxman/master/autodir_options_c/ccdensity__wfn.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccdensity__wfn.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccdensity__wfn.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccdensity__write_nos.html b/sphinxman/master/autodir_options_c/ccdensity__write_nos.html
index 0937d84d8fe..f705582b7d6 100644
--- a/sphinxman/master/autodir_options_c/ccdensity__write_nos.html
+++ b/sphinxman/master/autodir_options_c/ccdensity__write_nos.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccdensity__write_nos.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccdensity__write_nos.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccdensity__xi.html b/sphinxman/master/autodir_options_c/ccdensity__xi.html
index 11501b79525..12295067643 100644
--- a/sphinxman/master/autodir_options_c/ccdensity__xi.html
+++ b/sphinxman/master/autodir_options_c/ccdensity__xi.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccdensity__xi.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccdensity__xi.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccdensity__xi_connect.html b/sphinxman/master/autodir_options_c/ccdensity__xi_connect.html
index 2f4e4f5145e..c9875f829c7 100644
--- a/sphinxman/master/autodir_options_c/ccdensity__xi_connect.html
+++ b/sphinxman/master/autodir_options_c/ccdensity__xi_connect.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccdensity__xi_connect.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccdensity__xi_connect.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccdensity__zeta.html b/sphinxman/master/autodir_options_c/ccdensity__zeta.html
index b1d1fff5a03..1e3ed1c2af5 100644
--- a/sphinxman/master/autodir_options_c/ccdensity__zeta.html
+++ b/sphinxman/master/autodir_options_c/ccdensity__zeta.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccdensity__zeta.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccdensity__zeta.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccenergy__abcd.html b/sphinxman/master/autodir_options_c/ccenergy__abcd.html
index a011d6a8c90..39d62cd9f5d 100644
--- a/sphinxman/master/autodir_options_c/ccenergy__abcd.html
+++ b/sphinxman/master/autodir_options_c/ccenergy__abcd.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__abcd.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__abcd.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccenergy__analyze.html b/sphinxman/master/autodir_options_c/ccenergy__analyze.html
index 23a9c6e2934..8e14711076b 100644
--- a/sphinxman/master/autodir_options_c/ccenergy__analyze.html
+++ b/sphinxman/master/autodir_options_c/ccenergy__analyze.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__analyze.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__analyze.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccenergy__ao_basis.html b/sphinxman/master/autodir_options_c/ccenergy__ao_basis.html
index c2f5e1bb8ec..0895efe9467 100644
--- a/sphinxman/master/autodir_options_c/ccenergy__ao_basis.html
+++ b/sphinxman/master/autodir_options_c/ccenergy__ao_basis.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__ao_basis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__ao_basis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccenergy__bccd_maxiter.html b/sphinxman/master/autodir_options_c/ccenergy__bccd_maxiter.html
index a3b3a4ee161..3faf6635b0e 100644
--- a/sphinxman/master/autodir_options_c/ccenergy__bccd_maxiter.html
+++ b/sphinxman/master/autodir_options_c/ccenergy__bccd_maxiter.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__bccd_maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__bccd_maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccenergy__brueckner_orbs_r_convergence.html b/sphinxman/master/autodir_options_c/ccenergy__brueckner_orbs_r_convergence.html
index 7d3a2af8e40..78ac77e3280 100644
--- a/sphinxman/master/autodir_options_c/ccenergy__brueckner_orbs_r_convergence.html
+++ b/sphinxman/master/autodir_options_c/ccenergy__brueckner_orbs_r_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__brueckner_orbs_r_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__brueckner_orbs_r_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccenergy__cachelevel.html b/sphinxman/master/autodir_options_c/ccenergy__cachelevel.html
index 9a5581bde33..da0c95aa9bc 100644
--- a/sphinxman/master/autodir_options_c/ccenergy__cachelevel.html
+++ b/sphinxman/master/autodir_options_c/ccenergy__cachelevel.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__cachelevel.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__cachelevel.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccenergy__cachetype.html b/sphinxman/master/autodir_options_c/ccenergy__cachetype.html
index d4baf612191..124cfefbc4d 100644
--- a/sphinxman/master/autodir_options_c/ccenergy__cachetype.html
+++ b/sphinxman/master/autodir_options_c/ccenergy__cachetype.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__cachetype.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__cachetype.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccenergy__cc_num_threads.html b/sphinxman/master/autodir_options_c/ccenergy__cc_num_threads.html
index 4caabd69335..d4fc0c8b7f0 100644
--- a/sphinxman/master/autodir_options_c/ccenergy__cc_num_threads.html
+++ b/sphinxman/master/autodir_options_c/ccenergy__cc_num_threads.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__cc_num_threads.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__cc_num_threads.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccenergy__cc_os_scale.html b/sphinxman/master/autodir_options_c/ccenergy__cc_os_scale.html
index 52ab8e8bbd0..094bbb48435 100644
--- a/sphinxman/master/autodir_options_c/ccenergy__cc_os_scale.html
+++ b/sphinxman/master/autodir_options_c/ccenergy__cc_os_scale.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__cc_os_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__cc_os_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccenergy__cc_ss_scale.html b/sphinxman/master/autodir_options_c/ccenergy__cc_ss_scale.html
index cd3eeb21af0..e69db9ca77b 100644
--- a/sphinxman/master/autodir_options_c/ccenergy__cc_ss_scale.html
+++ b/sphinxman/master/autodir_options_c/ccenergy__cc_ss_scale.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__cc_ss_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__cc_ss_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccenergy__diis.html b/sphinxman/master/autodir_options_c/ccenergy__diis.html
index 4fda18bead1..f14f193f0c5 100644
--- a/sphinxman/master/autodir_options_c/ccenergy__diis.html
+++ b/sphinxman/master/autodir_options_c/ccenergy__diis.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__diis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__diis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccenergy__e_convergence.html b/sphinxman/master/autodir_options_c/ccenergy__e_convergence.html
index 48dd6d1bad1..f2bc7d15fe2 100644
--- a/sphinxman/master/autodir_options_c/ccenergy__e_convergence.html
+++ b/sphinxman/master/autodir_options_c/ccenergy__e_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__e_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__e_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccenergy__force_restart.html b/sphinxman/master/autodir_options_c/ccenergy__force_restart.html
index 85b9d9a3b30..9a56bb1c33d 100644
--- a/sphinxman/master/autodir_options_c/ccenergy__force_restart.html
+++ b/sphinxman/master/autodir_options_c/ccenergy__force_restart.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__force_restart.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__force_restart.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccenergy__local.html b/sphinxman/master/autodir_options_c/ccenergy__local.html
index e4233029aa7..2de23b2cff9 100644
--- a/sphinxman/master/autodir_options_c/ccenergy__local.html
+++ b/sphinxman/master/autodir_options_c/ccenergy__local.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__local.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__local.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccenergy__local_cphf_cutoff.html b/sphinxman/master/autodir_options_c/ccenergy__local_cphf_cutoff.html
index 40133bd8163..14efd90ddb0 100644
--- a/sphinxman/master/autodir_options_c/ccenergy__local_cphf_cutoff.html
+++ b/sphinxman/master/autodir_options_c/ccenergy__local_cphf_cutoff.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__local_cphf_cutoff.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__local_cphf_cutoff.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccenergy__local_cutoff.html b/sphinxman/master/autodir_options_c/ccenergy__local_cutoff.html
index c3d3edbfecb..c0623fd8e15 100644
--- a/sphinxman/master/autodir_options_c/ccenergy__local_cutoff.html
+++ b/sphinxman/master/autodir_options_c/ccenergy__local_cutoff.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__local_cutoff.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__local_cutoff.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccenergy__local_method.html b/sphinxman/master/autodir_options_c/ccenergy__local_method.html
index 5dab90d470f..21183d1f723 100644
--- a/sphinxman/master/autodir_options_c/ccenergy__local_method.html
+++ b/sphinxman/master/autodir_options_c/ccenergy__local_method.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__local_method.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__local_method.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccenergy__local_pairdef.html b/sphinxman/master/autodir_options_c/ccenergy__local_pairdef.html
index 9ed3eb56e5c..1922a2358de 100644
--- a/sphinxman/master/autodir_options_c/ccenergy__local_pairdef.html
+++ b/sphinxman/master/autodir_options_c/ccenergy__local_pairdef.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__local_pairdef.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__local_pairdef.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccenergy__local_weakp.html b/sphinxman/master/autodir_options_c/ccenergy__local_weakp.html
index c596cfa6c09..11a9914c097 100644
--- a/sphinxman/master/autodir_options_c/ccenergy__local_weakp.html
+++ b/sphinxman/master/autodir_options_c/ccenergy__local_weakp.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__local_weakp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__local_weakp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccenergy__maxiter.html b/sphinxman/master/autodir_options_c/ccenergy__maxiter.html
index 3605545b3b6..e84eafb4219 100644
--- a/sphinxman/master/autodir_options_c/ccenergy__maxiter.html
+++ b/sphinxman/master/autodir_options_c/ccenergy__maxiter.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccenergy__mp2_amps_print.html b/sphinxman/master/autodir_options_c/ccenergy__mp2_amps_print.html
index ba121e551bf..76c00c360d8 100644
--- a/sphinxman/master/autodir_options_c/ccenergy__mp2_amps_print.html
+++ b/sphinxman/master/autodir_options_c/ccenergy__mp2_amps_print.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__mp2_amps_print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__mp2_amps_print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccenergy__mp2_os_scale.html b/sphinxman/master/autodir_options_c/ccenergy__mp2_os_scale.html
index 7775fb5638c..de0abc45ae0 100644
--- a/sphinxman/master/autodir_options_c/ccenergy__mp2_os_scale.html
+++ b/sphinxman/master/autodir_options_c/ccenergy__mp2_os_scale.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__mp2_os_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__mp2_os_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccenergy__mp2_ss_scale.html b/sphinxman/master/autodir_options_c/ccenergy__mp2_ss_scale.html
index 15b0c8a63fe..8bf9a945ea1 100644
--- a/sphinxman/master/autodir_options_c/ccenergy__mp2_ss_scale.html
+++ b/sphinxman/master/autodir_options_c/ccenergy__mp2_ss_scale.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__mp2_ss_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__mp2_ss_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccenergy__new_triples.html b/sphinxman/master/autodir_options_c/ccenergy__new_triples.html
index 755d0660e58..a1e1386bd3f 100644
--- a/sphinxman/master/autodir_options_c/ccenergy__new_triples.html
+++ b/sphinxman/master/autodir_options_c/ccenergy__new_triples.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__new_triples.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__new_triples.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccenergy__num_amps_print.html b/sphinxman/master/autodir_options_c/ccenergy__num_amps_print.html
index 47c21ee8e80..307f65da238 100644
--- a/sphinxman/master/autodir_options_c/ccenergy__num_amps_print.html
+++ b/sphinxman/master/autodir_options_c/ccenergy__num_amps_print.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__num_amps_print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__num_amps_print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccenergy__pair_energies_print.html b/sphinxman/master/autodir_options_c/ccenergy__pair_energies_print.html
index a67d8092516..63459c708fe 100644
--- a/sphinxman/master/autodir_options_c/ccenergy__pair_energies_print.html
+++ b/sphinxman/master/autodir_options_c/ccenergy__pair_energies_print.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__pair_energies_print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__pair_energies_print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccenergy__property.html b/sphinxman/master/autodir_options_c/ccenergy__property.html
index bc5c01d1a29..da9396f75ab 100644
--- a/sphinxman/master/autodir_options_c/ccenergy__property.html
+++ b/sphinxman/master/autodir_options_c/ccenergy__property.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__property.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__property.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccenergy__r_convergence.html b/sphinxman/master/autodir_options_c/ccenergy__r_convergence.html
index 26e2853ecac..48133cb291a 100644
--- a/sphinxman/master/autodir_options_c/ccenergy__r_convergence.html
+++ b/sphinxman/master/autodir_options_c/ccenergy__r_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__r_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__r_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccenergy__reference.html b/sphinxman/master/autodir_options_c/ccenergy__reference.html
index efd86e1dc34..041af8c1b4c 100644
--- a/sphinxman/master/autodir_options_c/ccenergy__reference.html
+++ b/sphinxman/master/autodir_options_c/ccenergy__reference.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__reference.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__reference.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccenergy__restart.html b/sphinxman/master/autodir_options_c/ccenergy__restart.html
index f4c7a8a3541..2e8d81f00d3 100644
--- a/sphinxman/master/autodir_options_c/ccenergy__restart.html
+++ b/sphinxman/master/autodir_options_c/ccenergy__restart.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__restart.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__restart.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccenergy__scs_ccsd.html b/sphinxman/master/autodir_options_c/ccenergy__scs_ccsd.html
index c7e2f8a028f..eb28670e727 100644
--- a/sphinxman/master/autodir_options_c/ccenergy__scs_ccsd.html
+++ b/sphinxman/master/autodir_options_c/ccenergy__scs_ccsd.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__scs_ccsd.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__scs_ccsd.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccenergy__scs_mp2.html b/sphinxman/master/autodir_options_c/ccenergy__scs_mp2.html
index 8ae2c8fd481..36863ef2633 100644
--- a/sphinxman/master/autodir_options_c/ccenergy__scs_mp2.html
+++ b/sphinxman/master/autodir_options_c/ccenergy__scs_mp2.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__scs_mp2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__scs_mp2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccenergy__scsn_mp2.html b/sphinxman/master/autodir_options_c/ccenergy__scsn_mp2.html
index 04c08d23fa2..161ebe25151 100644
--- a/sphinxman/master/autodir_options_c/ccenergy__scsn_mp2.html
+++ b/sphinxman/master/autodir_options_c/ccenergy__scsn_mp2.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__scsn_mp2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__scsn_mp2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccenergy__semicanonical.html b/sphinxman/master/autodir_options_c/ccenergy__semicanonical.html
index 83b7a9f1175..b89f3a79892 100644
--- a/sphinxman/master/autodir_options_c/ccenergy__semicanonical.html
+++ b/sphinxman/master/autodir_options_c/ccenergy__semicanonical.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__semicanonical.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__semicanonical.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccenergy__t2_coupled.html b/sphinxman/master/autodir_options_c/ccenergy__t2_coupled.html
index edff1803036..55e87be0268 100644
--- a/sphinxman/master/autodir_options_c/ccenergy__t2_coupled.html
+++ b/sphinxman/master/autodir_options_c/ccenergy__t2_coupled.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__t2_coupled.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -197,7 +197,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__t2_coupled.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -213,7 +213,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccenergy__t3_ws_incore.html b/sphinxman/master/autodir_options_c/ccenergy__t3_ws_incore.html
index 4e015f673a5..7104463d06a 100644
--- a/sphinxman/master/autodir_options_c/ccenergy__t3_ws_incore.html
+++ b/sphinxman/master/autodir_options_c/ccenergy__t3_ws_incore.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__t3_ws_incore.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__t3_ws_incore.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccenergy__wfn.html b/sphinxman/master/autodir_options_c/ccenergy__wfn.html
index 8ce60ce8052..98699c72da6 100644
--- a/sphinxman/master/autodir_options_c/ccenergy__wfn.html
+++ b/sphinxman/master/autodir_options_c/ccenergy__wfn.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__wfn.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccenergy__wfn.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cceom__abcd.html b/sphinxman/master/autodir_options_c/cceom__abcd.html
index 70816121eb7..e9894a4bb49 100644
--- a/sphinxman/master/autodir_options_c/cceom__abcd.html
+++ b/sphinxman/master/autodir_options_c/cceom__abcd.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__abcd.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__abcd.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cceom__cachelevel.html b/sphinxman/master/autodir_options_c/cceom__cachelevel.html
index 120ebd0d6e8..fc023907216 100644
--- a/sphinxman/master/autodir_options_c/cceom__cachelevel.html
+++ b/sphinxman/master/autodir_options_c/cceom__cachelevel.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__cachelevel.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__cachelevel.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cceom__cachetype.html b/sphinxman/master/autodir_options_c/cceom__cachetype.html
index 95c6f030899..1c83244e717 100644
--- a/sphinxman/master/autodir_options_c/cceom__cachetype.html
+++ b/sphinxman/master/autodir_options_c/cceom__cachetype.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__cachetype.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__cachetype.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cceom__cc3_follow_root.html b/sphinxman/master/autodir_options_c/cceom__cc3_follow_root.html
index cc3d2db7395..7bd1ac35445 100644
--- a/sphinxman/master/autodir_options_c/cceom__cc3_follow_root.html
+++ b/sphinxman/master/autodir_options_c/cceom__cc3_follow_root.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__cc3_follow_root.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__cc3_follow_root.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cceom__cc_num_threads.html b/sphinxman/master/autodir_options_c/cceom__cc_num_threads.html
index f8a86cfe02f..e0078271523 100644
--- a/sphinxman/master/autodir_options_c/cceom__cc_num_threads.html
+++ b/sphinxman/master/autodir_options_c/cceom__cc_num_threads.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__cc_num_threads.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__cc_num_threads.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cceom__collapse_with_last.html b/sphinxman/master/autodir_options_c/cceom__collapse_with_last.html
index 1112ac034fa..b8c5148a15c 100644
--- a/sphinxman/master/autodir_options_c/cceom__collapse_with_last.html
+++ b/sphinxman/master/autodir_options_c/cceom__collapse_with_last.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__collapse_with_last.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__collapse_with_last.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cceom__collapse_with_last_cc3.html b/sphinxman/master/autodir_options_c/cceom__collapse_with_last_cc3.html
index 7282497c95f..649fb398e7b 100644
--- a/sphinxman/master/autodir_options_c/cceom__collapse_with_last_cc3.html
+++ b/sphinxman/master/autodir_options_c/cceom__collapse_with_last_cc3.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__collapse_with_last_cc3.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__collapse_with_last_cc3.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cceom__complex_tolerance.html b/sphinxman/master/autodir_options_c/cceom__complex_tolerance.html
index 640bbfa183b..c8a0aef8905 100644
--- a/sphinxman/master/autodir_options_c/cceom__complex_tolerance.html
+++ b/sphinxman/master/autodir_options_c/cceom__complex_tolerance.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__complex_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__complex_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cceom__e_convergence.html b/sphinxman/master/autodir_options_c/cceom__e_convergence.html
index 965179c5127..02d5a8a2805 100644
--- a/sphinxman/master/autodir_options_c/cceom__e_convergence.html
+++ b/sphinxman/master/autodir_options_c/cceom__e_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__e_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__e_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cceom__eom_guess.html b/sphinxman/master/autodir_options_c/cceom__eom_guess.html
index bd3de1f97c1..3d32e96cc6d 100644
--- a/sphinxman/master/autodir_options_c/cceom__eom_guess.html
+++ b/sphinxman/master/autodir_options_c/cceom__eom_guess.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__eom_guess.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__eom_guess.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cceom__eom_reference.html b/sphinxman/master/autodir_options_c/cceom__eom_reference.html
index 8147e411f46..0d8c2d93a09 100644
--- a/sphinxman/master/autodir_options_c/cceom__eom_reference.html
+++ b/sphinxman/master/autodir_options_c/cceom__eom_reference.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__eom_reference.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__eom_reference.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cceom__excitation_range.html b/sphinxman/master/autodir_options_c/cceom__excitation_range.html
index 604a3ee4080..38f4390e8f8 100644
--- a/sphinxman/master/autodir_options_c/cceom__excitation_range.html
+++ b/sphinxman/master/autodir_options_c/cceom__excitation_range.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__excitation_range.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__excitation_range.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cceom__full_matrix.html b/sphinxman/master/autodir_options_c/cceom__full_matrix.html
index 4ea12c8ffe5..6a29ac3ae2c 100644
--- a/sphinxman/master/autodir_options_c/cceom__full_matrix.html
+++ b/sphinxman/master/autodir_options_c/cceom__full_matrix.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__full_matrix.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__full_matrix.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cceom__local.html b/sphinxman/master/autodir_options_c/cceom__local.html
index d87bcba61ff..e3e2af6bb75 100644
--- a/sphinxman/master/autodir_options_c/cceom__local.html
+++ b/sphinxman/master/autodir_options_c/cceom__local.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__local.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__local.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cceom__local_cutoff.html b/sphinxman/master/autodir_options_c/cceom__local_cutoff.html
index de81cae24f9..320c5c97ca6 100644
--- a/sphinxman/master/autodir_options_c/cceom__local_cutoff.html
+++ b/sphinxman/master/autodir_options_c/cceom__local_cutoff.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__local_cutoff.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__local_cutoff.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cceom__local_do_singles.html b/sphinxman/master/autodir_options_c/cceom__local_do_singles.html
index a84d1039ca0..c9ba4c55c3d 100644
--- a/sphinxman/master/autodir_options_c/cceom__local_do_singles.html
+++ b/sphinxman/master/autodir_options_c/cceom__local_do_singles.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__local_do_singles.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -197,7 +197,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__local_do_singles.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -213,7 +213,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cceom__local_filter_singles.html b/sphinxman/master/autodir_options_c/cceom__local_filter_singles.html
index 800480e6897..75fddb2c19d 100644
--- a/sphinxman/master/autodir_options_c/cceom__local_filter_singles.html
+++ b/sphinxman/master/autodir_options_c/cceom__local_filter_singles.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__local_filter_singles.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__local_filter_singles.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cceom__local_method.html b/sphinxman/master/autodir_options_c/cceom__local_method.html
index fe95f6f455b..358d5660de9 100644
--- a/sphinxman/master/autodir_options_c/cceom__local_method.html
+++ b/sphinxman/master/autodir_options_c/cceom__local_method.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__local_method.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__local_method.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cceom__local_preconditioner.html b/sphinxman/master/autodir_options_c/cceom__local_preconditioner.html
index 9c0399af64a..0889ef2f591 100644
--- a/sphinxman/master/autodir_options_c/cceom__local_preconditioner.html
+++ b/sphinxman/master/autodir_options_c/cceom__local_preconditioner.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__local_preconditioner.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__local_preconditioner.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cceom__local_weakp.html b/sphinxman/master/autodir_options_c/cceom__local_weakp.html
index 4d7983340fa..ea04e68d664 100644
--- a/sphinxman/master/autodir_options_c/cceom__local_weakp.html
+++ b/sphinxman/master/autodir_options_c/cceom__local_weakp.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__local_weakp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__local_weakp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cceom__maxiter.html b/sphinxman/master/autodir_options_c/cceom__maxiter.html
index 5e3bd77a33e..a85f5de94cd 100644
--- a/sphinxman/master/autodir_options_c/cceom__maxiter.html
+++ b/sphinxman/master/autodir_options_c/cceom__maxiter.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cceom__new_triples.html b/sphinxman/master/autodir_options_c/cceom__new_triples.html
index 02cd070f0fb..23487c24659 100644
--- a/sphinxman/master/autodir_options_c/cceom__new_triples.html
+++ b/sphinxman/master/autodir_options_c/cceom__new_triples.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__new_triples.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__new_triples.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cceom__num_amps_print.html b/sphinxman/master/autodir_options_c/cceom__num_amps_print.html
index 1ae3b94c1c8..b2220d85106 100644
--- a/sphinxman/master/autodir_options_c/cceom__num_amps_print.html
+++ b/sphinxman/master/autodir_options_c/cceom__num_amps_print.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__num_amps_print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__num_amps_print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cceom__overlap_check.html b/sphinxman/master/autodir_options_c/cceom__overlap_check.html
index 4dfa7663763..a35c7431b9e 100644
--- a/sphinxman/master/autodir_options_c/cceom__overlap_check.html
+++ b/sphinxman/master/autodir_options_c/cceom__overlap_check.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__overlap_check.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__overlap_check.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cceom__prop_root.html b/sphinxman/master/autodir_options_c/cceom__prop_root.html
index 68ed9ede83a..13b30cc2eca 100644
--- a/sphinxman/master/autodir_options_c/cceom__prop_root.html
+++ b/sphinxman/master/autodir_options_c/cceom__prop_root.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__prop_root.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__prop_root.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cceom__prop_sym.html b/sphinxman/master/autodir_options_c/cceom__prop_sym.html
index 3771c45348b..714dbe230fd 100644
--- a/sphinxman/master/autodir_options_c/cceom__prop_sym.html
+++ b/sphinxman/master/autodir_options_c/cceom__prop_sym.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__prop_sym.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__prop_sym.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cceom__r_convergence.html b/sphinxman/master/autodir_options_c/cceom__r_convergence.html
index 8eb43ebbc62..fe2bf38e081 100644
--- a/sphinxman/master/autodir_options_c/cceom__r_convergence.html
+++ b/sphinxman/master/autodir_options_c/cceom__r_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__r_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__r_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cceom__reference.html b/sphinxman/master/autodir_options_c/cceom__reference.html
index 2cdb0c7fcbb..cd037229f11 100644
--- a/sphinxman/master/autodir_options_c/cceom__reference.html
+++ b/sphinxman/master/autodir_options_c/cceom__reference.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__reference.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__reference.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cceom__restart_eom_cc3.html b/sphinxman/master/autodir_options_c/cceom__restart_eom_cc3.html
index e249d277094..eea379c7f45 100644
--- a/sphinxman/master/autodir_options_c/cceom__restart_eom_cc3.html
+++ b/sphinxman/master/autodir_options_c/cceom__restart_eom_cc3.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__restart_eom_cc3.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__restart_eom_cc3.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cceom__rhf_triplets.html b/sphinxman/master/autodir_options_c/cceom__rhf_triplets.html
index a84b4723107..5cf8428f965 100644
--- a/sphinxman/master/autodir_options_c/cceom__rhf_triplets.html
+++ b/sphinxman/master/autodir_options_c/cceom__rhf_triplets.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__rhf_triplets.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__rhf_triplets.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cceom__roots_per_irrep.html b/sphinxman/master/autodir_options_c/cceom__roots_per_irrep.html
index c09bef4c116..45c15ba89db 100644
--- a/sphinxman/master/autodir_options_c/cceom__roots_per_irrep.html
+++ b/sphinxman/master/autodir_options_c/cceom__roots_per_irrep.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__roots_per_irrep.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__roots_per_irrep.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cceom__schmidt_add_residual_tolerance.html b/sphinxman/master/autodir_options_c/cceom__schmidt_add_residual_tolerance.html
index 11748364538..55bbb7d9b3b 100644
--- a/sphinxman/master/autodir_options_c/cceom__schmidt_add_residual_tolerance.html
+++ b/sphinxman/master/autodir_options_c/cceom__schmidt_add_residual_tolerance.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__schmidt_add_residual_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__schmidt_add_residual_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cceom__semicanonical.html b/sphinxman/master/autodir_options_c/cceom__semicanonical.html
index b4eea025917..fcc935146ec 100644
--- a/sphinxman/master/autodir_options_c/cceom__semicanonical.html
+++ b/sphinxman/master/autodir_options_c/cceom__semicanonical.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__semicanonical.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__semicanonical.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cceom__singles_print.html b/sphinxman/master/autodir_options_c/cceom__singles_print.html
index 7374f0e5df6..19f2d314044 100644
--- a/sphinxman/master/autodir_options_c/cceom__singles_print.html
+++ b/sphinxman/master/autodir_options_c/cceom__singles_print.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__singles_print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__singles_print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cceom__ss_e_convergence.html b/sphinxman/master/autodir_options_c/cceom__ss_e_convergence.html
index 73c5dc3fe04..4f9d99ae00e 100644
--- a/sphinxman/master/autodir_options_c/cceom__ss_e_convergence.html
+++ b/sphinxman/master/autodir_options_c/cceom__ss_e_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__ss_e_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__ss_e_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cceom__ss_r_convergence.html b/sphinxman/master/autodir_options_c/cceom__ss_r_convergence.html
index e538af24ccc..c4ae7d45286 100644
--- a/sphinxman/master/autodir_options_c/cceom__ss_r_convergence.html
+++ b/sphinxman/master/autodir_options_c/cceom__ss_r_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__ss_r_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__ss_r_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cceom__ss_skip_diag.html b/sphinxman/master/autodir_options_c/cceom__ss_skip_diag.html
index c6de8dd0af8..9edc3eb872c 100644
--- a/sphinxman/master/autodir_options_c/cceom__ss_skip_diag.html
+++ b/sphinxman/master/autodir_options_c/cceom__ss_skip_diag.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__ss_skip_diag.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__ss_skip_diag.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cceom__ss_vecs_per_root.html b/sphinxman/master/autodir_options_c/cceom__ss_vecs_per_root.html
index e3d2db61a6f..72c2f189e66 100644
--- a/sphinxman/master/autodir_options_c/cceom__ss_vecs_per_root.html
+++ b/sphinxman/master/autodir_options_c/cceom__ss_vecs_per_root.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__ss_vecs_per_root.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__ss_vecs_per_root.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cceom__t3_ws_incore.html b/sphinxman/master/autodir_options_c/cceom__t3_ws_incore.html
index a6133816e96..f62c2e8f861 100644
--- a/sphinxman/master/autodir_options_c/cceom__t3_ws_incore.html
+++ b/sphinxman/master/autodir_options_c/cceom__t3_ws_incore.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__t3_ws_incore.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__t3_ws_incore.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cceom__vecs_cc3.html b/sphinxman/master/autodir_options_c/cceom__vecs_cc3.html
index 816f3cd5462..0570394308f 100644
--- a/sphinxman/master/autodir_options_c/cceom__vecs_cc3.html
+++ b/sphinxman/master/autodir_options_c/cceom__vecs_cc3.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__vecs_cc3.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__vecs_cc3.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cceom__vecs_per_root.html b/sphinxman/master/autodir_options_c/cceom__vecs_per_root.html
index 95eb08fa981..64119b75b2d 100644
--- a/sphinxman/master/autodir_options_c/cceom__vecs_per_root.html
+++ b/sphinxman/master/autodir_options_c/cceom__vecs_per_root.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__vecs_per_root.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__vecs_per_root.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cceom__wfn.html b/sphinxman/master/autodir_options_c/cceom__wfn.html
index 5e1e866cd66..ac1083e2337 100644
--- a/sphinxman/master/autodir_options_c/cceom__wfn.html
+++ b/sphinxman/master/autodir_options_c/cceom__wfn.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__wfn.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cceom__wfn.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cchbar__cachelevel.html b/sphinxman/master/autodir_options_c/cchbar__cachelevel.html
index fc6afd2c284..c5aac358b9e 100644
--- a/sphinxman/master/autodir_options_c/cchbar__cachelevel.html
+++ b/sphinxman/master/autodir_options_c/cchbar__cachelevel.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cchbar__cachelevel.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cchbar__cachelevel.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cchbar__eom_reference.html b/sphinxman/master/autodir_options_c/cchbar__eom_reference.html
index 91d0cd03447..b23ad9a1433 100644
--- a/sphinxman/master/autodir_options_c/cchbar__eom_reference.html
+++ b/sphinxman/master/autodir_options_c/cchbar__eom_reference.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cchbar__eom_reference.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cchbar__eom_reference.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cchbar__t_amps.html b/sphinxman/master/autodir_options_c/cchbar__t_amps.html
index 0935fe1315a..e0925de8a4f 100644
--- a/sphinxman/master/autodir_options_c/cchbar__t_amps.html
+++ b/sphinxman/master/autodir_options_c/cchbar__t_amps.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cchbar__t_amps.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cchbar__t_amps.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cchbar__wabei_lowdisk.html b/sphinxman/master/autodir_options_c/cchbar__wabei_lowdisk.html
index 4db7b8ddff3..ab4daa8514e 100644
--- a/sphinxman/master/autodir_options_c/cchbar__wabei_lowdisk.html
+++ b/sphinxman/master/autodir_options_c/cchbar__wabei_lowdisk.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cchbar__wabei_lowdisk.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cchbar__wabei_lowdisk.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cchbar__wfn.html b/sphinxman/master/autodir_options_c/cchbar__wfn.html
index 0486cb53d86..be895cc72ee 100644
--- a/sphinxman/master/autodir_options_c/cchbar__wfn.html
+++ b/sphinxman/master/autodir_options_c/cchbar__wfn.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cchbar__wfn.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cchbar__wfn.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cclambda__abcd.html b/sphinxman/master/autodir_options_c/cclambda__abcd.html
index ffab96b41b7..7f033d6d777 100644
--- a/sphinxman/master/autodir_options_c/cclambda__abcd.html
+++ b/sphinxman/master/autodir_options_c/cclambda__abcd.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cclambda__abcd.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cclambda__abcd.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cclambda__ao_basis.html b/sphinxman/master/autodir_options_c/cclambda__ao_basis.html
index ea530ceeada..8d2f2d13bee 100644
--- a/sphinxman/master/autodir_options_c/cclambda__ao_basis.html
+++ b/sphinxman/master/autodir_options_c/cclambda__ao_basis.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cclambda__ao_basis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cclambda__ao_basis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cclambda__cachelevel.html b/sphinxman/master/autodir_options_c/cclambda__cachelevel.html
index 636aa5247ac..9d3e5b5a22f 100644
--- a/sphinxman/master/autodir_options_c/cclambda__cachelevel.html
+++ b/sphinxman/master/autodir_options_c/cclambda__cachelevel.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cclambda__cachelevel.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cclambda__cachelevel.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cclambda__diis.html b/sphinxman/master/autodir_options_c/cclambda__diis.html
index 2d382b95038..ecfb4fcff5b 100644
--- a/sphinxman/master/autodir_options_c/cclambda__diis.html
+++ b/sphinxman/master/autodir_options_c/cclambda__diis.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cclambda__diis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cclambda__diis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cclambda__jobtype.html b/sphinxman/master/autodir_options_c/cclambda__jobtype.html
index b0e7edf515d..3dc40bcad08 100644
--- a/sphinxman/master/autodir_options_c/cclambda__jobtype.html
+++ b/sphinxman/master/autodir_options_c/cclambda__jobtype.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cclambda__jobtype.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cclambda__jobtype.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cclambda__local.html b/sphinxman/master/autodir_options_c/cclambda__local.html
index 273846ca4c7..f8ee0407bd3 100644
--- a/sphinxman/master/autodir_options_c/cclambda__local.html
+++ b/sphinxman/master/autodir_options_c/cclambda__local.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cclambda__local.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cclambda__local.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cclambda__local_cphf_cutoff.html b/sphinxman/master/autodir_options_c/cclambda__local_cphf_cutoff.html
index 4957c9ba4d2..1cc234184c0 100644
--- a/sphinxman/master/autodir_options_c/cclambda__local_cphf_cutoff.html
+++ b/sphinxman/master/autodir_options_c/cclambda__local_cphf_cutoff.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cclambda__local_cphf_cutoff.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cclambda__local_cphf_cutoff.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cclambda__local_cutoff.html b/sphinxman/master/autodir_options_c/cclambda__local_cutoff.html
index 540535b3191..c16106f74c5 100644
--- a/sphinxman/master/autodir_options_c/cclambda__local_cutoff.html
+++ b/sphinxman/master/autodir_options_c/cclambda__local_cutoff.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cclambda__local_cutoff.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cclambda__local_cutoff.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cclambda__local_filter_singles.html b/sphinxman/master/autodir_options_c/cclambda__local_filter_singles.html
index 006d7bb767d..a228fb274e3 100644
--- a/sphinxman/master/autodir_options_c/cclambda__local_filter_singles.html
+++ b/sphinxman/master/autodir_options_c/cclambda__local_filter_singles.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cclambda__local_filter_singles.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cclambda__local_filter_singles.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cclambda__local_method.html b/sphinxman/master/autodir_options_c/cclambda__local_method.html
index b19b04e8739..df6688ab24e 100644
--- a/sphinxman/master/autodir_options_c/cclambda__local_method.html
+++ b/sphinxman/master/autodir_options_c/cclambda__local_method.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cclambda__local_method.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cclambda__local_method.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cclambda__local_pairdef.html b/sphinxman/master/autodir_options_c/cclambda__local_pairdef.html
index e4a8dd57d7d..50f5e06a2fa 100644
--- a/sphinxman/master/autodir_options_c/cclambda__local_pairdef.html
+++ b/sphinxman/master/autodir_options_c/cclambda__local_pairdef.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cclambda__local_pairdef.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cclambda__local_pairdef.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cclambda__local_weakp.html b/sphinxman/master/autodir_options_c/cclambda__local_weakp.html
index 4a62ee77927..3cb9f6f0567 100644
--- a/sphinxman/master/autodir_options_c/cclambda__local_weakp.html
+++ b/sphinxman/master/autodir_options_c/cclambda__local_weakp.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cclambda__local_weakp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cclambda__local_weakp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cclambda__maxiter.html b/sphinxman/master/autodir_options_c/cclambda__maxiter.html
index 88885d53eca..1ceeb9ff6ff 100644
--- a/sphinxman/master/autodir_options_c/cclambda__maxiter.html
+++ b/sphinxman/master/autodir_options_c/cclambda__maxiter.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cclambda__maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cclambda__maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cclambda__num_amps_print.html b/sphinxman/master/autodir_options_c/cclambda__num_amps_print.html
index 8aa33f11ee2..ae309b015ce 100644
--- a/sphinxman/master/autodir_options_c/cclambda__num_amps_print.html
+++ b/sphinxman/master/autodir_options_c/cclambda__num_amps_print.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cclambda__num_amps_print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cclambda__num_amps_print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cclambda__prop_all.html b/sphinxman/master/autodir_options_c/cclambda__prop_all.html
index 588f226018f..d5ac7ce43ab 100644
--- a/sphinxman/master/autodir_options_c/cclambda__prop_all.html
+++ b/sphinxman/master/autodir_options_c/cclambda__prop_all.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cclambda__prop_all.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cclambda__prop_all.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cclambda__prop_root.html b/sphinxman/master/autodir_options_c/cclambda__prop_root.html
index 90e9267d029..9f0eb1ab7d3 100644
--- a/sphinxman/master/autodir_options_c/cclambda__prop_root.html
+++ b/sphinxman/master/autodir_options_c/cclambda__prop_root.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cclambda__prop_root.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cclambda__prop_root.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cclambda__prop_sym.html b/sphinxman/master/autodir_options_c/cclambda__prop_sym.html
index c423e18c946..fec9ef259a5 100644
--- a/sphinxman/master/autodir_options_c/cclambda__prop_sym.html
+++ b/sphinxman/master/autodir_options_c/cclambda__prop_sym.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cclambda__prop_sym.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cclambda__prop_sym.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cclambda__r_convergence.html b/sphinxman/master/autodir_options_c/cclambda__r_convergence.html
index d75a1da5c4a..30e6bbb867e 100644
--- a/sphinxman/master/autodir_options_c/cclambda__r_convergence.html
+++ b/sphinxman/master/autodir_options_c/cclambda__r_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cclambda__r_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cclambda__r_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cclambda__restart.html b/sphinxman/master/autodir_options_c/cclambda__restart.html
index ac53ba9e0f1..6cbd6687224 100644
--- a/sphinxman/master/autodir_options_c/cclambda__restart.html
+++ b/sphinxman/master/autodir_options_c/cclambda__restart.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cclambda__restart.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cclambda__restart.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cclambda__roots_per_irrep.html b/sphinxman/master/autodir_options_c/cclambda__roots_per_irrep.html
index ab459bab95f..c92dd6d67ae 100644
--- a/sphinxman/master/autodir_options_c/cclambda__roots_per_irrep.html
+++ b/sphinxman/master/autodir_options_c/cclambda__roots_per_irrep.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cclambda__roots_per_irrep.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cclambda__roots_per_irrep.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cclambda__sekino.html b/sphinxman/master/autodir_options_c/cclambda__sekino.html
index ae086af08e2..4bbce769ffa 100644
--- a/sphinxman/master/autodir_options_c/cclambda__sekino.html
+++ b/sphinxman/master/autodir_options_c/cclambda__sekino.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cclambda__sekino.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cclambda__sekino.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cclambda__wfn.html b/sphinxman/master/autodir_options_c/cclambda__wfn.html
index bbca9c46264..7853e48e478 100644
--- a/sphinxman/master/autodir_options_c/cclambda__wfn.html
+++ b/sphinxman/master/autodir_options_c/cclambda__wfn.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cclambda__wfn.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cclambda__wfn.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cclambda__zeta.html b/sphinxman/master/autodir_options_c/cclambda__zeta.html
index da48705c5c0..9b19a2a4739 100644
--- a/sphinxman/master/autodir_options_c/cclambda__zeta.html
+++ b/sphinxman/master/autodir_options_c/cclambda__zeta.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cclambda__zeta.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cclambda__zeta.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccresponse__abcd.html b/sphinxman/master/autodir_options_c/ccresponse__abcd.html
index c96e5f8365a..aa4e7d6c505 100644
--- a/sphinxman/master/autodir_options_c/ccresponse__abcd.html
+++ b/sphinxman/master/autodir_options_c/ccresponse__abcd.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccresponse__abcd.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccresponse__abcd.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccresponse__analyze.html b/sphinxman/master/autodir_options_c/ccresponse__analyze.html
index 056abd35f80..e45b13c68a6 100644
--- a/sphinxman/master/autodir_options_c/ccresponse__analyze.html
+++ b/sphinxman/master/autodir_options_c/ccresponse__analyze.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccresponse__analyze.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccresponse__analyze.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccresponse__cachelevel.html b/sphinxman/master/autodir_options_c/ccresponse__cachelevel.html
index ec6848b3628..9ea74cc7247 100644
--- a/sphinxman/master/autodir_options_c/ccresponse__cachelevel.html
+++ b/sphinxman/master/autodir_options_c/ccresponse__cachelevel.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccresponse__cachelevel.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccresponse__cachelevel.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccresponse__diis.html b/sphinxman/master/autodir_options_c/ccresponse__diis.html
index ef321906f84..9d2d48b25bd 100644
--- a/sphinxman/master/autodir_options_c/ccresponse__diis.html
+++ b/sphinxman/master/autodir_options_c/ccresponse__diis.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccresponse__diis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccresponse__diis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccresponse__gauge.html b/sphinxman/master/autodir_options_c/ccresponse__gauge.html
index 5431ad93ca4..ff3ff23212d 100644
--- a/sphinxman/master/autodir_options_c/ccresponse__gauge.html
+++ b/sphinxman/master/autodir_options_c/ccresponse__gauge.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccresponse__gauge.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccresponse__gauge.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccresponse__linear.html b/sphinxman/master/autodir_options_c/ccresponse__linear.html
index 5f6f7a5d841..8181c50064a 100644
--- a/sphinxman/master/autodir_options_c/ccresponse__linear.html
+++ b/sphinxman/master/autodir_options_c/ccresponse__linear.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccresponse__linear.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccresponse__linear.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccresponse__local.html b/sphinxman/master/autodir_options_c/ccresponse__local.html
index e99a3851bbd..8c7c44168ce 100644
--- a/sphinxman/master/autodir_options_c/ccresponse__local.html
+++ b/sphinxman/master/autodir_options_c/ccresponse__local.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccresponse__local.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccresponse__local.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccresponse__local_cphf_cutoff.html b/sphinxman/master/autodir_options_c/ccresponse__local_cphf_cutoff.html
index 329395b36c0..b9361fc0867 100644
--- a/sphinxman/master/autodir_options_c/ccresponse__local_cphf_cutoff.html
+++ b/sphinxman/master/autodir_options_c/ccresponse__local_cphf_cutoff.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccresponse__local_cphf_cutoff.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccresponse__local_cphf_cutoff.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccresponse__local_cutoff.html b/sphinxman/master/autodir_options_c/ccresponse__local_cutoff.html
index b38a413bbdd..b6eb6cde852 100644
--- a/sphinxman/master/autodir_options_c/ccresponse__local_cutoff.html
+++ b/sphinxman/master/autodir_options_c/ccresponse__local_cutoff.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccresponse__local_cutoff.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccresponse__local_cutoff.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccresponse__local_filter_singles.html b/sphinxman/master/autodir_options_c/ccresponse__local_filter_singles.html
index c5387bbda2d..9b8b8c4c802 100644
--- a/sphinxman/master/autodir_options_c/ccresponse__local_filter_singles.html
+++ b/sphinxman/master/autodir_options_c/ccresponse__local_filter_singles.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccresponse__local_filter_singles.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccresponse__local_filter_singles.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccresponse__local_method.html b/sphinxman/master/autodir_options_c/ccresponse__local_method.html
index 766a2a1ffe4..61010ee1afa 100644
--- a/sphinxman/master/autodir_options_c/ccresponse__local_method.html
+++ b/sphinxman/master/autodir_options_c/ccresponse__local_method.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccresponse__local_method.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccresponse__local_method.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccresponse__local_pairdef.html b/sphinxman/master/autodir_options_c/ccresponse__local_pairdef.html
index bb19490a029..ae18b9ed978 100644
--- a/sphinxman/master/autodir_options_c/ccresponse__local_pairdef.html
+++ b/sphinxman/master/autodir_options_c/ccresponse__local_pairdef.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccresponse__local_pairdef.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccresponse__local_pairdef.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccresponse__local_weakp.html b/sphinxman/master/autodir_options_c/ccresponse__local_weakp.html
index 8d1893206b9..79317eb3e7b 100644
--- a/sphinxman/master/autodir_options_c/ccresponse__local_weakp.html
+++ b/sphinxman/master/autodir_options_c/ccresponse__local_weakp.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccresponse__local_weakp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccresponse__local_weakp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccresponse__maxiter.html b/sphinxman/master/autodir_options_c/ccresponse__maxiter.html
index 0ac1d652ff1..78b1e5eeb9d 100644
--- a/sphinxman/master/autodir_options_c/ccresponse__maxiter.html
+++ b/sphinxman/master/autodir_options_c/ccresponse__maxiter.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccresponse__maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccresponse__maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccresponse__num_amps_print.html b/sphinxman/master/autodir_options_c/ccresponse__num_amps_print.html
index b79a0349da5..a4be3293eeb 100644
--- a/sphinxman/master/autodir_options_c/ccresponse__num_amps_print.html
+++ b/sphinxman/master/autodir_options_c/ccresponse__num_amps_print.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccresponse__num_amps_print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccresponse__num_amps_print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccresponse__omega.html b/sphinxman/master/autodir_options_c/ccresponse__omega.html
index 2026423c673..4cfc408ddb3 100644
--- a/sphinxman/master/autodir_options_c/ccresponse__omega.html
+++ b/sphinxman/master/autodir_options_c/ccresponse__omega.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccresponse__omega.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccresponse__omega.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccresponse__property.html b/sphinxman/master/autodir_options_c/ccresponse__property.html
index 8c0f311f9cb..64e68af9de9 100644
--- a/sphinxman/master/autodir_options_c/ccresponse__property.html
+++ b/sphinxman/master/autodir_options_c/ccresponse__property.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccresponse__property.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccresponse__property.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccresponse__r_convergence.html b/sphinxman/master/autodir_options_c/ccresponse__r_convergence.html
index 4859af1d22d..a3fb784a100 100644
--- a/sphinxman/master/autodir_options_c/ccresponse__r_convergence.html
+++ b/sphinxman/master/autodir_options_c/ccresponse__r_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccresponse__r_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccresponse__r_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccresponse__reference.html b/sphinxman/master/autodir_options_c/ccresponse__reference.html
index 3e85bca8966..f345edf32e2 100644
--- a/sphinxman/master/autodir_options_c/ccresponse__reference.html
+++ b/sphinxman/master/autodir_options_c/ccresponse__reference.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccresponse__reference.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccresponse__reference.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccresponse__restart.html b/sphinxman/master/autodir_options_c/ccresponse__restart.html
index 6bfcdc65c8c..35375206f0d 100644
--- a/sphinxman/master/autodir_options_c/ccresponse__restart.html
+++ b/sphinxman/master/autodir_options_c/ccresponse__restart.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccresponse__restart.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccresponse__restart.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccresponse__sekino.html b/sphinxman/master/autodir_options_c/ccresponse__sekino.html
index 8b65e29e97c..4e154245e9c 100644
--- a/sphinxman/master/autodir_options_c/ccresponse__sekino.html
+++ b/sphinxman/master/autodir_options_c/ccresponse__sekino.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccresponse__sekino.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccresponse__sekino.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ccresponse__wfn.html b/sphinxman/master/autodir_options_c/ccresponse__wfn.html
index 47d24abad3a..7261941e453 100644
--- a/sphinxman/master/autodir_options_c/ccresponse__wfn.html
+++ b/sphinxman/master/autodir_options_c/ccresponse__wfn.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccresponse__wfn.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ccresponse__wfn.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cctransort__ao_basis.html b/sphinxman/master/autodir_options_c/cctransort__ao_basis.html
index 9e720171329..df9f69f4f9f 100644
--- a/sphinxman/master/autodir_options_c/cctransort__ao_basis.html
+++ b/sphinxman/master/autodir_options_c/cctransort__ao_basis.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cctransort__ao_basis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cctransort__ao_basis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cctransort__cachelevel.html b/sphinxman/master/autodir_options_c/cctransort__cachelevel.html
index 1a03671ed69..9d548d16798 100644
--- a/sphinxman/master/autodir_options_c/cctransort__cachelevel.html
+++ b/sphinxman/master/autodir_options_c/cctransort__cachelevel.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cctransort__cachelevel.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cctransort__cachelevel.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cctransort__delete_tei.html b/sphinxman/master/autodir_options_c/cctransort__delete_tei.html
index 0a4ea2c860a..f599fbe2693 100644
--- a/sphinxman/master/autodir_options_c/cctransort__delete_tei.html
+++ b/sphinxman/master/autodir_options_c/cctransort__delete_tei.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cctransort__delete_tei.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cctransort__delete_tei.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cctransort__reference.html b/sphinxman/master/autodir_options_c/cctransort__reference.html
index c583017dafc..d9515d833d1 100644
--- a/sphinxman/master/autodir_options_c/cctransort__reference.html
+++ b/sphinxman/master/autodir_options_c/cctransort__reference.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cctransort__reference.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cctransort__reference.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cctransort__run_cctransort.html b/sphinxman/master/autodir_options_c/cctransort__run_cctransort.html
index 6bbe3c112f4..7301e2417fc 100644
--- a/sphinxman/master/autodir_options_c/cctransort__run_cctransort.html
+++ b/sphinxman/master/autodir_options_c/cctransort__run_cctransort.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cctransort__run_cctransort.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cctransort__run_cctransort.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cctransort__semicanonical.html b/sphinxman/master/autodir_options_c/cctransort__semicanonical.html
index 74c40e067fc..0c4e55a1c79 100644
--- a/sphinxman/master/autodir_options_c/cctransort__semicanonical.html
+++ b/sphinxman/master/autodir_options_c/cctransort__semicanonical.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cctransort__semicanonical.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cctransort__semicanonical.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cctransort__wfn.html b/sphinxman/master/autodir_options_c/cctransort__wfn.html
index b8673f15606..bad830316f3 100644
--- a/sphinxman/master/autodir_options_c/cctransort__wfn.html
+++ b/sphinxman/master/autodir_options_c/cctransort__wfn.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cctransort__wfn.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cctransort__wfn.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cctriples__cc_num_threads.html b/sphinxman/master/autodir_options_c/cctriples__cc_num_threads.html
index 46ca4dd797f..8ea8c8b503b 100644
--- a/sphinxman/master/autodir_options_c/cctriples__cc_num_threads.html
+++ b/sphinxman/master/autodir_options_c/cctriples__cc_num_threads.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cctriples__cc_num_threads.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cctriples__cc_num_threads.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cctriples__reference.html b/sphinxman/master/autodir_options_c/cctriples__reference.html
index b9217914516..06bc095235e 100644
--- a/sphinxman/master/autodir_options_c/cctriples__reference.html
+++ b/sphinxman/master/autodir_options_c/cctriples__reference.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cctriples__reference.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cctriples__reference.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cctriples__semicanonical.html b/sphinxman/master/autodir_options_c/cctriples__semicanonical.html
index f9d7d67363b..511cb8ff0eb 100644
--- a/sphinxman/master/autodir_options_c/cctriples__semicanonical.html
+++ b/sphinxman/master/autodir_options_c/cctriples__semicanonical.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cctriples__semicanonical.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cctriples__semicanonical.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cctriples__wfn.html b/sphinxman/master/autodir_options_c/cctriples__wfn.html
index 205008010c1..5d4e5397bc6 100644
--- a/sphinxman/master/autodir_options_c/cctriples__wfn.html
+++ b/sphinxman/master/autodir_options_c/cctriples__wfn.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cctriples__wfn.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cctriples__wfn.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_abcdtype.html b/sphinxman/master/autodir_options_c/cfour__cfour_abcdtype.html
index eaff57d7f7e..b4878aec24b 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_abcdtype.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_abcdtype.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_abcdtype.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_abcdtype.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_active_orbi.html b/sphinxman/master/autodir_options_c/cfour__cfour_active_orbi.html
index ca57fa73969..0fcb80ff5ec 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_active_orbi.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_active_orbi.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_active_orbi.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_active_orbi.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_anh_algorithm.html b/sphinxman/master/autodir_options_c/cfour__cfour_anh_algorithm.html
index a1a99b68ca3..736cc11c126 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_anh_algorithm.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_anh_algorithm.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_anh_algorithm.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_anh_algorithm.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_anh_derivatives.html b/sphinxman/master/autodir_options_c/cfour__cfour_anh_derivatives.html
index 45798f5d9fb..9e2d5bc729b 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_anh_derivatives.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_anh_derivatives.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_anh_derivatives.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_anh_derivatives.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_anh_stepsize.html b/sphinxman/master/autodir_options_c/cfour__cfour_anh_stepsize.html
index 174de760cba..81f7e1ecc32 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_anh_stepsize.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_anh_stepsize.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_anh_stepsize.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_anh_stepsize.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_anh_symmetry.html b/sphinxman/master/autodir_options_c/cfour__cfour_anh_symmetry.html
index 799e6a98f84..bdb4deb0915 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_anh_symmetry.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_anh_symmetry.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_anh_symmetry.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_anh_symmetry.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_anharmonic.html b/sphinxman/master/autodir_options_c/cfour__cfour_anharmonic.html
index c1beb52a460..73a170a9a0f 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_anharmonic.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_anharmonic.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_anharmonic.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_anharmonic.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_ao_ladders.html b/sphinxman/master/autodir_options_c/cfour__cfour_ao_ladders.html
index 0b15bcc713c..6495f5f85d5 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_ao_ladders.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_ao_ladders.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_ao_ladders.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_ao_ladders.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_av_scf.html b/sphinxman/master/autodir_options_c/cfour__cfour_av_scf.html
index 660ba4e6c92..f3045232cbe 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_av_scf.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_av_scf.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_av_scf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_av_scf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_basis.html b/sphinxman/master/autodir_options_c/cfour__cfour_basis.html
index b13c3414132..c711a6bd947 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_basis.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_basis.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_basis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_basis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_bruck_conv.html b/sphinxman/master/autodir_options_c/cfour__cfour_bruck_conv.html
index 958d2c09b83..3ef1b1ee806 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_bruck_conv.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_bruck_conv.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_bruck_conv.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_bruck_conv.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_brueckner.html b/sphinxman/master/autodir_options_c/cfour__cfour_brueckner.html
index 63dc277cfd7..916a8526a4c 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_brueckner.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_brueckner.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_brueckner.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_brueckner.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_cache_recs.html b/sphinxman/master/autodir_options_c/cfour__cfour_cache_recs.html
index a6422440f23..f39904b6dbd 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_cache_recs.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_cache_recs.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_cache_recs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_cache_recs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_calc_level.html b/sphinxman/master/autodir_options_c/cfour__cfour_calc_level.html
index 0d5da43552f..51221bc6810 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_calc_level.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_calc_level.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_calc_level.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_calc_level.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_cc_conv.html b/sphinxman/master/autodir_options_c/cfour__cfour_cc_conv.html
index e6886ccf2ad..3c2d7ad7a83 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_cc_conv.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_cc_conv.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_cc_conv.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_cc_conv.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_cc_exporder.html b/sphinxman/master/autodir_options_c/cfour__cfour_cc_exporder.html
index 966c7917458..5acd3c350a3 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_cc_exporder.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_cc_exporder.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_cc_exporder.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_cc_exporder.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_cc_extrapolation.html b/sphinxman/master/autodir_options_c/cfour__cfour_cc_extrapolation.html
index 47b3fdf0276..e1a0fb215ad 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_cc_extrapolation.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_cc_extrapolation.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_cc_extrapolation.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_cc_extrapolation.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_cc_maxcyc.html b/sphinxman/master/autodir_options_c/cfour__cfour_cc_maxcyc.html
index fa1d2f58638..66c65ccc794 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_cc_maxcyc.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_cc_maxcyc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_cc_maxcyc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_cc_maxcyc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_cc_program.html b/sphinxman/master/autodir_options_c/cfour__cfour_cc_program.html
index fb6d820324d..3d2428bd2b2 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_cc_program.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_cc_program.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_cc_program.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_cc_program.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_charge.html b/sphinxman/master/autodir_options_c/cfour__cfour_charge.html
index 4dc62b60ad2..f4e8e02c71f 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_charge.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_charge.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_charge.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_charge.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_cis_conv.html b/sphinxman/master/autodir_options_c/cfour__cfour_cis_conv.html
index cc53dfae028..137e60af65c 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_cis_conv.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_cis_conv.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_cis_conv.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_cis_conv.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_continuum.html b/sphinxman/master/autodir_options_c/cfour__cfour_continuum.html
index 87036fbb88e..5b62b762de0 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_continuum.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_continuum.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_continuum.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_continuum.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_contraction.html b/sphinxman/master/autodir_options_c/cfour__cfour_contraction.html
index 4612567a781..f687ac20c69 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_contraction.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_contraction.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_contraction.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_contraction.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_convergence.html b/sphinxman/master/autodir_options_c/cfour__cfour_convergence.html
index 174c50920f3..69a62e2aee6 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_convergence.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_coordinates.html b/sphinxman/master/autodir_options_c/cfour__cfour_coordinates.html
index ab44d0d4f65..16766d67a17 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_coordinates.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_coordinates.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_coordinates.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_coordinates.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_core_orbitals.html b/sphinxman/master/autodir_options_c/cfour__cfour_core_orbitals.html
index d6ec3e0f57f..6a98f0981e4 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_core_orbitals.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_core_orbitals.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_core_orbitals.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_core_orbitals.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_cphf_conver.html b/sphinxman/master/autodir_options_c/cfour__cfour_cphf_conver.html
index 839b3ee299b..ac825eb892a 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_cphf_conver.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_cphf_conver.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_cphf_conver.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_cphf_conver.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_cphf_maxcyc.html b/sphinxman/master/autodir_options_c/cfour__cfour_cphf_maxcyc.html
index 04ab68cda78..efa6f4604f4 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_cphf_maxcyc.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_cphf_maxcyc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_cphf_maxcyc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_cphf_maxcyc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_curvilinear.html b/sphinxman/master/autodir_options_c/cfour__cfour_curvilinear.html
index 5f0bd70f325..add62214d6b 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_curvilinear.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_curvilinear.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_curvilinear.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_curvilinear.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_dboc.html b/sphinxman/master/autodir_options_c/cfour__cfour_dboc.html
index 7be7659d813..8e1a23505df 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_dboc.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_dboc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_dboc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_dboc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_dct.html b/sphinxman/master/autodir_options_c/cfour__cfour_dct.html
index 612bb761b5e..76a653c77b4 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_dct.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_dct.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_dct.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_dct.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_deriv_level.html b/sphinxman/master/autodir_options_c/cfour__cfour_deriv_level.html
index 27828e4228b..79bdd8be8d8 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_deriv_level.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_deriv_level.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_deriv_level.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_deriv_level.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_diff_type.html b/sphinxman/master/autodir_options_c/cfour__cfour_diff_type.html
index 44200229172..8304150014b 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_diff_type.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_diff_type.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_diff_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_diff_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_dropmo.html b/sphinxman/master/autodir_options_c/cfour__cfour_dropmo.html
index 940e359f9f6..ae20f763767 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_dropmo.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_dropmo.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_dropmo.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_dropmo.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_ecp.html b/sphinxman/master/autodir_options_c/cfour__cfour_ecp.html
index 691a52869bd..0265556dc2d 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_ecp.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_ecp.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_ecp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_ecp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_eigenvector.html b/sphinxman/master/autodir_options_c/cfour__cfour_eigenvector.html
index 09a1adc96e2..a08cf57f649 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_eigenvector.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_eigenvector.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_eigenvector.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_eigenvector.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_el_anharm.html b/sphinxman/master/autodir_options_c/cfour__cfour_el_anharm.html
index 6b59171652f..b314b2a24ed 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_el_anharm.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_el_anharm.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_el_anharm.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_el_anharm.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_eom_nonit.html b/sphinxman/master/autodir_options_c/cfour__cfour_eom_nonit.html
index 16840ec0e17..e80c820b4c2 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_eom_nonit.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_eom_nonit.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_eom_nonit.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_eom_nonit.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_estate_conv.html b/sphinxman/master/autodir_options_c/cfour__cfour_estate_conv.html
index c8cc38cf7ce..e7b7a9333fd 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_estate_conv.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_estate_conv.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_estate_conv.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_estate_conv.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_estate_maxcyc.html b/sphinxman/master/autodir_options_c/cfour__cfour_estate_maxcyc.html
index 104bfcc84a6..aaed6e3b05a 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_estate_maxcyc.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_estate_maxcyc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_estate_maxcyc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_estate_maxcyc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_estate_prop.html b/sphinxman/master/autodir_options_c/cfour__cfour_estate_prop.html
index a7ba4369d5e..06d143ee203 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_estate_prop.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_estate_prop.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_estate_prop.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_estate_prop.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_estate_sym.html b/sphinxman/master/autodir_options_c/cfour__cfour_estate_sym.html
index d77d12c9d01..eba9edcfeb0 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_estate_sym.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_estate_sym.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_estate_sym.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_estate_sym.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_estate_trans.html b/sphinxman/master/autodir_options_c/cfour__cfour_estate_trans.html
index 2d26c40565d..c9e94aed737 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_estate_trans.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_estate_trans.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_estate_trans.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_estate_trans.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_eval_hess.html b/sphinxman/master/autodir_options_c/cfour__cfour_eval_hess.html
index f64aa18b9fe..888f6a25d65 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_eval_hess.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_eval_hess.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_eval_hess.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_eval_hess.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_excitation.html b/sphinxman/master/autodir_options_c/cfour__cfour_excitation.html
index 0169870cb1e..6f0aaf76c1d 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_excitation.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_excitation.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_excitation.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_excitation.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_excite.html b/sphinxman/master/autodir_options_c/cfour__cfour_excite.html
index edc2295ac7e..6e01a78aabc 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_excite.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_excite.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_excite.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_excite.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_fc_field.html b/sphinxman/master/autodir_options_c/cfour__cfour_fc_field.html
index 71d86e33677..babebd8b0f8 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_fc_field.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_fc_field.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_fc_field.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_fc_field.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_fd_calctype.html b/sphinxman/master/autodir_options_c/cfour__cfour_fd_calctype.html
index 91fd1e8b47f..f1cb463482a 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_fd_calctype.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_fd_calctype.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_fd_calctype.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_fd_calctype.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_fd_irreps.html b/sphinxman/master/autodir_options_c/cfour__cfour_fd_irreps.html
index 09c0246e37b..6bbff9ef3a5 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_fd_irreps.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_fd_irreps.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_fd_irreps.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_fd_irreps.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_fd_project.html b/sphinxman/master/autodir_options_c/cfour__cfour_fd_project.html
index 70c51e35216..7d08ea7856a 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_fd_project.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_fd_project.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_fd_project.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_fd_project.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_fd_stepsize.html b/sphinxman/master/autodir_options_c/cfour__cfour_fd_stepsize.html
index f81f5912863..3b5d09d4b69 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_fd_stepsize.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_fd_stepsize.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_fd_stepsize.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_fd_stepsize.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_fd_usegroup.html b/sphinxman/master/autodir_options_c/cfour__cfour_fd_usegroup.html
index 708c7ddd054..56fbb6d0088 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_fd_usegroup.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_fd_usegroup.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_fd_usegroup.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_fd_usegroup.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_file_recsiz.html b/sphinxman/master/autodir_options_c/cfour__cfour_file_recsiz.html
index 3e7290cf884..75f89d1eecc 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_file_recsiz.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_file_recsiz.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_file_recsiz.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_file_recsiz.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_file_stripe.html b/sphinxman/master/autodir_options_c/cfour__cfour_file_stripe.html
index cde91066037..a8ebddf8ad3 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_file_stripe.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_file_stripe.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_file_stripe.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_file_stripe.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_finite_perturbation.html b/sphinxman/master/autodir_options_c/cfour__cfour_finite_perturbation.html
index 3660e70dbe2..0a486898963 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_finite_perturbation.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_finite_perturbation.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_finite_perturbation.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_finite_perturbation.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_fock.html b/sphinxman/master/autodir_options_c/cfour__cfour_fock.html
index 1c2f2d9fc53..01586fef486 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_fock.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_fock.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_fock.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_fock.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_freq_algorithm.html b/sphinxman/master/autodir_options_c/cfour__cfour_freq_algorithm.html
index b0e15a6bde4..8eca16c5397 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_freq_algorithm.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_freq_algorithm.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_freq_algorithm.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_freq_algorithm.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_frozen_core.html b/sphinxman/master/autodir_options_c/cfour__cfour_frozen_core.html
index 54e018a299a..6a82e3b0c1e 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_frozen_core.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_frozen_core.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_frozen_core.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_frozen_core.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_frozen_virt.html b/sphinxman/master/autodir_options_c/cfour__cfour_frozen_virt.html
index a21a5a9d9f3..c2bb463bea1 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_frozen_virt.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_frozen_virt.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_frozen_virt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_frozen_virt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_gamma_abcd.html b/sphinxman/master/autodir_options_c/cfour__cfour_gamma_abcd.html
index 23f6f0fa72b..8f0ec720191 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_gamma_abcd.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_gamma_abcd.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_gamma_abcd.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_gamma_abcd.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_genbas_1.html b/sphinxman/master/autodir_options_c/cfour__cfour_genbas_1.html
index 52051fd2168..cffed544c46 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_genbas_1.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_genbas_1.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_genbas_1.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_genbas_1.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_genbas_2.html b/sphinxman/master/autodir_options_c/cfour__cfour_genbas_2.html
index 580078adeab..f037db726f2 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_genbas_2.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_genbas_2.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_genbas_2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_genbas_2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_genbas_3.html b/sphinxman/master/autodir_options_c/cfour__cfour_genbas_3.html
index 7e80f3000c7..da3b49812d3 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_genbas_3.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_genbas_3.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_genbas_3.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_genbas_3.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_genbas_4.html b/sphinxman/master/autodir_options_c/cfour__cfour_genbas_4.html
index b8525700889..1fac961bbd8 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_genbas_4.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_genbas_4.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_genbas_4.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_genbas_4.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_geo_conv.html b/sphinxman/master/autodir_options_c/cfour__cfour_geo_conv.html
index 9762b3be420..ffdc94c3331 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_geo_conv.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_geo_conv.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_geo_conv.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_geo_conv.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_geo_maxcyc.html b/sphinxman/master/autodir_options_c/cfour__cfour_geo_maxcyc.html
index ee07774863a..65768a6fcfd 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_geo_maxcyc.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_geo_maxcyc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_geo_maxcyc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_geo_maxcyc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_geo_maxstep.html b/sphinxman/master/autodir_options_c/cfour__cfour_geo_maxstep.html
index 95d32694f06..343f0cc1270 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_geo_maxstep.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_geo_maxstep.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_geo_maxstep.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_geo_maxstep.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_geo_method.html b/sphinxman/master/autodir_options_c/cfour__cfour_geo_method.html
index e5fee8c7b94..283c59b5633 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_geo_method.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_geo_method.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_geo_method.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_geo_method.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_giao.html b/sphinxman/master/autodir_options_c/cfour__cfour_giao.html
index 0a557ec418e..d23fedb50ef 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_giao.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_giao.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_giao.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_giao.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_grid.html b/sphinxman/master/autodir_options_c/cfour__cfour_grid.html
index ee603417708..618970cfecc 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_grid.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_grid.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_grid.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_grid.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_guess.html b/sphinxman/master/autodir_options_c/cfour__cfour_guess.html
index 3d3295b1d25..5853ad252ce 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_guess.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_guess.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_guess.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_guess.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_hbar.html b/sphinxman/master/autodir_options_c/cfour__cfour_hbar.html
index 174c54f0ca4..cbfdec6fc82 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_hbar.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_hbar.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_hbar.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_hbar.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_hfstability.html b/sphinxman/master/autodir_options_c/cfour__cfour_hfstability.html
index 9808c1e9147..b3972632ff3 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_hfstability.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_hfstability.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_hfstability.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_hfstability.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_incore.html b/sphinxman/master/autodir_options_c/cfour__cfour_incore.html
index 6d7311756cf..fd8af05c4ac 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_incore.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_incore.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_incore.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_incore.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_input_mrcc.html b/sphinxman/master/autodir_options_c/cfour__cfour_input_mrcc.html
index 34c1b11c8ce..92fc54ce56b 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_input_mrcc.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_input_mrcc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_input_mrcc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_input_mrcc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_integrals.html b/sphinxman/master/autodir_options_c/cfour__cfour_integrals.html
index a801cc01926..357c141bd4c 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_integrals.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_integrals.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_integrals.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_integrals.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_joda_print.html b/sphinxman/master/autodir_options_c/cfour__cfour_joda_print.html
index 8f3bf9ac478..0334aa06728 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_joda_print.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_joda_print.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_joda_print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_joda_print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_lineq_conv.html b/sphinxman/master/autodir_options_c/cfour__cfour_lineq_conv.html
index fd76442ce07..ffd20e6e128 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_lineq_conv.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_lineq_conv.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_lineq_conv.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_lineq_conv.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_lineq_maxcy.html b/sphinxman/master/autodir_options_c/cfour__cfour_lineq_maxcy.html
index 11b8836fb1f..15b71067922 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_lineq_maxcy.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_lineq_maxcy.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_lineq_maxcy.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_lineq_maxcy.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_lineq_type.html b/sphinxman/master/autodir_options_c/cfour__cfour_lineq_type.html
index f57af51ab13..bea8ac37fca 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_lineq_type.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_lineq_type.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_lineq_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_lineq_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_lock_orbocc.html b/sphinxman/master/autodir_options_c/cfour__cfour_lock_orbocc.html
index 307959a348b..14c789adeed 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_lock_orbocc.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_lock_orbocc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_lock_orbocc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_lock_orbocc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_maxstep.html b/sphinxman/master/autodir_options_c/cfour__cfour_maxstep.html
index 91976fc557b..f21ffdda149 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_maxstep.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_maxstep.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_maxstep.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_maxstep.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_mem_unit.html b/sphinxman/master/autodir_options_c/cfour__cfour_mem_unit.html
index c4551b19fa0..e77f48b7b50 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_mem_unit.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_mem_unit.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_mem_unit.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_mem_unit.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_memory_size.html b/sphinxman/master/autodir_options_c/cfour__cfour_memory_size.html
index 910b914d5e7..ad6555fdec1 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_memory_size.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_memory_size.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_memory_size.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_memory_size.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_method.html b/sphinxman/master/autodir_options_c/cfour__cfour_method.html
index 400d4da594e..c77a951eb44 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_method.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_method.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_method.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_method.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_mrcc.html b/sphinxman/master/autodir_options_c/cfour__cfour_mrcc.html
index 7d6a0a0fe95..81b18e09653 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_mrcc.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_mrcc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_mrcc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_mrcc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_multiplicity.html b/sphinxman/master/autodir_options_c/cfour__cfour_multiplicity.html
index d02c2a74b78..6eae180cf37 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_multiplicity.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_multiplicity.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_multiplicity.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_multiplicity.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_nacoupling.html b/sphinxman/master/autodir_options_c/cfour__cfour_nacoupling.html
index 2d55a124f08..2d65fd1b96c 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_nacoupling.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_nacoupling.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_nacoupling.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_nacoupling.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_negeval.html b/sphinxman/master/autodir_options_c/cfour__cfour_negeval.html
index a656860109b..a3360689f3d 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_negeval.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_negeval.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_negeval.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_negeval.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_newnorm.html b/sphinxman/master/autodir_options_c/cfour__cfour_newnorm.html
index 4a39755ce7f..5d0704be9f1 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_newnorm.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_newnorm.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_newnorm.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_newnorm.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_nonhf.html b/sphinxman/master/autodir_options_c/cfour__cfour_nonhf.html
index 90176018681..bc82697009d 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_nonhf.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_nonhf.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_nonhf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_nonhf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_ntop_tamp.html b/sphinxman/master/autodir_options_c/cfour__cfour_ntop_tamp.html
index 0b0b6716ceb..bb9928e8a56 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_ntop_tamp.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_ntop_tamp.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_ntop_tamp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_ntop_tamp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_occupation.html b/sphinxman/master/autodir_options_c/cfour__cfour_occupation.html
index 64b9df3138f..1d48098b9c9 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_occupation.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_occupation.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_occupation.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_occupation.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_omp_num_threads.html b/sphinxman/master/autodir_options_c/cfour__cfour_omp_num_threads.html
index 5b241e34f27..b915cb3520b 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_omp_num_threads.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_omp_num_threads.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_omp_num_threads.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_omp_num_threads.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_open-shell.html b/sphinxman/master/autodir_options_c/cfour__cfour_open-shell.html
index 2322850cc8a..f98353e7df7 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_open-shell.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_open-shell.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_open-shell.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_open-shell.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_opt_maxcyc.html b/sphinxman/master/autodir_options_c/cfour__cfour_opt_maxcyc.html
index 13fb61b1dba..034d3d44021 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_opt_maxcyc.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_opt_maxcyc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_opt_maxcyc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_opt_maxcyc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_orbitals.html b/sphinxman/master/autodir_options_c/cfour__cfour_orbitals.html
index 9a44f558e4a..9f843a91cd3 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_orbitals.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_orbitals.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_orbitals.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_orbitals.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_pert_orb.html b/sphinxman/master/autodir_options_c/cfour__cfour_pert_orb.html
index a24f4ea8202..5ef9dc71608 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_pert_orb.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_pert_orb.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_pert_orb.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_pert_orb.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_points.html b/sphinxman/master/autodir_options_c/cfour__cfour_points.html
index 25e2e9a3416..62b31fecd97 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_points.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_points.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_print.html b/sphinxman/master/autodir_options_c/cfour__cfour_print.html
index 6f52c4f21c4..2606d34f55d 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_print.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_print.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_prop_integral.html b/sphinxman/master/autodir_options_c/cfour__cfour_prop_integral.html
index 978ae2fa22e..d60e93aea26 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_prop_integral.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_prop_integral.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_prop_integral.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_prop_integral.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_props.html b/sphinxman/master/autodir_options_c/cfour__cfour_props.html
index 490f9b1aed7..fdc4a906d31 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_props.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_props.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_props.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_props.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_qrhf_general.html b/sphinxman/master/autodir_options_c/cfour__cfour_qrhf_general.html
index 24d1fd338c0..59223274dae 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_qrhf_general.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_qrhf_general.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_qrhf_general.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_qrhf_general.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_qrhf_orbital.html b/sphinxman/master/autodir_options_c/cfour__cfour_qrhf_orbital.html
index 73a74274c33..f3c49d50f4d 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_qrhf_orbital.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_qrhf_orbital.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_qrhf_orbital.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_qrhf_orbital.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_qrhfgues.html b/sphinxman/master/autodir_options_c/cfour__cfour_qrhfgues.html
index c1235854564..69afeaad75c 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_qrhfgues.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_qrhfgues.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_qrhfgues.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_qrhfgues.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_raman_int.html b/sphinxman/master/autodir_options_c/cfour__cfour_raman_int.html
index bd0b48ce44f..bec16a9e641 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_raman_int.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_raman_int.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_raman_int.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_raman_int.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_raman_orb.html b/sphinxman/master/autodir_options_c/cfour__cfour_raman_orb.html
index 5db7b6b1abc..0191ec835e2 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_raman_orb.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_raman_orb.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_raman_orb.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_raman_orb.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_rdo.html b/sphinxman/master/autodir_options_c/cfour__cfour_rdo.html
index db613fdc9dd..7933ef950a0 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_rdo.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_rdo.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_rdo.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_rdo.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_reference.html b/sphinxman/master/autodir_options_c/cfour__cfour_reference.html
index f2e7d2d2779..d9acae65201 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_reference.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_reference.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_reference.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_reference.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_relativistic.html b/sphinxman/master/autodir_options_c/cfour__cfour_relativistic.html
index f2188cd2ef7..6b234f6a74f 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_relativistic.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_relativistic.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_relativistic.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_relativistic.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_relax_dens.html b/sphinxman/master/autodir_options_c/cfour__cfour_relax_dens.html
index 4e1e56a0303..ec0e8a5f3fd 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_relax_dens.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_relax_dens.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_relax_dens.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_relax_dens.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_res_raman.html b/sphinxman/master/autodir_options_c/cfour__cfour_res_raman.html
index 573a7131eeb..d18c928db7e 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_res_raman.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_res_raman.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_res_raman.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_res_raman.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_restart_cc.html b/sphinxman/master/autodir_options_c/cfour__cfour_restart_cc.html
index 37710c53816..42e85b66890 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_restart_cc.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_restart_cc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_restart_cc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_restart_cc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_rot_evec.html b/sphinxman/master/autodir_options_c/cfour__cfour_rot_evec.html
index 47b2be63475..cb9e8dffb95 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_rot_evec.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_rot_evec.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_rot_evec.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_rot_evec.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_save_ints.html b/sphinxman/master/autodir_options_c/cfour__cfour_save_ints.html
index 7579b87219f..deb7ba15937 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_save_ints.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_save_ints.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_save_ints.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_save_ints.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_scale_on.html b/sphinxman/master/autodir_options_c/cfour__cfour_scale_on.html
index bbc0827922a..2a0b7b06678 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_scale_on.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_scale_on.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_scale_on.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_scale_on.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_scf_conv.html b/sphinxman/master/autodir_options_c/cfour__cfour_scf_conv.html
index 76f591a27d5..2640baa8cc7 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_scf_conv.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_scf_conv.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_scf_conv.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_scf_conv.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_scf_damping.html b/sphinxman/master/autodir_options_c/cfour__cfour_scf_damping.html
index 68ac4ae83e7..a1c2fa6ec7e 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_scf_damping.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_scf_damping.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_scf_damping.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_scf_damping.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_scf_exporder.html b/sphinxman/master/autodir_options_c/cfour__cfour_scf_exporder.html
index 8b41ab8ba41..a432b164008 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_scf_exporder.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_scf_exporder.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_scf_exporder.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_scf_exporder.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_scf_expstart.html b/sphinxman/master/autodir_options_c/cfour__cfour_scf_expstart.html
index 4913f146037..a873bc443e0 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_scf_expstart.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_scf_expstart.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_scf_expstart.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_scf_expstart.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_scf_extrapolation.html b/sphinxman/master/autodir_options_c/cfour__cfour_scf_extrapolation.html
index d4575c07f33..9a82562348e 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_scf_extrapolation.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_scf_extrapolation.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_scf_extrapolation.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_scf_extrapolation.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_scf_maxcyc.html b/sphinxman/master/autodir_options_c/cfour__cfour_scf_maxcyc.html
index a2fc3fdfbb0..a1fc64ac00d 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_scf_maxcyc.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_scf_maxcyc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_scf_maxcyc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_scf_maxcyc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_sd_field.html b/sphinxman/master/autodir_options_c/cfour__cfour_sd_field.html
index 0c248b7d992..0e361f9f6e2 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_sd_field.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_sd_field.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_sd_field.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_sd_field.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_spherical.html b/sphinxman/master/autodir_options_c/cfour__cfour_spherical.html
index 6ee489a9b64..394153d1eb2 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_spherical.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_spherical.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_spherical.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_spherical.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_spin_flip.html b/sphinxman/master/autodir_options_c/cfour__cfour_spin_flip.html
index 9b357951cc5..da293b3a3fd 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_spin_flip.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_spin_flip.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_spin_flip.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_spin_flip.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_spin_orbit.html b/sphinxman/master/autodir_options_c/cfour__cfour_spin_orbit.html
index ac5fa5e529d..6fe23f6b3c2 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_spin_orbit.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_spin_orbit.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_spin_orbit.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_spin_orbit.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_spin_scal.html b/sphinxman/master/autodir_options_c/cfour__cfour_spin_scal.html
index 2ec9aec0c33..3a7e2bf3b46 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_spin_scal.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_spin_scal.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_spin_scal.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_spin_scal.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_spinrotation.html b/sphinxman/master/autodir_options_c/cfour__cfour_spinrotation.html
index cb8038d9002..64f82cfc2e1 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_spinrotation.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_spinrotation.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_spinrotation.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_spinrotation.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_subgroup.html b/sphinxman/master/autodir_options_c/cfour__cfour_subgroup.html
index c495a4d5bfb..ce6eb09c017 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_subgroup.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_subgroup.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_subgroup.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_subgroup.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_sym_check.html b/sphinxman/master/autodir_options_c/cfour__cfour_sym_check.html
index 4260761f87d..478bf9eac47 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_sym_check.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_sym_check.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_sym_check.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_sym_check.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_symmetry.html b/sphinxman/master/autodir_options_c/cfour__cfour_symmetry.html
index 8911b9c0315..ade9395cf6b 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_symmetry.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_symmetry.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_symmetry.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_symmetry.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_t3_extrapol.html b/sphinxman/master/autodir_options_c/cfour__cfour_t3_extrapol.html
index ba926a7fb06..36799b840ab 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_t3_extrapol.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_t3_extrapol.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_t3_extrapol.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_t3_extrapol.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_tamp_sum.html b/sphinxman/master/autodir_options_c/cfour__cfour_tamp_sum.html
index 4894c6dd602..f1f6a10af8e 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_tamp_sum.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_tamp_sum.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_tamp_sum.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_tamp_sum.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_thermochemistry.html b/sphinxman/master/autodir_options_c/cfour__cfour_thermochemistry.html
index 7ec3d523d6c..daef8de040e 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_thermochemistry.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_thermochemistry.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_thermochemistry.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_thermochemistry.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_trans_inv.html b/sphinxman/master/autodir_options_c/cfour__cfour_trans_inv.html
index 6dd235c7b0d..363086d684a 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_trans_inv.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_trans_inv.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_trans_inv.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_trans_inv.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_treat_pert.html b/sphinxman/master/autodir_options_c/cfour__cfour_treat_pert.html
index 98ddb5fd0ec..0043ec976ab 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_treat_pert.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_treat_pert.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_treat_pert.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_treat_pert.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_uij_threshold.html b/sphinxman/master/autodir_options_c/cfour__cfour_uij_threshold.html
index dbf7c77de89..5b579550c56 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_uij_threshold.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_uij_threshold.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_uij_threshold.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_uij_threshold.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_units.html b/sphinxman/master/autodir_options_c/cfour__cfour_units.html
index c0a29bc8f2a..6fec595c4f9 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_units.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_units.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_units.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_units.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_update_hessian.html b/sphinxman/master/autodir_options_c/cfour__cfour_update_hessian.html
index f26872d763e..7e20705a887 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_update_hessian.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_update_hessian.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_update_hessian.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_update_hessian.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_vibration.html b/sphinxman/master/autodir_options_c/cfour__cfour_vibration.html
index 86d65e1f855..66bbb8b57a6 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_vibration.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_vibration.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_vibration.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_vibration.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_vtran.html b/sphinxman/master/autodir_options_c/cfour__cfour_vtran.html
index 6b674fe2441..cac5b03d9fc 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_vtran.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_vtran.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_vtran.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_vtran.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_xfield.html b/sphinxman/master/autodir_options_c/cfour__cfour_xfield.html
index 64aecec82b7..886925029ca 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_xfield.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_xfield.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_xfield.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_xfield.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_xform_tol.html b/sphinxman/master/autodir_options_c/cfour__cfour_xform_tol.html
index d9c372a0313..c771a5f8601 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_xform_tol.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_xform_tol.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_xform_tol.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_xform_tol.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_yfield.html b/sphinxman/master/autodir_options_c/cfour__cfour_yfield.html
index f94161b32c8..39be62d43c4 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_yfield.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_yfield.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_yfield.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_yfield.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__cfour_zfield.html b/sphinxman/master/autodir_options_c/cfour__cfour_zfield.html
index 4ab1ef262e7..589cee756dd 100644
--- a/sphinxman/master/autodir_options_c/cfour__cfour_zfield.html
+++ b/sphinxman/master/autodir_options_c/cfour__cfour_zfield.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_zfield.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__cfour_zfield.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cfour__translate_psi4.html b/sphinxman/master/autodir_options_c/cfour__translate_psi4.html
index b6a88d75bf2..36dafeec27d 100644
--- a/sphinxman/master/autodir_options_c/cfour__translate_psi4.html
+++ b/sphinxman/master/autodir_options_c/cfour__translate_psi4.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__translate_psi4.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cfour__translate_psi4.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cphf__cphf_mem_safety_factor.html b/sphinxman/master/autodir_options_c/cphf__cphf_mem_safety_factor.html
index 12613dc2792..ee264afe854 100644
--- a/sphinxman/master/autodir_options_c/cphf__cphf_mem_safety_factor.html
+++ b/sphinxman/master/autodir_options_c/cphf__cphf_mem_safety_factor.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cphf__cphf_mem_safety_factor.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cphf__cphf_mem_safety_factor.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cphf__cphf_tasks.html b/sphinxman/master/autodir_options_c/cphf__cphf_tasks.html
index 68f0bcc2f47..5e94f33a618 100644
--- a/sphinxman/master/autodir_options_c/cphf__cphf_tasks.html
+++ b/sphinxman/master/autodir_options_c/cphf__cphf_tasks.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cphf__cphf_tasks.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cphf__cphf_tasks.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cphf__debug.html b/sphinxman/master/autodir_options_c/cphf__debug.html
index 87de7c245ce..72013fd085b 100644
--- a/sphinxman/master/autodir_options_c/cphf__debug.html
+++ b/sphinxman/master/autodir_options_c/cphf__debug.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cphf__debug.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cphf__debug.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cphf__df_basis_scf.html b/sphinxman/master/autodir_options_c/cphf__df_basis_scf.html
index 0bc4bdb0480..62c30c8e2a3 100644
--- a/sphinxman/master/autodir_options_c/cphf__df_basis_scf.html
+++ b/sphinxman/master/autodir_options_c/cphf__df_basis_scf.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cphf__df_basis_scf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cphf__df_basis_scf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cphf__explicit_hamiltonian.html b/sphinxman/master/autodir_options_c/cphf__explicit_hamiltonian.html
index 189058de2bc..9451da44c00 100644
--- a/sphinxman/master/autodir_options_c/cphf__explicit_hamiltonian.html
+++ b/sphinxman/master/autodir_options_c/cphf__explicit_hamiltonian.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cphf__explicit_hamiltonian.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cphf__explicit_hamiltonian.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cphf__module.html b/sphinxman/master/autodir_options_c/cphf__module.html
index 109393f4ed3..5dcf1ca23e2 100644
--- a/sphinxman/master/autodir_options_c/cphf__module.html
+++ b/sphinxman/master/autodir_options_c/cphf__module.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cphf__module.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cphf__module.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cphf__print.html b/sphinxman/master/autodir_options_c/cphf__print.html
index e06d8bcfa25..945f49f87db 100644
--- a/sphinxman/master/autodir_options_c/cphf__print.html
+++ b/sphinxman/master/autodir_options_c/cphf__print.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cphf__print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cphf__print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cphf__scf_type.html b/sphinxman/master/autodir_options_c/cphf__scf_type.html
index 40c95c19147..e9ad44e5d3d 100644
--- a/sphinxman/master/autodir_options_c/cphf__scf_type.html
+++ b/sphinxman/master/autodir_options_c/cphf__scf_type.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cphf__scf_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cphf__scf_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cphf__solver_convergence.html b/sphinxman/master/autodir_options_c/cphf__solver_convergence.html
index e67bf3869fd..e0cc4047345 100644
--- a/sphinxman/master/autodir_options_c/cphf__solver_convergence.html
+++ b/sphinxman/master/autodir_options_c/cphf__solver_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cphf__solver_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cphf__solver_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cphf__solver_maxiter.html b/sphinxman/master/autodir_options_c/cphf__solver_maxiter.html
index 870c4930ebf..7cb033a7d6e 100644
--- a/sphinxman/master/autodir_options_c/cphf__solver_maxiter.html
+++ b/sphinxman/master/autodir_options_c/cphf__solver_maxiter.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cphf__solver_maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cphf__solver_maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cphf__solver_n_guess.html b/sphinxman/master/autodir_options_c/cphf__solver_n_guess.html
index 1b2ec2cb2da..e7deebe59c5 100644
--- a/sphinxman/master/autodir_options_c/cphf__solver_n_guess.html
+++ b/sphinxman/master/autodir_options_c/cphf__solver_n_guess.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cphf__solver_n_guess.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cphf__solver_n_guess.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/cphf__solver_precondition.html b/sphinxman/master/autodir_options_c/cphf__solver_precondition.html
index a664afbba47..8a886d953e4 100644
--- a/sphinxman/master/autodir_options_c/cphf__solver_precondition.html
+++ b/sphinxman/master/autodir_options_c/cphf__solver_precondition.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cphf__solver_precondition.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/cphf__solver_precondition.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dct__algorithm.html b/sphinxman/master/autodir_options_c/dct__algorithm.html
index b751a69b0b2..c1fa4082b2e 100644
--- a/sphinxman/master/autodir_options_c/dct__algorithm.html
+++ b/sphinxman/master/autodir_options_c/dct__algorithm.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__algorithm.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__algorithm.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dct__ao_basis.html b/sphinxman/master/autodir_options_c/dct__ao_basis.html
index a85ef05101b..5f6717beb31 100644
--- a/sphinxman/master/autodir_options_c/dct__ao_basis.html
+++ b/sphinxman/master/autodir_options_c/dct__ao_basis.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__ao_basis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__ao_basis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dct__cachelevel.html b/sphinxman/master/autodir_options_c/dct__cachelevel.html
index 67111999c7e..104e90c8bdf 100644
--- a/sphinxman/master/autodir_options_c/dct__cachelevel.html
+++ b/sphinxman/master/autodir_options_c/dct__cachelevel.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__cachelevel.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__cachelevel.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dct__damping_percentage.html b/sphinxman/master/autodir_options_c/dct__damping_percentage.html
index 0a371e96500..5c36587ac44 100644
--- a/sphinxman/master/autodir_options_c/dct__damping_percentage.html
+++ b/sphinxman/master/autodir_options_c/dct__damping_percentage.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__damping_percentage.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__damping_percentage.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dct__dct_functional.html b/sphinxman/master/autodir_options_c/dct__dct_functional.html
index 1a2d12024ec..baef989a53b 100644
--- a/sphinxman/master/autodir_options_c/dct__dct_functional.html
+++ b/sphinxman/master/autodir_options_c/dct__dct_functional.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__dct_functional.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__dct_functional.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dct__dct_guess.html b/sphinxman/master/autodir_options_c/dct__dct_guess.html
index d480e83ccd3..472925738f4 100644
--- a/sphinxman/master/autodir_options_c/dct__dct_guess.html
+++ b/sphinxman/master/autodir_options_c/dct__dct_guess.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__dct_guess.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__dct_guess.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dct__dct_type.html b/sphinxman/master/autodir_options_c/dct__dct_type.html
index 2fd95dbc3fe..845d33a0a33 100644
--- a/sphinxman/master/autodir_options_c/dct__dct_type.html
+++ b/sphinxman/master/autodir_options_c/dct__dct_type.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__dct_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__dct_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dct__df_basis_dct.html b/sphinxman/master/autodir_options_c/dct__df_basis_dct.html
index 2312d6fc3c7..da668c8a313 100644
--- a/sphinxman/master/autodir_options_c/dct__df_basis_dct.html
+++ b/sphinxman/master/autodir_options_c/dct__df_basis_dct.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__df_basis_dct.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__df_basis_dct.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dct__diis_max_vecs.html b/sphinxman/master/autodir_options_c/dct__diis_max_vecs.html
index ec82bf4bab1..520709c60a7 100644
--- a/sphinxman/master/autodir_options_c/dct__diis_max_vecs.html
+++ b/sphinxman/master/autodir_options_c/dct__diis_max_vecs.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__diis_max_vecs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__diis_max_vecs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dct__diis_min_vecs.html b/sphinxman/master/autodir_options_c/dct__diis_min_vecs.html
index cc7cb67ade7..4e022039dd4 100644
--- a/sphinxman/master/autodir_options_c/dct__diis_min_vecs.html
+++ b/sphinxman/master/autodir_options_c/dct__diis_min_vecs.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__diis_min_vecs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__diis_min_vecs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dct__diis_start_convergence.html b/sphinxman/master/autodir_options_c/dct__diis_start_convergence.html
index feb5aaddacd..6a39cb06bfd 100644
--- a/sphinxman/master/autodir_options_c/dct__diis_start_convergence.html
+++ b/sphinxman/master/autodir_options_c/dct__diis_start_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__diis_start_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__diis_start_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dct__e_convergence.html b/sphinxman/master/autodir_options_c/dct__e_convergence.html
index 7c3cc724aba..43c048363a7 100644
--- a/sphinxman/master/autodir_options_c/dct__e_convergence.html
+++ b/sphinxman/master/autodir_options_c/dct__e_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__e_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__e_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dct__energy_level_shift.html b/sphinxman/master/autodir_options_c/dct__energy_level_shift.html
index 83d92df0e11..39a6f663a96 100644
--- a/sphinxman/master/autodir_options_c/dct__energy_level_shift.html
+++ b/sphinxman/master/autodir_options_c/dct__energy_level_shift.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__energy_level_shift.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__energy_level_shift.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dct__guess_r_convergence.html b/sphinxman/master/autodir_options_c/dct__guess_r_convergence.html
index 1cf7edf5b3a..ea6a97b1cff 100644
--- a/sphinxman/master/autodir_options_c/dct__guess_r_convergence.html
+++ b/sphinxman/master/autodir_options_c/dct__guess_r_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__guess_r_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__guess_r_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dct__ints_tolerance.html b/sphinxman/master/autodir_options_c/dct__ints_tolerance.html
index 19c11378099..72969b1adb0 100644
--- a/sphinxman/master/autodir_options_c/dct__ints_tolerance.html
+++ b/sphinxman/master/autodir_options_c/dct__ints_tolerance.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__ints_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__ints_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dct__maxiter.html b/sphinxman/master/autodir_options_c/dct__maxiter.html
index 3d08bcf26ac..e6250f80160 100644
--- a/sphinxman/master/autodir_options_c/dct__maxiter.html
+++ b/sphinxman/master/autodir_options_c/dct__maxiter.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dct__odc_guess.html b/sphinxman/master/autodir_options_c/dct__odc_guess.html
index a9bc35d45c8..a4d30822713 100644
--- a/sphinxman/master/autodir_options_c/dct__odc_guess.html
+++ b/sphinxman/master/autodir_options_c/dct__odc_guess.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__odc_guess.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__odc_guess.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dct__opdm.html b/sphinxman/master/autodir_options_c/dct__opdm.html
index 49994e78d5f..e6148075f95 100644
--- a/sphinxman/master/autodir_options_c/dct__opdm.html
+++ b/sphinxman/master/autodir_options_c/dct__opdm.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__opdm.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__opdm.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dct__orbital_level_shift.html b/sphinxman/master/autodir_options_c/dct__orbital_level_shift.html
index a8cbcc5dbe8..004dd9f17fb 100644
--- a/sphinxman/master/autodir_options_c/dct__orbital_level_shift.html
+++ b/sphinxman/master/autodir_options_c/dct__orbital_level_shift.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__orbital_level_shift.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__orbital_level_shift.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dct__qc_coupling.html b/sphinxman/master/autodir_options_c/dct__qc_coupling.html
index c93cc908b6c..cb16c30a121 100644
--- a/sphinxman/master/autodir_options_c/dct__qc_coupling.html
+++ b/sphinxman/master/autodir_options_c/dct__qc_coupling.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__qc_coupling.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__qc_coupling.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dct__qc_type.html b/sphinxman/master/autodir_options_c/dct__qc_type.html
index ad88088d3c5..21bb12a921f 100644
--- a/sphinxman/master/autodir_options_c/dct__qc_type.html
+++ b/sphinxman/master/autodir_options_c/dct__qc_type.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__qc_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__qc_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dct__r_convergence.html b/sphinxman/master/autodir_options_c/dct__r_convergence.html
index 1dac706bc67..5777356b502 100644
--- a/sphinxman/master/autodir_options_c/dct__r_convergence.html
+++ b/sphinxman/master/autodir_options_c/dct__r_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__r_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__r_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dct__reference.html b/sphinxman/master/autodir_options_c/dct__reference.html
index 80336a2cebb..0a148482d84 100644
--- a/sphinxman/master/autodir_options_c/dct__reference.html
+++ b/sphinxman/master/autodir_options_c/dct__reference.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__reference.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__reference.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dct__relax_guess_orbitals.html b/sphinxman/master/autodir_options_c/dct__relax_guess_orbitals.html
index b92050afbbb..1a019752823 100644
--- a/sphinxman/master/autodir_options_c/dct__relax_guess_orbitals.html
+++ b/sphinxman/master/autodir_options_c/dct__relax_guess_orbitals.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__relax_guess_orbitals.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__relax_guess_orbitals.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dct__response_algorithm.html b/sphinxman/master/autodir_options_c/dct__response_algorithm.html
index a6b85386301..f42b2640f75 100644
--- a/sphinxman/master/autodir_options_c/dct__response_algorithm.html
+++ b/sphinxman/master/autodir_options_c/dct__response_algorithm.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__response_algorithm.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__response_algorithm.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dct__stability_add_vectors.html b/sphinxman/master/autodir_options_c/dct__stability_add_vectors.html
index 864953ffd03..b7457e79a08 100644
--- a/sphinxman/master/autodir_options_c/dct__stability_add_vectors.html
+++ b/sphinxman/master/autodir_options_c/dct__stability_add_vectors.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__stability_add_vectors.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__stability_add_vectors.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dct__stability_augment_space_tol.html b/sphinxman/master/autodir_options_c/dct__stability_augment_space_tol.html
index b7ba0f97e20..0359472236c 100644
--- a/sphinxman/master/autodir_options_c/dct__stability_augment_space_tol.html
+++ b/sphinxman/master/autodir_options_c/dct__stability_augment_space_tol.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__stability_augment_space_tol.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__stability_augment_space_tol.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dct__stability_check.html b/sphinxman/master/autodir_options_c/dct__stability_check.html
index 0978239ea95..3ecd03795cd 100644
--- a/sphinxman/master/autodir_options_c/dct__stability_check.html
+++ b/sphinxman/master/autodir_options_c/dct__stability_check.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__stability_check.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__stability_check.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dct__stability_convergence.html b/sphinxman/master/autodir_options_c/dct__stability_convergence.html
index faab43a9c84..a5c94b6b5c8 100644
--- a/sphinxman/master/autodir_options_c/dct__stability_convergence.html
+++ b/sphinxman/master/autodir_options_c/dct__stability_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__stability_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__stability_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dct__stability_max_space_size.html b/sphinxman/master/autodir_options_c/dct__stability_max_space_size.html
index 0eed90d5e35..0855d6042fa 100644
--- a/sphinxman/master/autodir_options_c/dct__stability_max_space_size.html
+++ b/sphinxman/master/autodir_options_c/dct__stability_max_space_size.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__stability_max_space_size.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__stability_max_space_size.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dct__stability_n_eigenvalues.html b/sphinxman/master/autodir_options_c/dct__stability_n_eigenvalues.html
index db2a0fef43d..8e14a7c6642 100644
--- a/sphinxman/master/autodir_options_c/dct__stability_n_eigenvalues.html
+++ b/sphinxman/master/autodir_options_c/dct__stability_n_eigenvalues.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__stability_n_eigenvalues.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__stability_n_eigenvalues.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dct__stability_n_guess_vectors.html b/sphinxman/master/autodir_options_c/dct__stability_n_guess_vectors.html
index 2b97873a79c..a6fc9f64a82 100644
--- a/sphinxman/master/autodir_options_c/dct__stability_n_guess_vectors.html
+++ b/sphinxman/master/autodir_options_c/dct__stability_n_guess_vectors.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__stability_n_guess_vectors.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__stability_n_guess_vectors.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dct__three_particle.html b/sphinxman/master/autodir_options_c/dct__three_particle.html
index 59d47c0e0ba..bf33c6037d2 100644
--- a/sphinxman/master/autodir_options_c/dct__three_particle.html
+++ b/sphinxman/master/autodir_options_c/dct__three_particle.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__three_particle.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__three_particle.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dct__tikhonow_omega.html b/sphinxman/master/autodir_options_c/dct__tikhonow_omega.html
index b54d59fecc9..1a6103dc6cf 100644
--- a/sphinxman/master/autodir_options_c/dct__tikhonow_omega.html
+++ b/sphinxman/master/autodir_options_c/dct__tikhonow_omega.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__tikhonow_omega.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dct__tikhonow_omega.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ddx__ddx_diis_max_vecs.html b/sphinxman/master/autodir_options_c/ddx__ddx_diis_max_vecs.html
index abb2a0622b6..e417f0f8b9c 100644
--- a/sphinxman/master/autodir_options_c/ddx__ddx_diis_max_vecs.html
+++ b/sphinxman/master/autodir_options_c/ddx__ddx_diis_max_vecs.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ddx__ddx_diis_max_vecs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ddx__ddx_diis_max_vecs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ddx__ddx_eta.html b/sphinxman/master/autodir_options_c/ddx__ddx_eta.html
index 21f2c370c48..1e69b1c1a69 100644
--- a/sphinxman/master/autodir_options_c/ddx__ddx_eta.html
+++ b/sphinxman/master/autodir_options_c/ddx__ddx_eta.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ddx__ddx_eta.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ddx__ddx_eta.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ddx__ddx_fmm.html b/sphinxman/master/autodir_options_c/ddx__ddx_fmm.html
index f5f2adf2997..d9b8f8fed37 100644
--- a/sphinxman/master/autodir_options_c/ddx__ddx_fmm.html
+++ b/sphinxman/master/autodir_options_c/ddx__ddx_fmm.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ddx__ddx_fmm.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ddx__ddx_fmm.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ddx__ddx_fmm_local_lmax.html b/sphinxman/master/autodir_options_c/ddx__ddx_fmm_local_lmax.html
index 90660892e88..070db8b60b5 100644
--- a/sphinxman/master/autodir_options_c/ddx__ddx_fmm_local_lmax.html
+++ b/sphinxman/master/autodir_options_c/ddx__ddx_fmm_local_lmax.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ddx__ddx_fmm_local_lmax.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ddx__ddx_fmm_local_lmax.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ddx__ddx_fmm_multipole_lmax.html b/sphinxman/master/autodir_options_c/ddx__ddx_fmm_multipole_lmax.html
index f3eee877625..19995847863 100644
--- a/sphinxman/master/autodir_options_c/ddx__ddx_fmm_multipole_lmax.html
+++ b/sphinxman/master/autodir_options_c/ddx__ddx_fmm_multipole_lmax.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ddx__ddx_fmm_multipole_lmax.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ddx__ddx_fmm_multipole_lmax.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ddx__ddx_incore.html b/sphinxman/master/autodir_options_c/ddx__ddx_incore.html
index 80ceaf8fd7e..1187945701b 100644
--- a/sphinxman/master/autodir_options_c/ddx__ddx_incore.html
+++ b/sphinxman/master/autodir_options_c/ddx__ddx_incore.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ddx__ddx_incore.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ddx__ddx_incore.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ddx__ddx_lmax.html b/sphinxman/master/autodir_options_c/ddx__ddx_lmax.html
index 678c0ca172f..86b2aad2e79 100644
--- a/sphinxman/master/autodir_options_c/ddx__ddx_lmax.html
+++ b/sphinxman/master/autodir_options_c/ddx__ddx_lmax.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ddx__ddx_lmax.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ddx__ddx_lmax.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ddx__ddx_logfile.html b/sphinxman/master/autodir_options_c/ddx__ddx_logfile.html
index c2c22f608be..b7dee1671ce 100644
--- a/sphinxman/master/autodir_options_c/ddx__ddx_logfile.html
+++ b/sphinxman/master/autodir_options_c/ddx__ddx_logfile.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ddx__ddx_logfile.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ddx__ddx_logfile.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ddx__ddx_maxiter.html b/sphinxman/master/autodir_options_c/ddx__ddx_maxiter.html
index f63419d389c..19795ae5837 100644
--- a/sphinxman/master/autodir_options_c/ddx__ddx_maxiter.html
+++ b/sphinxman/master/autodir_options_c/ddx__ddx_maxiter.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ddx__ddx_maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ddx__ddx_maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ddx__ddx_model.html b/sphinxman/master/autodir_options_c/ddx__ddx_model.html
index 55037a271f5..a08eddd06bc 100644
--- a/sphinxman/master/autodir_options_c/ddx__ddx_model.html
+++ b/sphinxman/master/autodir_options_c/ddx__ddx_model.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ddx__ddx_model.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ddx__ddx_model.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ddx__ddx_n_lebedev.html b/sphinxman/master/autodir_options_c/ddx__ddx_n_lebedev.html
index 0f8c0265159..86947d12b0d 100644
--- a/sphinxman/master/autodir_options_c/ddx__ddx_n_lebedev.html
+++ b/sphinxman/master/autodir_options_c/ddx__ddx_n_lebedev.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ddx__ddx_n_lebedev.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ddx__ddx_n_lebedev.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ddx__ddx_radii.html b/sphinxman/master/autodir_options_c/ddx__ddx_radii.html
index 2179f68a8b5..1c9abd91552 100644
--- a/sphinxman/master/autodir_options_c/ddx__ddx_radii.html
+++ b/sphinxman/master/autodir_options_c/ddx__ddx_radii.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ddx__ddx_radii.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ddx__ddx_radii.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ddx__ddx_radii_scaling.html b/sphinxman/master/autodir_options_c/ddx__ddx_radii_scaling.html
index c2e081d10d6..2d41940b555 100644
--- a/sphinxman/master/autodir_options_c/ddx__ddx_radii_scaling.html
+++ b/sphinxman/master/autodir_options_c/ddx__ddx_radii_scaling.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ddx__ddx_radii_scaling.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ddx__ddx_radii_scaling.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ddx__ddx_radii_set.html b/sphinxman/master/autodir_options_c/ddx__ddx_radii_set.html
index 1523b8aedcf..0dde88d66cd 100644
--- a/sphinxman/master/autodir_options_c/ddx__ddx_radii_set.html
+++ b/sphinxman/master/autodir_options_c/ddx__ddx_radii_set.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ddx__ddx_radii_set.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ddx__ddx_radii_set.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ddx__ddx_shift.html b/sphinxman/master/autodir_options_c/ddx__ddx_shift.html
index 20a04cf3881..4bd88adbf21 100644
--- a/sphinxman/master/autodir_options_c/ddx__ddx_shift.html
+++ b/sphinxman/master/autodir_options_c/ddx__ddx_shift.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ddx__ddx_shift.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ddx__ddx_shift.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ddx__ddx_solute_radial_points.html b/sphinxman/master/autodir_options_c/ddx__ddx_solute_radial_points.html
index a9a66195c63..6ee0a461515 100644
--- a/sphinxman/master/autodir_options_c/ddx__ddx_solute_radial_points.html
+++ b/sphinxman/master/autodir_options_c/ddx__ddx_solute_radial_points.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ddx__ddx_solute_radial_points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ddx__ddx_solute_radial_points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ddx__ddx_solute_spherical_points.html b/sphinxman/master/autodir_options_c/ddx__ddx_solute_spherical_points.html
index 7451752f7c4..c8898058805 100644
--- a/sphinxman/master/autodir_options_c/ddx__ddx_solute_spherical_points.html
+++ b/sphinxman/master/autodir_options_c/ddx__ddx_solute_spherical_points.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ddx__ddx_solute_spherical_points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ddx__ddx_solute_spherical_points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ddx__ddx_solvation_convergence.html b/sphinxman/master/autodir_options_c/ddx__ddx_solvation_convergence.html
index ff3dbf9aceb..5e251517e37 100644
--- a/sphinxman/master/autodir_options_c/ddx__ddx_solvation_convergence.html
+++ b/sphinxman/master/autodir_options_c/ddx__ddx_solvation_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ddx__ddx_solvation_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ddx__ddx_solvation_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ddx__ddx_solvent.html b/sphinxman/master/autodir_options_c/ddx__ddx_solvent.html
index 8f9962be2e0..c96851c519c 100644
--- a/sphinxman/master/autodir_options_c/ddx__ddx_solvent.html
+++ b/sphinxman/master/autodir_options_c/ddx__ddx_solvent.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ddx__ddx_solvent.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ddx__ddx_solvent.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ddx__ddx_solvent_epsilon.html b/sphinxman/master/autodir_options_c/ddx__ddx_solvent_epsilon.html
index bdce1cb4cb5..3a910e51872 100644
--- a/sphinxman/master/autodir_options_c/ddx__ddx_solvent_epsilon.html
+++ b/sphinxman/master/autodir_options_c/ddx__ddx_solvent_epsilon.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ddx__ddx_solvent_epsilon.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ddx__ddx_solvent_epsilon.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ddx__ddx_solvent_epsilon_optical.html b/sphinxman/master/autodir_options_c/ddx__ddx_solvent_epsilon_optical.html
index 60bad29277b..3e493d65b3d 100644
--- a/sphinxman/master/autodir_options_c/ddx__ddx_solvent_epsilon_optical.html
+++ b/sphinxman/master/autodir_options_c/ddx__ddx_solvent_epsilon_optical.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ddx__ddx_solvent_epsilon_optical.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ddx__ddx_solvent_epsilon_optical.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/ddx__ddx_solvent_kappa.html b/sphinxman/master/autodir_options_c/ddx__ddx_solvent_kappa.html
index 541bd8eec09..671343497e2 100644
--- a/sphinxman/master/autodir_options_c/ddx__ddx_solvent_kappa.html
+++ b/sphinxman/master/autodir_options_c/ddx__ddx_solvent_kappa.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ddx__ddx_solvent_kappa.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/ddx__ddx_solvent_kappa.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__a_ras3_max.html b/sphinxman/master/autodir_options_c/detci__a_ras3_max.html
index ed828434610..a34631fc4e8 100644
--- a/sphinxman/master/autodir_options_c/detci__a_ras3_max.html
+++ b/sphinxman/master/autodir_options_c/detci__a_ras3_max.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__a_ras3_max.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__a_ras3_max.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__avg_states.html b/sphinxman/master/autodir_options_c/detci__avg_states.html
index 7d61af4cc75..1f44960fdd3 100644
--- a/sphinxman/master/autodir_options_c/detci__avg_states.html
+++ b/sphinxman/master/autodir_options_c/detci__avg_states.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__avg_states.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__avg_states.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__avg_weights.html b/sphinxman/master/autodir_options_c/detci__avg_weights.html
index 9d7691042ef..3a6fc665e80 100644
--- a/sphinxman/master/autodir_options_c/detci__avg_weights.html
+++ b/sphinxman/master/autodir_options_c/detci__avg_weights.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__avg_weights.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__avg_weights.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__b_ras3_max.html b/sphinxman/master/autodir_options_c/detci__b_ras3_max.html
index 6febff34ad2..914ae13421a 100644
--- a/sphinxman/master/autodir_options_c/detci__b_ras3_max.html
+++ b/sphinxman/master/autodir_options_c/detci__b_ras3_max.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__b_ras3_max.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__b_ras3_max.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__bendazzoli.html b/sphinxman/master/autodir_options_c/detci__bendazzoli.html
index b75b4369a96..59087d2b162 100644
--- a/sphinxman/master/autodir_options_c/detci__bendazzoli.html
+++ b/sphinxman/master/autodir_options_c/detci__bendazzoli.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__bendazzoli.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__bendazzoli.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__calc_s_squared.html b/sphinxman/master/autodir_options_c/detci__calc_s_squared.html
index 10a79505238..0109b97c98a 100644
--- a/sphinxman/master/autodir_options_c/detci__calc_s_squared.html
+++ b/sphinxman/master/autodir_options_c/detci__calc_s_squared.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__calc_s_squared.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__calc_s_squared.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__cc.html b/sphinxman/master/autodir_options_c/detci__cc.html
index 7859c6cb986..e8814876bbe 100644
--- a/sphinxman/master/autodir_options_c/detci__cc.html
+++ b/sphinxman/master/autodir_options_c/detci__cc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__cc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__cc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__cc_a_ras3_max.html b/sphinxman/master/autodir_options_c/detci__cc_a_ras3_max.html
index b2760f97a5d..3a2f4b9aefc 100644
--- a/sphinxman/master/autodir_options_c/detci__cc_a_ras3_max.html
+++ b/sphinxman/master/autodir_options_c/detci__cc_a_ras3_max.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__cc_a_ras3_max.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__cc_a_ras3_max.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__cc_b_ras3_max.html b/sphinxman/master/autodir_options_c/detci__cc_b_ras3_max.html
index 7a5f987c037..374b9002e2c 100644
--- a/sphinxman/master/autodir_options_c/detci__cc_b_ras3_max.html
+++ b/sphinxman/master/autodir_options_c/detci__cc_b_ras3_max.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__cc_b_ras3_max.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__cc_b_ras3_max.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__cc_ex_level.html b/sphinxman/master/autodir_options_c/detci__cc_ex_level.html
index 45c40adcc23..63c2070fee7 100644
--- a/sphinxman/master/autodir_options_c/detci__cc_ex_level.html
+++ b/sphinxman/master/autodir_options_c/detci__cc_ex_level.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__cc_ex_level.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__cc_ex_level.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__cc_fix_external.html b/sphinxman/master/autodir_options_c/detci__cc_fix_external.html
index 7d59a7a80ad..284192a7839 100644
--- a/sphinxman/master/autodir_options_c/detci__cc_fix_external.html
+++ b/sphinxman/master/autodir_options_c/detci__cc_fix_external.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__cc_fix_external.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__cc_fix_external.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__cc_fix_external_min.html b/sphinxman/master/autodir_options_c/detci__cc_fix_external_min.html
index bbbe648f7bc..e150ec7ec8c 100644
--- a/sphinxman/master/autodir_options_c/detci__cc_fix_external_min.html
+++ b/sphinxman/master/autodir_options_c/detci__cc_fix_external_min.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__cc_fix_external_min.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__cc_fix_external_min.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__cc_macro.html b/sphinxman/master/autodir_options_c/detci__cc_macro.html
index 939db5811b9..9c6cd9af412 100644
--- a/sphinxman/master/autodir_options_c/detci__cc_macro.html
+++ b/sphinxman/master/autodir_options_c/detci__cc_macro.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__cc_macro.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__cc_macro.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__cc_mixed.html b/sphinxman/master/autodir_options_c/detci__cc_mixed.html
index 1937bacb1b4..c833d119f7e 100644
--- a/sphinxman/master/autodir_options_c/detci__cc_mixed.html
+++ b/sphinxman/master/autodir_options_c/detci__cc_mixed.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__cc_mixed.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__cc_mixed.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__cc_ras34_max.html b/sphinxman/master/autodir_options_c/detci__cc_ras34_max.html
index 85c419d6711..63d4f4b958c 100644
--- a/sphinxman/master/autodir_options_c/detci__cc_ras34_max.html
+++ b/sphinxman/master/autodir_options_c/detci__cc_ras34_max.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__cc_ras34_max.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__cc_ras34_max.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__cc_ras3_max.html b/sphinxman/master/autodir_options_c/detci__cc_ras3_max.html
index faac15e17f4..ed3afee2eab 100644
--- a/sphinxman/master/autodir_options_c/detci__cc_ras3_max.html
+++ b/sphinxman/master/autodir_options_c/detci__cc_ras3_max.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__cc_ras3_max.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__cc_ras3_max.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__cc_ras4_max.html b/sphinxman/master/autodir_options_c/detci__cc_ras4_max.html
index 0b56621e551..c14ef5856d3 100644
--- a/sphinxman/master/autodir_options_c/detci__cc_ras4_max.html
+++ b/sphinxman/master/autodir_options_c/detci__cc_ras4_max.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__cc_ras4_max.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__cc_ras4_max.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__cc_update_eps.html b/sphinxman/master/autodir_options_c/detci__cc_update_eps.html
index 3094c322e55..448a7cbb348 100644
--- a/sphinxman/master/autodir_options_c/detci__cc_update_eps.html
+++ b/sphinxman/master/autodir_options_c/detci__cc_update_eps.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__cc_update_eps.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__cc_update_eps.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__cc_val_ex_level.html b/sphinxman/master/autodir_options_c/detci__cc_val_ex_level.html
index 540ac4df776..1938abb1b57 100644
--- a/sphinxman/master/autodir_options_c/detci__cc_val_ex_level.html
+++ b/sphinxman/master/autodir_options_c/detci__cc_val_ex_level.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__cc_val_ex_level.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__cc_val_ex_level.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__cc_variational.html b/sphinxman/master/autodir_options_c/detci__cc_variational.html
index 9b4745270c9..1d6cddb964c 100644
--- a/sphinxman/master/autodir_options_c/detci__cc_variational.html
+++ b/sphinxman/master/autodir_options_c/detci__cc_variational.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__cc_variational.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__cc_variational.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__cc_vecs_read.html b/sphinxman/master/autodir_options_c/detci__cc_vecs_read.html
index 029be9917dc..e4f7ad8d9af 100644
--- a/sphinxman/master/autodir_options_c/detci__cc_vecs_read.html
+++ b/sphinxman/master/autodir_options_c/detci__cc_vecs_read.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__cc_vecs_read.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__cc_vecs_read.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__cc_vecs_write.html b/sphinxman/master/autodir_options_c/detci__cc_vecs_write.html
index d7f3f4c6b4d..e652d5cd18a 100644
--- a/sphinxman/master/autodir_options_c/detci__cc_vecs_write.html
+++ b/sphinxman/master/autodir_options_c/detci__cc_vecs_write.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__cc_vecs_write.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__cc_vecs_write.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__ci_file_start.html b/sphinxman/master/autodir_options_c/detci__ci_file_start.html
index c1fe23b8c16..19e3b97eaca 100644
--- a/sphinxman/master/autodir_options_c/detci__ci_file_start.html
+++ b/sphinxman/master/autodir_options_c/detci__ci_file_start.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__ci_file_start.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__ci_file_start.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__ci_maxiter.html b/sphinxman/master/autodir_options_c/detci__ci_maxiter.html
index 3da6f0ee6f7..429496a3073 100644
--- a/sphinxman/master/autodir_options_c/detci__ci_maxiter.html
+++ b/sphinxman/master/autodir_options_c/detci__ci_maxiter.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__ci_maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__ci_maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__ci_num_threads.html b/sphinxman/master/autodir_options_c/detci__ci_num_threads.html
index 3ae27152d7b..d2c25453135 100644
--- a/sphinxman/master/autodir_options_c/detci__ci_num_threads.html
+++ b/sphinxman/master/autodir_options_c/detci__ci_num_threads.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__ci_num_threads.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__ci_num_threads.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__ciblks_print.html b/sphinxman/master/autodir_options_c/detci__ciblks_print.html
index 0835ccef913..a7451b7b126 100644
--- a/sphinxman/master/autodir_options_c/detci__ciblks_print.html
+++ b/sphinxman/master/autodir_options_c/detci__ciblks_print.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__ciblks_print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__ciblks_print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__collapse_size.html b/sphinxman/master/autodir_options_c/detci__collapse_size.html
index e00b2d76fee..762beaf4006 100644
--- a/sphinxman/master/autodir_options_c/detci__collapse_size.html
+++ b/sphinxman/master/autodir_options_c/detci__collapse_size.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__collapse_size.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__collapse_size.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__detci_freeze_core.html b/sphinxman/master/autodir_options_c/detci__detci_freeze_core.html
index 923527f9a00..ad361e76dbf 100644
--- a/sphinxman/master/autodir_options_c/detci__detci_freeze_core.html
+++ b/sphinxman/master/autodir_options_c/detci__detci_freeze_core.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__detci_freeze_core.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__detci_freeze_core.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__df_basis_mcscf.html b/sphinxman/master/autodir_options_c/detci__df_basis_mcscf.html
index 8d71d9afd1a..e102d6dc74b 100644
--- a/sphinxman/master/autodir_options_c/detci__df_basis_mcscf.html
+++ b/sphinxman/master/autodir_options_c/detci__df_basis_mcscf.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__df_basis_mcscf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__df_basis_mcscf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__diag_method.html b/sphinxman/master/autodir_options_c/detci__diag_method.html
index c27aa03ecef..da1dd310220 100644
--- a/sphinxman/master/autodir_options_c/detci__diag_method.html
+++ b/sphinxman/master/autodir_options_c/detci__diag_method.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__diag_method.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__diag_method.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__diis.html b/sphinxman/master/autodir_options_c/detci__diis.html
index 125206778d5..bcee9e39582 100644
--- a/sphinxman/master/autodir_options_c/detci__diis.html
+++ b/sphinxman/master/autodir_options_c/detci__diis.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__diis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__diis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__diis_freq.html b/sphinxman/master/autodir_options_c/detci__diis_freq.html
index f04acd9e26b..007733e22f8 100644
--- a/sphinxman/master/autodir_options_c/detci__diis_freq.html
+++ b/sphinxman/master/autodir_options_c/detci__diis_freq.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__diis_freq.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__diis_freq.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__diis_max_vecs.html b/sphinxman/master/autodir_options_c/detci__diis_max_vecs.html
index af8e6e27c07..89db1341bee 100644
--- a/sphinxman/master/autodir_options_c/detci__diis_max_vecs.html
+++ b/sphinxman/master/autodir_options_c/detci__diis_max_vecs.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__diis_max_vecs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__diis_max_vecs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__diis_min_vecs.html b/sphinxman/master/autodir_options_c/detci__diis_min_vecs.html
index 6151fb3ee96..f253b56245c 100644
--- a/sphinxman/master/autodir_options_c/detci__diis_min_vecs.html
+++ b/sphinxman/master/autodir_options_c/detci__diis_min_vecs.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__diis_min_vecs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__diis_min_vecs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__diis_start_iter.html b/sphinxman/master/autodir_options_c/detci__diis_start_iter.html
index 02def4fb26a..36724cdb8e8 100644
--- a/sphinxman/master/autodir_options_c/detci__diis_start_iter.html
+++ b/sphinxman/master/autodir_options_c/detci__diis_start_iter.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__diis_start_iter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__diis_start_iter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__dipmom.html b/sphinxman/master/autodir_options_c/detci__dipmom.html
index aa8e6e40ec9..0339cf78f1d 100644
--- a/sphinxman/master/autodir_options_c/detci__dipmom.html
+++ b/sphinxman/master/autodir_options_c/detci__dipmom.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__dipmom.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__dipmom.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__e_convergence.html b/sphinxman/master/autodir_options_c/detci__e_convergence.html
index e454ff79410..019ce7c6836 100644
--- a/sphinxman/master/autodir_options_c/detci__e_convergence.html
+++ b/sphinxman/master/autodir_options_c/detci__e_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__e_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__e_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__ex_allow.html b/sphinxman/master/autodir_options_c/detci__ex_allow.html
index 15c6eb54ba3..cd35df3a4a6 100644
--- a/sphinxman/master/autodir_options_c/detci__ex_allow.html
+++ b/sphinxman/master/autodir_options_c/detci__ex_allow.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__ex_allow.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__ex_allow.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__ex_level.html b/sphinxman/master/autodir_options_c/detci__ex_level.html
index fedb881d568..4280a81f5d7 100644
--- a/sphinxman/master/autodir_options_c/detci__ex_level.html
+++ b/sphinxman/master/autodir_options_c/detci__ex_level.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__ex_level.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__ex_level.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__fci.html b/sphinxman/master/autodir_options_c/detci__fci.html
index ddbeae6a336..6761c558e8c 100644
--- a/sphinxman/master/autodir_options_c/detci__fci.html
+++ b/sphinxman/master/autodir_options_c/detci__fci.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__fci.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__fci.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__fci_strings.html b/sphinxman/master/autodir_options_c/detci__fci_strings.html
index ec99eb14578..b3a08d90e12 100644
--- a/sphinxman/master/autodir_options_c/detci__fci_strings.html
+++ b/sphinxman/master/autodir_options_c/detci__fci_strings.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__fci_strings.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__fci_strings.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__filter_guess.html b/sphinxman/master/autodir_options_c/detci__filter_guess.html
index 9abf1788136..a86204138b4 100644
--- a/sphinxman/master/autodir_options_c/detci__filter_guess.html
+++ b/sphinxman/master/autodir_options_c/detci__filter_guess.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__filter_guess.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__filter_guess.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__filter_guess_det1.html b/sphinxman/master/autodir_options_c/detci__filter_guess_det1.html
index 178d57e4459..4cc92aeaba2 100644
--- a/sphinxman/master/autodir_options_c/detci__filter_guess_det1.html
+++ b/sphinxman/master/autodir_options_c/detci__filter_guess_det1.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__filter_guess_det1.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__filter_guess_det1.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__filter_guess_det2.html b/sphinxman/master/autodir_options_c/detci__filter_guess_det2.html
index 8fc9bfb610f..9feeb589fbb 100644
--- a/sphinxman/master/autodir_options_c/detci__filter_guess_det2.html
+++ b/sphinxman/master/autodir_options_c/detci__filter_guess_det2.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__filter_guess_det2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__filter_guess_det2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__filter_guess_sign.html b/sphinxman/master/autodir_options_c/detci__filter_guess_sign.html
index c25cf23f722..f272fc8353d 100644
--- a/sphinxman/master/autodir_options_c/detci__filter_guess_sign.html
+++ b/sphinxman/master/autodir_options_c/detci__filter_guess_sign.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__filter_guess_sign.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__filter_guess_sign.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__filter_zero_det.html b/sphinxman/master/autodir_options_c/detci__filter_zero_det.html
index 26f46d9ec4e..8d5bb10539f 100644
--- a/sphinxman/master/autodir_options_c/detci__filter_zero_det.html
+++ b/sphinxman/master/autodir_options_c/detci__filter_zero_det.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__filter_zero_det.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__filter_zero_det.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__follow_root.html b/sphinxman/master/autodir_options_c/detci__follow_root.html
index 8ec060a966c..0a1394a734e 100644
--- a/sphinxman/master/autodir_options_c/detci__follow_root.html
+++ b/sphinxman/master/autodir_options_c/detci__follow_root.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__follow_root.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__follow_root.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__follow_vector.html b/sphinxman/master/autodir_options_c/detci__follow_vector.html
index 0f0d97ef748..2d6e95b3ed5 100644
--- a/sphinxman/master/autodir_options_c/detci__follow_vector.html
+++ b/sphinxman/master/autodir_options_c/detci__follow_vector.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__follow_vector.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__follow_vector.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__guess_vector.html b/sphinxman/master/autodir_options_c/detci__guess_vector.html
index 4af559bbd5d..cc439efb3c8 100644
--- a/sphinxman/master/autodir_options_c/detci__guess_vector.html
+++ b/sphinxman/master/autodir_options_c/detci__guess_vector.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__guess_vector.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__guess_vector.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__h0_block_coupling.html b/sphinxman/master/autodir_options_c/detci__h0_block_coupling.html
index bb9b960f30c..b10d52351de 100644
--- a/sphinxman/master/autodir_options_c/detci__h0_block_coupling.html
+++ b/sphinxman/master/autodir_options_c/detci__h0_block_coupling.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__h0_block_coupling.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__h0_block_coupling.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__h0_block_coupling_size.html b/sphinxman/master/autodir_options_c/detci__h0_block_coupling_size.html
index 4593c2a3730..9dde699dd0d 100644
--- a/sphinxman/master/autodir_options_c/detci__h0_block_coupling_size.html
+++ b/sphinxman/master/autodir_options_c/detci__h0_block_coupling_size.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__h0_block_coupling_size.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__h0_block_coupling_size.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__h0_blocksize.html b/sphinxman/master/autodir_options_c/detci__h0_blocksize.html
index 322e6f05ff3..e682974fdb5 100644
--- a/sphinxman/master/autodir_options_c/detci__h0_blocksize.html
+++ b/sphinxman/master/autodir_options_c/detci__h0_blocksize.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__h0_blocksize.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__h0_blocksize.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__h0_guess_size.html b/sphinxman/master/autodir_options_c/detci__h0_guess_size.html
index 63167221cbe..99f3a37b98e 100644
--- a/sphinxman/master/autodir_options_c/detci__h0_guess_size.html
+++ b/sphinxman/master/autodir_options_c/detci__h0_guess_size.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__h0_guess_size.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__h0_guess_size.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__hd_avg.html b/sphinxman/master/autodir_options_c/detci__hd_avg.html
index 89a1a237ec7..a4a001a42e3 100644
--- a/sphinxman/master/autodir_options_c/detci__hd_avg.html
+++ b/sphinxman/master/autodir_options_c/detci__hd_avg.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__hd_avg.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__hd_avg.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__hd_otf.html b/sphinxman/master/autodir_options_c/detci__hd_otf.html
index 34547425fe2..922894b917a 100644
--- a/sphinxman/master/autodir_options_c/detci__hd_otf.html
+++ b/sphinxman/master/autodir_options_c/detci__hd_otf.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__hd_otf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__hd_otf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__icore.html b/sphinxman/master/autodir_options_c/detci__icore.html
index 06af741a794..d578ede25dc 100644
--- a/sphinxman/master/autodir_options_c/detci__icore.html
+++ b/sphinxman/master/autodir_options_c/detci__icore.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__icore.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__icore.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__istop.html b/sphinxman/master/autodir_options_c/detci__istop.html
index a072a705fbe..594a10ad3e6 100644
--- a/sphinxman/master/autodir_options_c/detci__istop.html
+++ b/sphinxman/master/autodir_options_c/detci__istop.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__istop.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__istop.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__lse.html b/sphinxman/master/autodir_options_c/detci__lse.html
index bb3e1c08cbc..532d3189552 100644
--- a/sphinxman/master/autodir_options_c/detci__lse.html
+++ b/sphinxman/master/autodir_options_c/detci__lse.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__lse.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__lse.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__lse_collapse.html b/sphinxman/master/autodir_options_c/detci__lse_collapse.html
index fb84c8bcfe8..1f0feac2071 100644
--- a/sphinxman/master/autodir_options_c/detci__lse_collapse.html
+++ b/sphinxman/master/autodir_options_c/detci__lse_collapse.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__lse_collapse.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__lse_collapse.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__lse_tolerance.html b/sphinxman/master/autodir_options_c/detci__lse_tolerance.html
index e81a26136eb..3a9f5dab6f7 100644
--- a/sphinxman/master/autodir_options_c/detci__lse_tolerance.html
+++ b/sphinxman/master/autodir_options_c/detci__lse_tolerance.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__lse_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__lse_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__max_num_vecs.html b/sphinxman/master/autodir_options_c/detci__max_num_vecs.html
index a81b22f0a89..564c2ab165f 100644
--- a/sphinxman/master/autodir_options_c/detci__max_num_vecs.html
+++ b/sphinxman/master/autodir_options_c/detci__max_num_vecs.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__max_num_vecs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__max_num_vecs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__mcscf_algorithm.html b/sphinxman/master/autodir_options_c/detci__mcscf_algorithm.html
index 66a3ee7c7ab..310340fa51f 100644
--- a/sphinxman/master/autodir_options_c/detci__mcscf_algorithm.html
+++ b/sphinxman/master/autodir_options_c/detci__mcscf_algorithm.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__mcscf_algorithm.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__mcscf_algorithm.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__mcscf_ci_cleanup.html b/sphinxman/master/autodir_options_c/detci__mcscf_ci_cleanup.html
index 2fb38051b83..6dd273f621e 100644
--- a/sphinxman/master/autodir_options_c/detci__mcscf_ci_cleanup.html
+++ b/sphinxman/master/autodir_options_c/detci__mcscf_ci_cleanup.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__mcscf_ci_cleanup.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__mcscf_ci_cleanup.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__mcscf_diis_error_type.html b/sphinxman/master/autodir_options_c/detci__mcscf_diis_error_type.html
index 62deac1b9fd..2c2ab97a1c4 100644
--- a/sphinxman/master/autodir_options_c/detci__mcscf_diis_error_type.html
+++ b/sphinxman/master/autodir_options_c/detci__mcscf_diis_error_type.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__mcscf_diis_error_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__mcscf_diis_error_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__mcscf_diis_freq.html b/sphinxman/master/autodir_options_c/detci__mcscf_diis_freq.html
index 833056ecd8d..f7ef94a0fb7 100644
--- a/sphinxman/master/autodir_options_c/detci__mcscf_diis_freq.html
+++ b/sphinxman/master/autodir_options_c/detci__mcscf_diis_freq.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__mcscf_diis_freq.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__mcscf_diis_freq.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__mcscf_diis_max_vecs.html b/sphinxman/master/autodir_options_c/detci__mcscf_diis_max_vecs.html
index f5a92f5e343..0f8940bacfe 100644
--- a/sphinxman/master/autodir_options_c/detci__mcscf_diis_max_vecs.html
+++ b/sphinxman/master/autodir_options_c/detci__mcscf_diis_max_vecs.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__mcscf_diis_max_vecs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__mcscf_diis_max_vecs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__mcscf_diis_start.html b/sphinxman/master/autodir_options_c/detci__mcscf_diis_start.html
index c590783d676..f7686fc60e1 100644
--- a/sphinxman/master/autodir_options_c/detci__mcscf_diis_start.html
+++ b/sphinxman/master/autodir_options_c/detci__mcscf_diis_start.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__mcscf_diis_start.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__mcscf_diis_start.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__mcscf_dpd_cleanup.html b/sphinxman/master/autodir_options_c/detci__mcscf_dpd_cleanup.html
index 43ac1f78500..b1c744911a6 100644
--- a/sphinxman/master/autodir_options_c/detci__mcscf_dpd_cleanup.html
+++ b/sphinxman/master/autodir_options_c/detci__mcscf_dpd_cleanup.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__mcscf_dpd_cleanup.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__mcscf_dpd_cleanup.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__mcscf_e_convergence.html b/sphinxman/master/autodir_options_c/detci__mcscf_e_convergence.html
index 36403dfe885..d79c9e27960 100644
--- a/sphinxman/master/autodir_options_c/detci__mcscf_e_convergence.html
+++ b/sphinxman/master/autodir_options_c/detci__mcscf_e_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__mcscf_e_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__mcscf_e_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__mcscf_guess.html b/sphinxman/master/autodir_options_c/detci__mcscf_guess.html
index 52378e6541b..808d56ec867 100644
--- a/sphinxman/master/autodir_options_c/detci__mcscf_guess.html
+++ b/sphinxman/master/autodir_options_c/detci__mcscf_guess.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__mcscf_guess.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__mcscf_guess.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__mcscf_max_rot.html b/sphinxman/master/autodir_options_c/detci__mcscf_max_rot.html
index 29d9e0d413f..c7e7a1919e7 100644
--- a/sphinxman/master/autodir_options_c/detci__mcscf_max_rot.html
+++ b/sphinxman/master/autodir_options_c/detci__mcscf_max_rot.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__mcscf_max_rot.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__mcscf_max_rot.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__mcscf_maxiter.html b/sphinxman/master/autodir_options_c/detci__mcscf_maxiter.html
index 916026f5696..8eaf04377f8 100644
--- a/sphinxman/master/autodir_options_c/detci__mcscf_maxiter.html
+++ b/sphinxman/master/autodir_options_c/detci__mcscf_maxiter.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__mcscf_maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__mcscf_maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__mcscf_r_convergence.html b/sphinxman/master/autodir_options_c/detci__mcscf_r_convergence.html
index 3177ba0f061..cdd2e1a6bb8 100644
--- a/sphinxman/master/autodir_options_c/detci__mcscf_r_convergence.html
+++ b/sphinxman/master/autodir_options_c/detci__mcscf_r_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__mcscf_r_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__mcscf_r_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__mcscf_rotate.html b/sphinxman/master/autodir_options_c/detci__mcscf_rotate.html
index 78a256797fe..5716f1f6179 100644
--- a/sphinxman/master/autodir_options_c/detci__mcscf_rotate.html
+++ b/sphinxman/master/autodir_options_c/detci__mcscf_rotate.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__mcscf_rotate.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__mcscf_rotate.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__mcscf_so_start_e.html b/sphinxman/master/autodir_options_c/detci__mcscf_so_start_e.html
index 6f0612978bb..e1619daa782 100644
--- a/sphinxman/master/autodir_options_c/detci__mcscf_so_start_e.html
+++ b/sphinxman/master/autodir_options_c/detci__mcscf_so_start_e.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__mcscf_so_start_e.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__mcscf_so_start_e.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__mcscf_so_start_grad.html b/sphinxman/master/autodir_options_c/detci__mcscf_so_start_grad.html
index 67bf9772dd6..927177f1b49 100644
--- a/sphinxman/master/autodir_options_c/detci__mcscf_so_start_grad.html
+++ b/sphinxman/master/autodir_options_c/detci__mcscf_so_start_grad.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__mcscf_so_start_grad.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__mcscf_so_start_grad.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__mcscf_type.html b/sphinxman/master/autodir_options_c/detci__mcscf_type.html
index 3c10a84c3d6..e3879d188b4 100644
--- a/sphinxman/master/autodir_options_c/detci__mcscf_type.html
+++ b/sphinxman/master/autodir_options_c/detci__mcscf_type.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__mcscf_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__mcscf_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__mixed.html b/sphinxman/master/autodir_options_c/detci__mixed.html
index f7f433f6b90..7aeae20bf09 100644
--- a/sphinxman/master/autodir_options_c/detci__mixed.html
+++ b/sphinxman/master/autodir_options_c/detci__mixed.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__mixed.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__mixed.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__mixed4.html b/sphinxman/master/autodir_options_c/detci__mixed4.html
index 7a5a1dbb8a6..057a439628f 100644
--- a/sphinxman/master/autodir_options_c/detci__mixed4.html
+++ b/sphinxman/master/autodir_options_c/detci__mixed4.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__mixed4.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__mixed4.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__mpn.html b/sphinxman/master/autodir_options_c/detci__mpn.html
index 3f56c403dae..772623fb1d2 100644
--- a/sphinxman/master/autodir_options_c/detci__mpn.html
+++ b/sphinxman/master/autodir_options_c/detci__mpn.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__mpn.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__mpn.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__mpn_order_save.html b/sphinxman/master/autodir_options_c/detci__mpn_order_save.html
index b65b6f2a9c2..3b7bf516d95 100644
--- a/sphinxman/master/autodir_options_c/detci__mpn_order_save.html
+++ b/sphinxman/master/autodir_options_c/detci__mpn_order_save.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__mpn_order_save.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__mpn_order_save.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__mpn_schmidt.html b/sphinxman/master/autodir_options_c/detci__mpn_schmidt.html
index eea66a426cb..677fd717193 100644
--- a/sphinxman/master/autodir_options_c/detci__mpn_schmidt.html
+++ b/sphinxman/master/autodir_options_c/detci__mpn_schmidt.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__mpn_schmidt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__mpn_schmidt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__mpn_wigner.html b/sphinxman/master/autodir_options_c/detci__mpn_wigner.html
index d59e99569a5..806dcc98f32 100644
--- a/sphinxman/master/autodir_options_c/detci__mpn_wigner.html
+++ b/sphinxman/master/autodir_options_c/detci__mpn_wigner.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__mpn_wigner.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__mpn_wigner.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__ms0.html b/sphinxman/master/autodir_options_c/detci__ms0.html
index 23763d5c4bc..633be8f0599 100644
--- a/sphinxman/master/autodir_options_c/detci__ms0.html
+++ b/sphinxman/master/autodir_options_c/detci__ms0.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__ms0.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__ms0.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__nat_orbs.html b/sphinxman/master/autodir_options_c/detci__nat_orbs.html
index 626526f99f8..995a783f46f 100644
--- a/sphinxman/master/autodir_options_c/detci__nat_orbs.html
+++ b/sphinxman/master/autodir_options_c/detci__nat_orbs.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__nat_orbs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__nat_orbs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__no_dfile.html b/sphinxman/master/autodir_options_c/detci__no_dfile.html
index 3ca4247f5e1..4f81a0c80ef 100644
--- a/sphinxman/master/autodir_options_c/detci__no_dfile.html
+++ b/sphinxman/master/autodir_options_c/detci__no_dfile.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__no_dfile.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__no_dfile.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__num_amps_print.html b/sphinxman/master/autodir_options_c/detci__num_amps_print.html
index 4e9c23c592e..96f21c7f98e 100644
--- a/sphinxman/master/autodir_options_c/detci__num_amps_print.html
+++ b/sphinxman/master/autodir_options_c/detci__num_amps_print.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__num_amps_print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__num_amps_print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__num_dets_print.html b/sphinxman/master/autodir_options_c/detci__num_dets_print.html
index 9a74001781e..4301a509458 100644
--- a/sphinxman/master/autodir_options_c/detci__num_dets_print.html
+++ b/sphinxman/master/autodir_options_c/detci__num_dets_print.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__num_dets_print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__num_dets_print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__num_init_vecs.html b/sphinxman/master/autodir_options_c/detci__num_init_vecs.html
index 81297ba6eac..6462f7512a9 100644
--- a/sphinxman/master/autodir_options_c/detci__num_init_vecs.html
+++ b/sphinxman/master/autodir_options_c/detci__num_init_vecs.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__num_init_vecs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__num_init_vecs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__num_roots.html b/sphinxman/master/autodir_options_c/detci__num_roots.html
index 9f8a4145f96..4376395e114 100644
--- a/sphinxman/master/autodir_options_c/detci__num_roots.html
+++ b/sphinxman/master/autodir_options_c/detci__num_roots.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__num_roots.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__num_roots.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__opdm.html b/sphinxman/master/autodir_options_c/detci__opdm.html
index 5da804e32d0..3ac2d2821d0 100644
--- a/sphinxman/master/autodir_options_c/detci__opdm.html
+++ b/sphinxman/master/autodir_options_c/detci__opdm.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__opdm.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__opdm.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__perturb_magnitude.html b/sphinxman/master/autodir_options_c/detci__perturb_magnitude.html
index cdb057b8fba..c8242fe16d9 100644
--- a/sphinxman/master/autodir_options_c/detci__perturb_magnitude.html
+++ b/sphinxman/master/autodir_options_c/detci__perturb_magnitude.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__perturb_magnitude.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__perturb_magnitude.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__preconditioner.html b/sphinxman/master/autodir_options_c/detci__preconditioner.html
index 3d5d4dcd0bf..283d1a461cd 100644
--- a/sphinxman/master/autodir_options_c/detci__preconditioner.html
+++ b/sphinxman/master/autodir_options_c/detci__preconditioner.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__preconditioner.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__preconditioner.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__r4s.html b/sphinxman/master/autodir_options_c/detci__r4s.html
index 3f29c9d6324..99ec9984501 100644
--- a/sphinxman/master/autodir_options_c/detci__r4s.html
+++ b/sphinxman/master/autodir_options_c/detci__r4s.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__r4s.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__r4s.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__r_convergence.html b/sphinxman/master/autodir_options_c/detci__r_convergence.html
index 359eefdeca7..8f55d6ce4a2 100644
--- a/sphinxman/master/autodir_options_c/detci__r_convergence.html
+++ b/sphinxman/master/autodir_options_c/detci__r_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__r_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__r_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__ras34_max.html b/sphinxman/master/autodir_options_c/detci__ras34_max.html
index a1bec02f157..1c79fef613c 100644
--- a/sphinxman/master/autodir_options_c/detci__ras34_max.html
+++ b/sphinxman/master/autodir_options_c/detci__ras34_max.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__ras34_max.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__ras34_max.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__ras3_max.html b/sphinxman/master/autodir_options_c/detci__ras3_max.html
index 37446b40372..00f07239c95 100644
--- a/sphinxman/master/autodir_options_c/detci__ras3_max.html
+++ b/sphinxman/master/autodir_options_c/detci__ras3_max.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__ras3_max.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__ras3_max.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__ras4_max.html b/sphinxman/master/autodir_options_c/detci__ras4_max.html
index f005163b273..57d6c6934e7 100644
--- a/sphinxman/master/autodir_options_c/detci__ras4_max.html
+++ b/sphinxman/master/autodir_options_c/detci__ras4_max.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__ras4_max.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__ras4_max.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__reference.html b/sphinxman/master/autodir_options_c/detci__reference.html
index 272e8087706..484d5edfe7d 100644
--- a/sphinxman/master/autodir_options_c/detci__reference.html
+++ b/sphinxman/master/autodir_options_c/detci__reference.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__reference.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__reference.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__reference_sym.html b/sphinxman/master/autodir_options_c/detci__reference_sym.html
index 1b5002d28d0..d7f91d9364d 100644
--- a/sphinxman/master/autodir_options_c/detci__reference_sym.html
+++ b/sphinxman/master/autodir_options_c/detci__reference_sym.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__reference_sym.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__reference_sym.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__repl_otf.html b/sphinxman/master/autodir_options_c/detci__repl_otf.html
index b76096a0f79..8e50c2ab441 100644
--- a/sphinxman/master/autodir_options_c/detci__repl_otf.html
+++ b/sphinxman/master/autodir_options_c/detci__repl_otf.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__repl_otf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__repl_otf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__restart.html b/sphinxman/master/autodir_options_c/detci__restart.html
index a0849c6be33..b4407c15800 100644
--- a/sphinxman/master/autodir_options_c/detci__restart.html
+++ b/sphinxman/master/autodir_options_c/detci__restart.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__restart.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__restart.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__s.html b/sphinxman/master/autodir_options_c/detci__s.html
index 5281daefca5..23a672e7428 100644
--- a/sphinxman/master/autodir_options_c/detci__s.html
+++ b/sphinxman/master/autodir_options_c/detci__s.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__s.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__s.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__sf_restrict.html b/sphinxman/master/autodir_options_c/detci__sf_restrict.html
index 4a653d60681..0e63bca43d9 100644
--- a/sphinxman/master/autodir_options_c/detci__sf_restrict.html
+++ b/sphinxman/master/autodir_options_c/detci__sf_restrict.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__sf_restrict.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__sf_restrict.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__sigma_overlap.html b/sphinxman/master/autodir_options_c/detci__sigma_overlap.html
index bb3eabb3514..01d0893252a 100644
--- a/sphinxman/master/autodir_options_c/detci__sigma_overlap.html
+++ b/sphinxman/master/autodir_options_c/detci__sigma_overlap.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__sigma_overlap.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__sigma_overlap.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__tdm.html b/sphinxman/master/autodir_options_c/detci__tdm.html
index f592fe83871..238215f7b92 100644
--- a/sphinxman/master/autodir_options_c/detci__tdm.html
+++ b/sphinxman/master/autodir_options_c/detci__tdm.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__tdm.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__tdm.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__tpdm.html b/sphinxman/master/autodir_options_c/detci__tpdm.html
index ef99168903c..6b2a53cc3d1 100644
--- a/sphinxman/master/autodir_options_c/detci__tpdm.html
+++ b/sphinxman/master/autodir_options_c/detci__tpdm.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__tpdm.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__tpdm.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__update.html b/sphinxman/master/autodir_options_c/detci__update.html
index 83880124817..2e343542127 100644
--- a/sphinxman/master/autodir_options_c/detci__update.html
+++ b/sphinxman/master/autodir_options_c/detci__update.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__update.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__update.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__val_ex_level.html b/sphinxman/master/autodir_options_c/detci__val_ex_level.html
index 360c0e9e2a2..8c1e6942c60 100644
--- a/sphinxman/master/autodir_options_c/detci__val_ex_level.html
+++ b/sphinxman/master/autodir_options_c/detci__val_ex_level.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__val_ex_level.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__val_ex_level.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/detci__wfn.html b/sphinxman/master/autodir_options_c/detci__wfn.html
index 0f9a1a904b7..b6a66c52d72 100644
--- a/sphinxman/master/autodir_options_c/detci__wfn.html
+++ b/sphinxman/master/autodir_options_c/detci__wfn.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__wfn.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/detci__wfn.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfep2__df_basis_ep2.html b/sphinxman/master/autodir_options_c/dfep2__df_basis_ep2.html
index 9cad3f49ee2..33ff2b2f6b8 100644
--- a/sphinxman/master/autodir_options_c/dfep2__df_basis_ep2.html
+++ b/sphinxman/master/autodir_options_c/dfep2__df_basis_ep2.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfep2__df_basis_ep2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfep2__df_basis_ep2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfep2__ep2_convergence.html b/sphinxman/master/autodir_options_c/dfep2__ep2_convergence.html
index 3fe7933c214..dba90073041 100644
--- a/sphinxman/master/autodir_options_c/dfep2__ep2_convergence.html
+++ b/sphinxman/master/autodir_options_c/dfep2__ep2_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfep2__ep2_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfep2__ep2_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfep2__ep2_maxiter.html b/sphinxman/master/autodir_options_c/dfep2__ep2_maxiter.html
index 16002dbdc66..f313bd05ab0 100644
--- a/sphinxman/master/autodir_options_c/dfep2__ep2_maxiter.html
+++ b/sphinxman/master/autodir_options_c/dfep2__ep2_maxiter.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfep2__ep2_maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfep2__ep2_maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfep2__ep2_num_ea.html b/sphinxman/master/autodir_options_c/dfep2__ep2_num_ea.html
index 07f77fc0e54..d2138022c65 100644
--- a/sphinxman/master/autodir_options_c/dfep2__ep2_num_ea.html
+++ b/sphinxman/master/autodir_options_c/dfep2__ep2_num_ea.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfep2__ep2_num_ea.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfep2__ep2_num_ea.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfep2__ep2_num_ip.html b/sphinxman/master/autodir_options_c/dfep2__ep2_num_ip.html
index 6918bfffa25..92e17cff5a5 100644
--- a/sphinxman/master/autodir_options_c/dfep2__ep2_num_ip.html
+++ b/sphinxman/master/autodir_options_c/dfep2__ep2_num_ip.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfep2__ep2_num_ip.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfep2__ep2_num_ip.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfep2__ep2_orbitals.html b/sphinxman/master/autodir_options_c/dfep2__ep2_orbitals.html
index 9428abfea02..b32840e2273 100644
--- a/sphinxman/master/autodir_options_c/dfep2__ep2_orbitals.html
+++ b/sphinxman/master/autodir_options_c/dfep2__ep2_orbitals.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfep2__ep2_orbitals.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfep2__ep2_orbitals.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfmp2__basis.html b/sphinxman/master/autodir_options_c/dfmp2__basis.html
index 9521a2b7621..c945fea7d75 100644
--- a/sphinxman/master/autodir_options_c/dfmp2__basis.html
+++ b/sphinxman/master/autodir_options_c/dfmp2__basis.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfmp2__basis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfmp2__basis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfmp2__df_basis_mp2.html b/sphinxman/master/autodir_options_c/dfmp2__df_basis_mp2.html
index 7dc40dd081f..da5de109fd5 100644
--- a/sphinxman/master/autodir_options_c/dfmp2__df_basis_mp2.html
+++ b/sphinxman/master/autodir_options_c/dfmp2__df_basis_mp2.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfmp2__df_basis_mp2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfmp2__df_basis_mp2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfmp2__df_ints_io.html b/sphinxman/master/autodir_options_c/dfmp2__df_ints_io.html
index d48c055a11d..4ba5bf9deb9 100644
--- a/sphinxman/master/autodir_options_c/dfmp2__df_ints_io.html
+++ b/sphinxman/master/autodir_options_c/dfmp2__df_ints_io.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfmp2__df_ints_io.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfmp2__df_ints_io.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfmp2__df_ints_num_threads.html b/sphinxman/master/autodir_options_c/dfmp2__df_ints_num_threads.html
index e7bc4f5cc93..1e1595f67c2 100644
--- a/sphinxman/master/autodir_options_c/dfmp2__df_ints_num_threads.html
+++ b/sphinxman/master/autodir_options_c/dfmp2__df_ints_num_threads.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfmp2__df_ints_num_threads.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfmp2__df_ints_num_threads.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfmp2__dfmp2_mem_factor.html b/sphinxman/master/autodir_options_c/dfmp2__dfmp2_mem_factor.html
index d24816e92e2..ea83de71025 100644
--- a/sphinxman/master/autodir_options_c/dfmp2__dfmp2_mem_factor.html
+++ b/sphinxman/master/autodir_options_c/dfmp2__dfmp2_mem_factor.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfmp2__dfmp2_mem_factor.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfmp2__dfmp2_mem_factor.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfmp2__dfmp2_p2_tolerance.html b/sphinxman/master/autodir_options_c/dfmp2__dfmp2_p2_tolerance.html
index 2fa6f01986f..0c0233093b2 100644
--- a/sphinxman/master/autodir_options_c/dfmp2__dfmp2_p2_tolerance.html
+++ b/sphinxman/master/autodir_options_c/dfmp2__dfmp2_p2_tolerance.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfmp2__dfmp2_p2_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfmp2__dfmp2_p2_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfmp2__dfmp2_p_tolerance.html b/sphinxman/master/autodir_options_c/dfmp2__dfmp2_p_tolerance.html
index a9cfeef4f32..c58d737b27e 100644
--- a/sphinxman/master/autodir_options_c/dfmp2__dfmp2_p_tolerance.html
+++ b/sphinxman/master/autodir_options_c/dfmp2__dfmp2_p_tolerance.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfmp2__dfmp2_p_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfmp2__dfmp2_p_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfmp2__ints_tolerance.html b/sphinxman/master/autodir_options_c/dfmp2__ints_tolerance.html
index 39c1cfa88bc..0cccbea7e1a 100644
--- a/sphinxman/master/autodir_options_c/dfmp2__ints_tolerance.html
+++ b/sphinxman/master/autodir_options_c/dfmp2__ints_tolerance.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfmp2__ints_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfmp2__ints_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfmp2__madmp2_sleep.html b/sphinxman/master/autodir_options_c/dfmp2__madmp2_sleep.html
index 37bca2b700a..3f154448483 100644
--- a/sphinxman/master/autodir_options_c/dfmp2__madmp2_sleep.html
+++ b/sphinxman/master/autodir_options_c/dfmp2__madmp2_sleep.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfmp2__madmp2_sleep.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfmp2__madmp2_sleep.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfmp2__mp2_os_scale.html b/sphinxman/master/autodir_options_c/dfmp2__mp2_os_scale.html
index fa8d6656b02..493d2fa60e1 100644
--- a/sphinxman/master/autodir_options_c/dfmp2__mp2_os_scale.html
+++ b/sphinxman/master/autodir_options_c/dfmp2__mp2_os_scale.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfmp2__mp2_os_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfmp2__mp2_os_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfmp2__mp2_ss_scale.html b/sphinxman/master/autodir_options_c/dfmp2__mp2_ss_scale.html
index 8e155cdd40b..2c7e864dfa9 100644
--- a/sphinxman/master/autodir_options_c/dfmp2__mp2_ss_scale.html
+++ b/sphinxman/master/autodir_options_c/dfmp2__mp2_ss_scale.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfmp2__mp2_ss_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfmp2__mp2_ss_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfmp2__onepdm.html b/sphinxman/master/autodir_options_c/dfmp2__onepdm.html
index 2e71af60628..17f3232ad22 100644
--- a/sphinxman/master/autodir_options_c/dfmp2__onepdm.html
+++ b/sphinxman/master/autodir_options_c/dfmp2__onepdm.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfmp2__onepdm.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfmp2__onepdm.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfmp2__opdm_relax.html b/sphinxman/master/autodir_options_c/dfmp2__opdm_relax.html
index 8dc09108883..4b5528dc721 100644
--- a/sphinxman/master/autodir_options_c/dfmp2__opdm_relax.html
+++ b/sphinxman/master/autodir_options_c/dfmp2__opdm_relax.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfmp2__opdm_relax.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfmp2__opdm_relax.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__cc_diis_max_vecs.html b/sphinxman/master/autodir_options_c/dfocc__cc_diis_max_vecs.html
index 7ea36a15b5f..ad9b6a71fca 100644
--- a/sphinxman/master/autodir_options_c/dfocc__cc_diis_max_vecs.html
+++ b/sphinxman/master/autodir_options_c/dfocc__cc_diis_max_vecs.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__cc_diis_max_vecs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__cc_diis_max_vecs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__cc_diis_min_vecs.html b/sphinxman/master/autodir_options_c/dfocc__cc_diis_min_vecs.html
index fa4351d5d4e..3e04459b27d 100644
--- a/sphinxman/master/autodir_options_c/dfocc__cc_diis_min_vecs.html
+++ b/sphinxman/master/autodir_options_c/dfocc__cc_diis_min_vecs.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__cc_diis_min_vecs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__cc_diis_min_vecs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__cc_lambda.html b/sphinxman/master/autodir_options_c/dfocc__cc_lambda.html
index fc51bcf8c25..40f80f69c9e 100644
--- a/sphinxman/master/autodir_options_c/dfocc__cc_lambda.html
+++ b/sphinxman/master/autodir_options_c/dfocc__cc_lambda.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__cc_lambda.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__cc_lambda.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__cc_maxiter.html b/sphinxman/master/autodir_options_c/dfocc__cc_maxiter.html
index cbc8e1fbec6..f887d5ae85e 100644
--- a/sphinxman/master/autodir_options_c/dfocc__cc_maxiter.html
+++ b/sphinxman/master/autodir_options_c/dfocc__cc_maxiter.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__cc_maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__cc_maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__cholesky.html b/sphinxman/master/autodir_options_c/dfocc__cholesky.html
index e309b68fc2d..670f29cf8d0 100644
--- a/sphinxman/master/autodir_options_c/dfocc__cholesky.html
+++ b/sphinxman/master/autodir_options_c/dfocc__cholesky.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__cholesky.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__cholesky.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__cholesky_tolerance.html b/sphinxman/master/autodir_options_c/dfocc__cholesky_tolerance.html
index 84221743c72..f47862c5034 100644
--- a/sphinxman/master/autodir_options_c/dfocc__cholesky_tolerance.html
+++ b/sphinxman/master/autodir_options_c/dfocc__cholesky_tolerance.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__cholesky_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__cholesky_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__comput_s2.html b/sphinxman/master/autodir_options_c/dfocc__comput_s2.html
index b8a42832505..ca73e9b577d 100644
--- a/sphinxman/master/autodir_options_c/dfocc__comput_s2.html
+++ b/sphinxman/master/autodir_options_c/dfocc__comput_s2.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__comput_s2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__comput_s2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__cutoff.html b/sphinxman/master/autodir_options_c/dfocc__cutoff.html
index f67df4b67e2..f5114cc6268 100644
--- a/sphinxman/master/autodir_options_c/dfocc__cutoff.html
+++ b/sphinxman/master/autodir_options_c/dfocc__cutoff.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__cutoff.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__cutoff.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__do_diis.html b/sphinxman/master/autodir_options_c/dfocc__do_diis.html
index 7e1bf3d2d78..1fc71582230 100644
--- a/sphinxman/master/autodir_options_c/dfocc__do_diis.html
+++ b/sphinxman/master/autodir_options_c/dfocc__do_diis.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__do_diis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__do_diis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__do_level_shift.html b/sphinxman/master/autodir_options_c/dfocc__do_level_shift.html
index f409d3eb209..e77a653cf0f 100644
--- a/sphinxman/master/autodir_options_c/dfocc__do_level_shift.html
+++ b/sphinxman/master/autodir_options_c/dfocc__do_level_shift.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__do_level_shift.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__do_level_shift.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__do_scs.html b/sphinxman/master/autodir_options_c/dfocc__do_scs.html
index c81dc7be7b7..8e8298dfe63 100644
--- a/sphinxman/master/autodir_options_c/dfocc__do_scs.html
+++ b/sphinxman/master/autodir_options_c/dfocc__do_scs.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__do_scs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__do_scs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__do_sos.html b/sphinxman/master/autodir_options_c/dfocc__do_sos.html
index d29d40b15a3..7452b9a0a4a 100644
--- a/sphinxman/master/autodir_options_c/dfocc__do_sos.html
+++ b/sphinxman/master/autodir_options_c/dfocc__do_sos.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__do_sos.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__do_sos.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__e3_scale.html b/sphinxman/master/autodir_options_c/dfocc__e3_scale.html
index cf6f75ea79b..31f0d3dc0c3 100644
--- a/sphinxman/master/autodir_options_c/dfocc__e3_scale.html
+++ b/sphinxman/master/autodir_options_c/dfocc__e3_scale.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__e3_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__e3_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__e_convergence.html b/sphinxman/master/autodir_options_c/dfocc__e_convergence.html
index 23ec0c170cf..026884cc96d 100644
--- a/sphinxman/master/autodir_options_c/dfocc__e_convergence.html
+++ b/sphinxman/master/autodir_options_c/dfocc__e_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__e_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__e_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__ekt_ip.html b/sphinxman/master/autodir_options_c/dfocc__ekt_ip.html
index 34e7343c30f..02b07538d8c 100644
--- a/sphinxman/master/autodir_options_c/dfocc__ekt_ip.html
+++ b/sphinxman/master/autodir_options_c/dfocc__ekt_ip.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__ekt_ip.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__ekt_ip.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__hess_type.html b/sphinxman/master/autodir_options_c/dfocc__hess_type.html
index 62f57d28662..b7f3b0e9772 100644
--- a/sphinxman/master/autodir_options_c/dfocc__hess_type.html
+++ b/sphinxman/master/autodir_options_c/dfocc__hess_type.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__hess_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__hess_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__integral_cutoff.html b/sphinxman/master/autodir_options_c/dfocc__integral_cutoff.html
index 4308cecd412..ac961bc81de 100644
--- a/sphinxman/master/autodir_options_c/dfocc__integral_cutoff.html
+++ b/sphinxman/master/autodir_options_c/dfocc__integral_cutoff.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__integral_cutoff.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__integral_cutoff.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__level_shift.html b/sphinxman/master/autodir_options_c/dfocc__level_shift.html
index 8904d664a7e..928a58ab584 100644
--- a/sphinxman/master/autodir_options_c/dfocc__level_shift.html
+++ b/sphinxman/master/autodir_options_c/dfocc__level_shift.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__level_shift.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__level_shift.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__lineq_solver.html b/sphinxman/master/autodir_options_c/dfocc__lineq_solver.html
index f3473f34cae..576cc1aef6a 100644
--- a/sphinxman/master/autodir_options_c/dfocc__lineq_solver.html
+++ b/sphinxman/master/autodir_options_c/dfocc__lineq_solver.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__lineq_solver.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__lineq_solver.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__max_mograd_convergence.html b/sphinxman/master/autodir_options_c/dfocc__max_mograd_convergence.html
index d91103e1b11..2e049fd41f2 100644
--- a/sphinxman/master/autodir_options_c/dfocc__max_mograd_convergence.html
+++ b/sphinxman/master/autodir_options_c/dfocc__max_mograd_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__max_mograd_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__max_mograd_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__mo_diis_num_vecs.html b/sphinxman/master/autodir_options_c/dfocc__mo_diis_num_vecs.html
index 82239439265..f52fc9a988c 100644
--- a/sphinxman/master/autodir_options_c/dfocc__mo_diis_num_vecs.html
+++ b/sphinxman/master/autodir_options_c/dfocc__mo_diis_num_vecs.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__mo_diis_num_vecs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__mo_diis_num_vecs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__mo_maxiter.html b/sphinxman/master/autodir_options_c/dfocc__mo_maxiter.html
index 82c2eccff7b..813dc165962 100644
--- a/sphinxman/master/autodir_options_c/dfocc__mo_maxiter.html
+++ b/sphinxman/master/autodir_options_c/dfocc__mo_maxiter.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__mo_maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__mo_maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__mo_step_max.html b/sphinxman/master/autodir_options_c/dfocc__mo_step_max.html
index 470ac277a8f..c337da955c7 100644
--- a/sphinxman/master/autodir_options_c/dfocc__mo_step_max.html
+++ b/sphinxman/master/autodir_options_c/dfocc__mo_step_max.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__mo_step_max.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__mo_step_max.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__molden_write.html b/sphinxman/master/autodir_options_c/dfocc__molden_write.html
index 750fe670739..371cd5b4248 100644
--- a/sphinxman/master/autodir_options_c/dfocc__molden_write.html
+++ b/sphinxman/master/autodir_options_c/dfocc__molden_write.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__molden_write.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__molden_write.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__mp2_amp_type.html b/sphinxman/master/autodir_options_c/dfocc__mp2_amp_type.html
index e1871ab968b..c0af38e5159 100644
--- a/sphinxman/master/autodir_options_c/dfocc__mp2_amp_type.html
+++ b/sphinxman/master/autodir_options_c/dfocc__mp2_amp_type.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__mp2_amp_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__mp2_amp_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__mp2_os_scale.html b/sphinxman/master/autodir_options_c/dfocc__mp2_os_scale.html
index d5c87216bec..821c50037c4 100644
--- a/sphinxman/master/autodir_options_c/dfocc__mp2_os_scale.html
+++ b/sphinxman/master/autodir_options_c/dfocc__mp2_os_scale.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__mp2_os_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__mp2_os_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__mp2_sos_scale.html b/sphinxman/master/autodir_options_c/dfocc__mp2_sos_scale.html
index 9625b2a95ae..d16797d2810 100644
--- a/sphinxman/master/autodir_options_c/dfocc__mp2_sos_scale.html
+++ b/sphinxman/master/autodir_options_c/dfocc__mp2_sos_scale.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__mp2_sos_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__mp2_sos_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__mp2_sos_scale2.html b/sphinxman/master/autodir_options_c/dfocc__mp2_sos_scale2.html
index b2d198c5b13..971a803a0e8 100644
--- a/sphinxman/master/autodir_options_c/dfocc__mp2_sos_scale2.html
+++ b/sphinxman/master/autodir_options_c/dfocc__mp2_sos_scale2.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__mp2_sos_scale2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__mp2_sos_scale2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__mp2_ss_scale.html b/sphinxman/master/autodir_options_c/dfocc__mp2_ss_scale.html
index e77e9f0bd3c..acc4a5e79a1 100644
--- a/sphinxman/master/autodir_options_c/dfocc__mp2_ss_scale.html
+++ b/sphinxman/master/autodir_options_c/dfocc__mp2_ss_scale.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__mp2_ss_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__mp2_ss_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__nat_orbs.html b/sphinxman/master/autodir_options_c/dfocc__nat_orbs.html
index b53a56e3786..5d2ce9fec62 100644
--- a/sphinxman/master/autodir_options_c/dfocc__nat_orbs.html
+++ b/sphinxman/master/autodir_options_c/dfocc__nat_orbs.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__nat_orbs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__nat_orbs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__occ_orbs_print.html b/sphinxman/master/autodir_options_c/dfocc__occ_orbs_print.html
index 317a5667e92..e6972b82bd4 100644
--- a/sphinxman/master/autodir_options_c/dfocc__occ_orbs_print.html
+++ b/sphinxman/master/autodir_options_c/dfocc__occ_orbs_print.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__occ_orbs_print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__occ_orbs_print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__oeprop.html b/sphinxman/master/autodir_options_c/dfocc__oeprop.html
index fd9aa4f2a4b..ab4b1f80be6 100644
--- a/sphinxman/master/autodir_options_c/dfocc__oeprop.html
+++ b/sphinxman/master/autodir_options_c/dfocc__oeprop.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__oeprop.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__oeprop.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__oo_scale.html b/sphinxman/master/autodir_options_c/dfocc__oo_scale.html
index 83b01723a0f..a67edfc501f 100644
--- a/sphinxman/master/autodir_options_c/dfocc__oo_scale.html
+++ b/sphinxman/master/autodir_options_c/dfocc__oo_scale.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__oo_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__oo_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__opt_method.html b/sphinxman/master/autodir_options_c/dfocc__opt_method.html
index 340b87b06fd..f004b407021 100644
--- a/sphinxman/master/autodir_options_c/dfocc__opt_method.html
+++ b/sphinxman/master/autodir_options_c/dfocc__opt_method.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__opt_method.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__opt_method.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__orb_opt.html b/sphinxman/master/autodir_options_c/dfocc__orb_opt.html
index 8b3aee606fd..174b414c9cb 100644
--- a/sphinxman/master/autodir_options_c/dfocc__orb_opt.html
+++ b/sphinxman/master/autodir_options_c/dfocc__orb_opt.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__orb_opt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__orb_opt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__orb_resp_solver.html b/sphinxman/master/autodir_options_c/dfocc__orb_resp_solver.html
index 338d01879a1..d659f69ce4d 100644
--- a/sphinxman/master/autodir_options_c/dfocc__orb_resp_solver.html
+++ b/sphinxman/master/autodir_options_c/dfocc__orb_resp_solver.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__orb_resp_solver.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__orb_resp_solver.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__orth_type.html b/sphinxman/master/autodir_options_c/dfocc__orth_type.html
index 6ecc54fb9af..8257b8c94ae 100644
--- a/sphinxman/master/autodir_options_c/dfocc__orth_type.html
+++ b/sphinxman/master/autodir_options_c/dfocc__orth_type.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__orth_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__orth_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__pcg_beta_type.html b/sphinxman/master/autodir_options_c/dfocc__pcg_beta_type.html
index a1bda361683..a4c4e19710f 100644
--- a/sphinxman/master/autodir_options_c/dfocc__pcg_beta_type.html
+++ b/sphinxman/master/autodir_options_c/dfocc__pcg_beta_type.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__pcg_beta_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__pcg_beta_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__pcg_convergence.html b/sphinxman/master/autodir_options_c/dfocc__pcg_convergence.html
index d76ca19c8b4..6dfccabedce 100644
--- a/sphinxman/master/autodir_options_c/dfocc__pcg_convergence.html
+++ b/sphinxman/master/autodir_options_c/dfocc__pcg_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__pcg_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__pcg_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__pcg_maxiter.html b/sphinxman/master/autodir_options_c/dfocc__pcg_maxiter.html
index 5ff784f2e52..1e8e4599497 100644
--- a/sphinxman/master/autodir_options_c/dfocc__pcg_maxiter.html
+++ b/sphinxman/master/autodir_options_c/dfocc__pcg_maxiter.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__pcg_maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__pcg_maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__ppl_type.html b/sphinxman/master/autodir_options_c/dfocc__ppl_type.html
index 302011977fc..86dbacade75 100644
--- a/sphinxman/master/autodir_options_c/dfocc__ppl_type.html
+++ b/sphinxman/master/autodir_options_c/dfocc__ppl_type.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__ppl_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__ppl_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__qchf.html b/sphinxman/master/autodir_options_c/dfocc__qchf.html
index 7b49a37b135..c9275826079 100644
--- a/sphinxman/master/autodir_options_c/dfocc__qchf.html
+++ b/sphinxman/master/autodir_options_c/dfocc__qchf.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__qchf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__qchf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__r_convergence.html b/sphinxman/master/autodir_options_c/dfocc__r_convergence.html
index 326587bfaa4..69a1b55fde6 100644
--- a/sphinxman/master/autodir_options_c/dfocc__r_convergence.html
+++ b/sphinxman/master/autodir_options_c/dfocc__r_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__r_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__r_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__read_scf_3index.html b/sphinxman/master/autodir_options_c/dfocc__read_scf_3index.html
index b3ab4ef449d..cb409c0c8b4 100644
--- a/sphinxman/master/autodir_options_c/dfocc__read_scf_3index.html
+++ b/sphinxman/master/autodir_options_c/dfocc__read_scf_3index.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__read_scf_3index.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__read_scf_3index.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__reg_param.html b/sphinxman/master/autodir_options_c/dfocc__reg_param.html
index d34c9400ec9..9081b1ae92e 100644
--- a/sphinxman/master/autodir_options_c/dfocc__reg_param.html
+++ b/sphinxman/master/autodir_options_c/dfocc__reg_param.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__reg_param.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__reg_param.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__regularization.html b/sphinxman/master/autodir_options_c/dfocc__regularization.html
index f950ca45d45..e4b96d883a0 100644
--- a/sphinxman/master/autodir_options_c/dfocc__regularization.html
+++ b/sphinxman/master/autodir_options_c/dfocc__regularization.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__regularization.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__regularization.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__remp_a.html b/sphinxman/master/autodir_options_c/dfocc__remp_a.html
index 36fe7b33e03..5ca3b292948 100644
--- a/sphinxman/master/autodir_options_c/dfocc__remp_a.html
+++ b/sphinxman/master/autodir_options_c/dfocc__remp_a.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__remp_a.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__remp_a.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__rms_mograd_convergence.html b/sphinxman/master/autodir_options_c/dfocc__rms_mograd_convergence.html
index a26f5caaa37..8098aab9f06 100644
--- a/sphinxman/master/autodir_options_c/dfocc__rms_mograd_convergence.html
+++ b/sphinxman/master/autodir_options_c/dfocc__rms_mograd_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__rms_mograd_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__rms_mograd_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__scs_type.html b/sphinxman/master/autodir_options_c/dfocc__scs_type.html
index 2abe8f6dc0c..904ebd66fca 100644
--- a/sphinxman/master/autodir_options_c/dfocc__scs_type.html
+++ b/sphinxman/master/autodir_options_c/dfocc__scs_type.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__scs_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__scs_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__sos_type.html b/sphinxman/master/autodir_options_c/dfocc__sos_type.html
index 5050f0bf0f8..93c9239aaf5 100644
--- a/sphinxman/master/autodir_options_c/dfocc__sos_type.html
+++ b/sphinxman/master/autodir_options_c/dfocc__sos_type.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__sos_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__sos_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__triples_iabc_type.html b/sphinxman/master/autodir_options_c/dfocc__triples_iabc_type.html
index f77e846944a..e9c79294608 100644
--- a/sphinxman/master/autodir_options_c/dfocc__triples_iabc_type.html
+++ b/sphinxman/master/autodir_options_c/dfocc__triples_iabc_type.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__triples_iabc_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__triples_iabc_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dfocc__wfn_type.html b/sphinxman/master/autodir_options_c/dfocc__wfn_type.html
index 4350635b13d..fdbf9e3bc1c 100644
--- a/sphinxman/master/autodir_options_c/dfocc__wfn_type.html
+++ b/sphinxman/master/autodir_options_c/dfocc__wfn_type.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__wfn_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dfocc__wfn_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dlpno__df_basis_mp2.html b/sphinxman/master/autodir_options_c/dlpno__df_basis_mp2.html
index b1438d51420..3bf7ed1e3f9 100644
--- a/sphinxman/master/autodir_options_c/dlpno__df_basis_mp2.html
+++ b/sphinxman/master/autodir_options_c/dlpno__df_basis_mp2.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dlpno__df_basis_mp2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dlpno__df_basis_mp2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dlpno__dlpno_algorithm.html b/sphinxman/master/autodir_options_c/dlpno__dlpno_algorithm.html
index 3250df019b5..a0a83b1ec3b 100644
--- a/sphinxman/master/autodir_options_c/dlpno__dlpno_algorithm.html
+++ b/sphinxman/master/autodir_options_c/dlpno__dlpno_algorithm.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dlpno__dlpno_algorithm.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dlpno__dlpno_algorithm.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dlpno__dlpno_local_orbitals.html b/sphinxman/master/autodir_options_c/dlpno__dlpno_local_orbitals.html
index 8d41411711e..42040b5dadc 100644
--- a/sphinxman/master/autodir_options_c/dlpno__dlpno_local_orbitals.html
+++ b/sphinxman/master/autodir_options_c/dlpno__dlpno_local_orbitals.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dlpno__dlpno_local_orbitals.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dlpno__dlpno_local_orbitals.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dlpno__dlpno_maxiter.html b/sphinxman/master/autodir_options_c/dlpno__dlpno_maxiter.html
index 1ae79f6a8af..d5f9fe79b17 100644
--- a/sphinxman/master/autodir_options_c/dlpno__dlpno_maxiter.html
+++ b/sphinxman/master/autodir_options_c/dlpno__dlpno_maxiter.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dlpno__dlpno_maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dlpno__dlpno_maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dlpno__doi_basis_tolerance.html b/sphinxman/master/autodir_options_c/dlpno__doi_basis_tolerance.html
index 1a476818419..062c2dac4d5 100644
--- a/sphinxman/master/autodir_options_c/dlpno__doi_basis_tolerance.html
+++ b/sphinxman/master/autodir_options_c/dlpno__doi_basis_tolerance.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dlpno__doi_basis_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dlpno__doi_basis_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dlpno__doi_pruning_scheme.html b/sphinxman/master/autodir_options_c/dlpno__doi_pruning_scheme.html
index 951deb51041..a61f65ec2ad 100644
--- a/sphinxman/master/autodir_options_c/dlpno__doi_pruning_scheme.html
+++ b/sphinxman/master/autodir_options_c/dlpno__doi_pruning_scheme.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dlpno__doi_pruning_scheme.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dlpno__doi_pruning_scheme.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dlpno__doi_radial_points.html b/sphinxman/master/autodir_options_c/dlpno__doi_radial_points.html
index f75932bdaa1..ce2109304a5 100644
--- a/sphinxman/master/autodir_options_c/dlpno__doi_radial_points.html
+++ b/sphinxman/master/autodir_options_c/dlpno__doi_radial_points.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dlpno__doi_radial_points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dlpno__doi_radial_points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dlpno__doi_spherical_points.html b/sphinxman/master/autodir_options_c/dlpno__doi_spherical_points.html
index 79b79294e07..2199336d3b5 100644
--- a/sphinxman/master/autodir_options_c/dlpno__doi_spherical_points.html
+++ b/sphinxman/master/autodir_options_c/dlpno__doi_spherical_points.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dlpno__doi_spherical_points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dlpno__doi_spherical_points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dlpno__e_convergence.html b/sphinxman/master/autodir_options_c/dlpno__e_convergence.html
index cf2e579015e..2807903c59c 100644
--- a/sphinxman/master/autodir_options_c/dlpno__e_convergence.html
+++ b/sphinxman/master/autodir_options_c/dlpno__e_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dlpno__e_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dlpno__e_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dlpno__f_cut.html b/sphinxman/master/autodir_options_c/dlpno__f_cut.html
index 757eea59aeb..7809d7ad7d1 100644
--- a/sphinxman/master/autodir_options_c/dlpno__f_cut.html
+++ b/sphinxman/master/autodir_options_c/dlpno__f_cut.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dlpno__f_cut.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dlpno__f_cut.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dlpno__local_convergence.html b/sphinxman/master/autodir_options_c/dlpno__local_convergence.html
index abea8404ba2..f69fd392fd9 100644
--- a/sphinxman/master/autodir_options_c/dlpno__local_convergence.html
+++ b/sphinxman/master/autodir_options_c/dlpno__local_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dlpno__local_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dlpno__local_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dlpno__local_maxiter.html b/sphinxman/master/autodir_options_c/dlpno__local_maxiter.html
index 809b8d8c88e..0f6faf19e73 100644
--- a/sphinxman/master/autodir_options_c/dlpno__local_maxiter.html
+++ b/sphinxman/master/autodir_options_c/dlpno__local_maxiter.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dlpno__local_maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dlpno__local_maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dlpno__pno_convergence.html b/sphinxman/master/autodir_options_c/dlpno__pno_convergence.html
index 3e255c63c63..3881782c423 100644
--- a/sphinxman/master/autodir_options_c/dlpno__pno_convergence.html
+++ b/sphinxman/master/autodir_options_c/dlpno__pno_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dlpno__pno_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dlpno__pno_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dlpno__r_convergence.html b/sphinxman/master/autodir_options_c/dlpno__r_convergence.html
index a5e9a07d229..447aa590f2d 100644
--- a/sphinxman/master/autodir_options_c/dlpno__r_convergence.html
+++ b/sphinxman/master/autodir_options_c/dlpno__r_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dlpno__r_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dlpno__r_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dlpno__s_cut.html b/sphinxman/master/autodir_options_c/dlpno__s_cut.html
index 19922bbe2da..32c770a8bd5 100644
--- a/sphinxman/master/autodir_options_c/dlpno__s_cut.html
+++ b/sphinxman/master/autodir_options_c/dlpno__s_cut.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dlpno__s_cut.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dlpno__s_cut.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dlpno__t_cut_clmo.html b/sphinxman/master/autodir_options_c/dlpno__t_cut_clmo.html
index 2a72493fe5e..5e2a2b6e903 100644
--- a/sphinxman/master/autodir_options_c/dlpno__t_cut_clmo.html
+++ b/sphinxman/master/autodir_options_c/dlpno__t_cut_clmo.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dlpno__t_cut_clmo.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dlpno__t_cut_clmo.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dlpno__t_cut_cpao.html b/sphinxman/master/autodir_options_c/dlpno__t_cut_cpao.html
index aad0ce49ea2..c0ecedc528c 100644
--- a/sphinxman/master/autodir_options_c/dlpno__t_cut_cpao.html
+++ b/sphinxman/master/autodir_options_c/dlpno__t_cut_cpao.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dlpno__t_cut_cpao.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dlpno__t_cut_cpao.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dlpno__t_cut_do.html b/sphinxman/master/autodir_options_c/dlpno__t_cut_do.html
index 449a9a3cf0f..e533168cce0 100644
--- a/sphinxman/master/autodir_options_c/dlpno__t_cut_do.html
+++ b/sphinxman/master/autodir_options_c/dlpno__t_cut_do.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dlpno__t_cut_do.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dlpno__t_cut_do.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dlpno__t_cut_do_ij.html b/sphinxman/master/autodir_options_c/dlpno__t_cut_do_ij.html
index d4376fe750f..4ad295aba10 100644
--- a/sphinxman/master/autodir_options_c/dlpno__t_cut_do_ij.html
+++ b/sphinxman/master/autodir_options_c/dlpno__t_cut_do_ij.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dlpno__t_cut_do_ij.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dlpno__t_cut_do_ij.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dlpno__t_cut_do_pre.html b/sphinxman/master/autodir_options_c/dlpno__t_cut_do_pre.html
index dd9e543cd27..110b8f2ea42 100644
--- a/sphinxman/master/autodir_options_c/dlpno__t_cut_do_pre.html
+++ b/sphinxman/master/autodir_options_c/dlpno__t_cut_do_pre.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dlpno__t_cut_do_pre.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dlpno__t_cut_do_pre.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dlpno__t_cut_mkn.html b/sphinxman/master/autodir_options_c/dlpno__t_cut_mkn.html
index 947544dfdac..a51ca4345b1 100644
--- a/sphinxman/master/autodir_options_c/dlpno__t_cut_mkn.html
+++ b/sphinxman/master/autodir_options_c/dlpno__t_cut_mkn.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dlpno__t_cut_mkn.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dlpno__t_cut_mkn.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dlpno__t_cut_pno.html b/sphinxman/master/autodir_options_c/dlpno__t_cut_pno.html
index 3cec210bd8b..61ece31189b 100644
--- a/sphinxman/master/autodir_options_c/dlpno__t_cut_pno.html
+++ b/sphinxman/master/autodir_options_c/dlpno__t_cut_pno.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dlpno__t_cut_pno.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dlpno__t_cut_pno.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dlpno__t_cut_pre.html b/sphinxman/master/autodir_options_c/dlpno__t_cut_pre.html
index 9516ce1e2cb..bd6a6ecacbc 100644
--- a/sphinxman/master/autodir_options_c/dlpno__t_cut_pre.html
+++ b/sphinxman/master/autodir_options_c/dlpno__t_cut_pre.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dlpno__t_cut_pre.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dlpno__t_cut_pre.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dmrg__dmrg_caspt2_calc.html b/sphinxman/master/autodir_options_c/dmrg__dmrg_caspt2_calc.html
index 3ca585ac91d..3b526fc95f8 100644
--- a/sphinxman/master/autodir_options_c/dmrg__dmrg_caspt2_calc.html
+++ b/sphinxman/master/autodir_options_c/dmrg__dmrg_caspt2_calc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dmrg__dmrg_caspt2_calc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dmrg__dmrg_caspt2_calc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dmrg__dmrg_caspt2_imag.html b/sphinxman/master/autodir_options_c/dmrg__dmrg_caspt2_imag.html
index 334ca0fc666..6f0ccafe877 100644
--- a/sphinxman/master/autodir_options_c/dmrg__dmrg_caspt2_imag.html
+++ b/sphinxman/master/autodir_options_c/dmrg__dmrg_caspt2_imag.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dmrg__dmrg_caspt2_imag.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dmrg__dmrg_caspt2_imag.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dmrg__dmrg_caspt2_ipea.html b/sphinxman/master/autodir_options_c/dmrg__dmrg_caspt2_ipea.html
index 87e30af2d06..b624a2d1a0c 100644
--- a/sphinxman/master/autodir_options_c/dmrg__dmrg_caspt2_ipea.html
+++ b/sphinxman/master/autodir_options_c/dmrg__dmrg_caspt2_ipea.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dmrg__dmrg_caspt2_ipea.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dmrg__dmrg_caspt2_ipea.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dmrg__dmrg_caspt2_orbs.html b/sphinxman/master/autodir_options_c/dmrg__dmrg_caspt2_orbs.html
index 8ea98930adb..b3db94d3969 100644
--- a/sphinxman/master/autodir_options_c/dmrg__dmrg_caspt2_orbs.html
+++ b/sphinxman/master/autodir_options_c/dmrg__dmrg_caspt2_orbs.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dmrg__dmrg_caspt2_orbs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dmrg__dmrg_caspt2_orbs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dmrg__dmrg_diis.html b/sphinxman/master/autodir_options_c/dmrg__dmrg_diis.html
index 8b8682ed59f..64f4517b3dc 100644
--- a/sphinxman/master/autodir_options_c/dmrg__dmrg_diis.html
+++ b/sphinxman/master/autodir_options_c/dmrg__dmrg_diis.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dmrg__dmrg_diis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dmrg__dmrg_diis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dmrg__dmrg_diis_write.html b/sphinxman/master/autodir_options_c/dmrg__dmrg_diis_write.html
index 6559ad5b752..6dd988667ce 100644
--- a/sphinxman/master/autodir_options_c/dmrg__dmrg_diis_write.html
+++ b/sphinxman/master/autodir_options_c/dmrg__dmrg_diis_write.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dmrg__dmrg_diis_write.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dmrg__dmrg_diis_write.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dmrg__dmrg_excitation.html b/sphinxman/master/autodir_options_c/dmrg__dmrg_excitation.html
index f8a57c935a5..10f62f9faa7 100644
--- a/sphinxman/master/autodir_options_c/dmrg__dmrg_excitation.html
+++ b/sphinxman/master/autodir_options_c/dmrg__dmrg_excitation.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dmrg__dmrg_excitation.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dmrg__dmrg_excitation.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dmrg__dmrg_irrep.html b/sphinxman/master/autodir_options_c/dmrg__dmrg_irrep.html
index 71ab37eb023..02054a6a3af 100644
--- a/sphinxman/master/autodir_options_c/dmrg__dmrg_irrep.html
+++ b/sphinxman/master/autodir_options_c/dmrg__dmrg_irrep.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dmrg__dmrg_irrep.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dmrg__dmrg_irrep.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dmrg__dmrg_local_init.html b/sphinxman/master/autodir_options_c/dmrg__dmrg_local_init.html
index af77895f879..94f2879e41f 100644
--- a/sphinxman/master/autodir_options_c/dmrg__dmrg_local_init.html
+++ b/sphinxman/master/autodir_options_c/dmrg__dmrg_local_init.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dmrg__dmrg_local_init.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dmrg__dmrg_local_init.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dmrg__dmrg_molden_write.html b/sphinxman/master/autodir_options_c/dmrg__dmrg_molden_write.html
index 33f384568e4..198f8c0acdd 100644
--- a/sphinxman/master/autodir_options_c/dmrg__dmrg_molden_write.html
+++ b/sphinxman/master/autodir_options_c/dmrg__dmrg_molden_write.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dmrg__dmrg_molden_write.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dmrg__dmrg_molden_write.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dmrg__dmrg_mps_write.html b/sphinxman/master/autodir_options_c/dmrg__dmrg_mps_write.html
index 7c00a619e88..21dcd5f8977 100644
--- a/sphinxman/master/autodir_options_c/dmrg__dmrg_mps_write.html
+++ b/sphinxman/master/autodir_options_c/dmrg__dmrg_mps_write.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dmrg__dmrg_mps_write.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dmrg__dmrg_mps_write.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dmrg__dmrg_multiplicity.html b/sphinxman/master/autodir_options_c/dmrg__dmrg_multiplicity.html
index fd5fed22297..7f2931087ef 100644
--- a/sphinxman/master/autodir_options_c/dmrg__dmrg_multiplicity.html
+++ b/sphinxman/master/autodir_options_c/dmrg__dmrg_multiplicity.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dmrg__dmrg_multiplicity.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dmrg__dmrg_multiplicity.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dmrg__dmrg_opdm_ao_print.html b/sphinxman/master/autodir_options_c/dmrg__dmrg_opdm_ao_print.html
index 68f3ceda5b0..46475320481 100644
--- a/sphinxman/master/autodir_options_c/dmrg__dmrg_opdm_ao_print.html
+++ b/sphinxman/master/autodir_options_c/dmrg__dmrg_opdm_ao_print.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dmrg__dmrg_opdm_ao_print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dmrg__dmrg_opdm_ao_print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dmrg__dmrg_print_corr.html b/sphinxman/master/autodir_options_c/dmrg__dmrg_print_corr.html
index 0bbe26e062a..3e8e9012d07 100644
--- a/sphinxman/master/autodir_options_c/dmrg__dmrg_print_corr.html
+++ b/sphinxman/master/autodir_options_c/dmrg__dmrg_print_corr.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dmrg__dmrg_print_corr.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dmrg__dmrg_print_corr.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dmrg__dmrg_scf_active_space.html b/sphinxman/master/autodir_options_c/dmrg__dmrg_scf_active_space.html
index 8c4075a6678..06c033be498 100644
--- a/sphinxman/master/autodir_options_c/dmrg__dmrg_scf_active_space.html
+++ b/sphinxman/master/autodir_options_c/dmrg__dmrg_scf_active_space.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dmrg__dmrg_scf_active_space.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dmrg__dmrg_scf_active_space.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dmrg__dmrg_scf_diis_thr.html b/sphinxman/master/autodir_options_c/dmrg__dmrg_scf_diis_thr.html
index 5feccbbe255..435ed633f07 100644
--- a/sphinxman/master/autodir_options_c/dmrg__dmrg_scf_diis_thr.html
+++ b/sphinxman/master/autodir_options_c/dmrg__dmrg_scf_diis_thr.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dmrg__dmrg_scf_diis_thr.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dmrg__dmrg_scf_diis_thr.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dmrg__dmrg_scf_grad_thr.html b/sphinxman/master/autodir_options_c/dmrg__dmrg_scf_grad_thr.html
index 8fa28ac715b..1e86818fa5c 100644
--- a/sphinxman/master/autodir_options_c/dmrg__dmrg_scf_grad_thr.html
+++ b/sphinxman/master/autodir_options_c/dmrg__dmrg_scf_grad_thr.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dmrg__dmrg_scf_grad_thr.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dmrg__dmrg_scf_grad_thr.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dmrg__dmrg_scf_max_iter.html b/sphinxman/master/autodir_options_c/dmrg__dmrg_scf_max_iter.html
index 4e70a9d9865..1bd0aa84761 100644
--- a/sphinxman/master/autodir_options_c/dmrg__dmrg_scf_max_iter.html
+++ b/sphinxman/master/autodir_options_c/dmrg__dmrg_scf_max_iter.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dmrg__dmrg_scf_max_iter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dmrg__dmrg_scf_max_iter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dmrg__dmrg_scf_state_avg.html b/sphinxman/master/autodir_options_c/dmrg__dmrg_scf_state_avg.html
index 67e38d0f7e3..90018df9014 100644
--- a/sphinxman/master/autodir_options_c/dmrg__dmrg_scf_state_avg.html
+++ b/sphinxman/master/autodir_options_c/dmrg__dmrg_scf_state_avg.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dmrg__dmrg_scf_state_avg.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dmrg__dmrg_scf_state_avg.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dmrg__dmrg_sweep_dvdson_rtol.html b/sphinxman/master/autodir_options_c/dmrg__dmrg_sweep_dvdson_rtol.html
index 655e0478149..3b3dcd98268 100644
--- a/sphinxman/master/autodir_options_c/dmrg__dmrg_sweep_dvdson_rtol.html
+++ b/sphinxman/master/autodir_options_c/dmrg__dmrg_sweep_dvdson_rtol.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dmrg__dmrg_sweep_dvdson_rtol.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dmrg__dmrg_sweep_dvdson_rtol.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dmrg__dmrg_sweep_energy_conv.html b/sphinxman/master/autodir_options_c/dmrg__dmrg_sweep_energy_conv.html
index 6bede18d653..b79d15a1907 100644
--- a/sphinxman/master/autodir_options_c/dmrg__dmrg_sweep_energy_conv.html
+++ b/sphinxman/master/autodir_options_c/dmrg__dmrg_sweep_energy_conv.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dmrg__dmrg_sweep_energy_conv.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dmrg__dmrg_sweep_energy_conv.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dmrg__dmrg_sweep_max_sweeps.html b/sphinxman/master/autodir_options_c/dmrg__dmrg_sweep_max_sweeps.html
index 7fe2f5bc3cf..1d0b09deb29 100644
--- a/sphinxman/master/autodir_options_c/dmrg__dmrg_sweep_max_sweeps.html
+++ b/sphinxman/master/autodir_options_c/dmrg__dmrg_sweep_max_sweeps.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dmrg__dmrg_sweep_max_sweeps.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dmrg__dmrg_sweep_max_sweeps.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dmrg__dmrg_sweep_noise_prefac.html b/sphinxman/master/autodir_options_c/dmrg__dmrg_sweep_noise_prefac.html
index 6c479d6575e..3ed0df7d7fe 100644
--- a/sphinxman/master/autodir_options_c/dmrg__dmrg_sweep_noise_prefac.html
+++ b/sphinxman/master/autodir_options_c/dmrg__dmrg_sweep_noise_prefac.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dmrg__dmrg_sweep_noise_prefac.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dmrg__dmrg_sweep_noise_prefac.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dmrg__dmrg_sweep_states.html b/sphinxman/master/autodir_options_c/dmrg__dmrg_sweep_states.html
index d06640f3f3f..239d926f2dc 100644
--- a/sphinxman/master/autodir_options_c/dmrg__dmrg_sweep_states.html
+++ b/sphinxman/master/autodir_options_c/dmrg__dmrg_sweep_states.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dmrg__dmrg_sweep_states.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dmrg__dmrg_sweep_states.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/dmrg__dmrg_unitary_write.html b/sphinxman/master/autodir_options_c/dmrg__dmrg_unitary_write.html
index f9094c9ded1..982be886592 100644
--- a/sphinxman/master/autodir_options_c/dmrg__dmrg_unitary_write.html
+++ b/sphinxman/master/autodir_options_c/dmrg__dmrg_unitary_write.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dmrg__dmrg_unitary_write.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/dmrg__dmrg_unitary_write.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/efp__dertype.html b/sphinxman/master/autodir_options_c/efp__dertype.html
index 253f6ca0bcd..c02a54df2e1 100644
--- a/sphinxman/master/autodir_options_c/efp__dertype.html
+++ b/sphinxman/master/autodir_options_c/efp__dertype.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/efp__dertype.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/efp__dertype.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/efp__efp_disp.html b/sphinxman/master/autodir_options_c/efp__efp_disp.html
index 152078bdb5b..8248d708b9c 100644
--- a/sphinxman/master/autodir_options_c/efp__efp_disp.html
+++ b/sphinxman/master/autodir_options_c/efp__efp_disp.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/efp__efp_disp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/efp__efp_disp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/efp__efp_disp_damping.html b/sphinxman/master/autodir_options_c/efp__efp_disp_damping.html
index db74909489f..1d4214d6d48 100644
--- a/sphinxman/master/autodir_options_c/efp__efp_disp_damping.html
+++ b/sphinxman/master/autodir_options_c/efp__efp_disp_damping.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/efp__efp_disp_damping.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/efp__efp_disp_damping.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/efp__efp_elst.html b/sphinxman/master/autodir_options_c/efp__efp_elst.html
index 2a52bbc26d5..912e1ae1c4d 100644
--- a/sphinxman/master/autodir_options_c/efp__efp_elst.html
+++ b/sphinxman/master/autodir_options_c/efp__efp_elst.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/efp__efp_elst.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/efp__efp_elst.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/efp__efp_elst_damping.html b/sphinxman/master/autodir_options_c/efp__efp_elst_damping.html
index 83b840e6001..2a4f0b4dda1 100644
--- a/sphinxman/master/autodir_options_c/efp__efp_elst_damping.html
+++ b/sphinxman/master/autodir_options_c/efp__efp_elst_damping.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/efp__efp_elst_damping.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/efp__efp_elst_damping.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/efp__efp_exch.html b/sphinxman/master/autodir_options_c/efp__efp_exch.html
index 2acdd1b0ce4..1d0a3f1ed3e 100644
--- a/sphinxman/master/autodir_options_c/efp__efp_exch.html
+++ b/sphinxman/master/autodir_options_c/efp__efp_exch.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/efp__efp_exch.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/efp__efp_exch.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/efp__efp_ind.html b/sphinxman/master/autodir_options_c/efp__efp_ind.html
index 40c148ec235..e6bd10e1dd7 100644
--- a/sphinxman/master/autodir_options_c/efp__efp_ind.html
+++ b/sphinxman/master/autodir_options_c/efp__efp_ind.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/efp__efp_ind.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/efp__efp_ind.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/efp__efp_ind_damping.html b/sphinxman/master/autodir_options_c/efp__efp_ind_damping.html
index 5af3779ab04..755d958c3e0 100644
--- a/sphinxman/master/autodir_options_c/efp__efp_ind_damping.html
+++ b/sphinxman/master/autodir_options_c/efp__efp_ind_damping.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/efp__efp_ind_damping.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/efp__efp_ind_damping.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/efp__efp_qm_elst.html b/sphinxman/master/autodir_options_c/efp__efp_qm_elst.html
index 314f8a6c64b..b2fab99be3c 100644
--- a/sphinxman/master/autodir_options_c/efp__efp_qm_elst.html
+++ b/sphinxman/master/autodir_options_c/efp__efp_qm_elst.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/efp__efp_qm_elst.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/efp__efp_qm_elst.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/efp__efp_qm_ind.html b/sphinxman/master/autodir_options_c/efp__efp_qm_ind.html
index 20098b41d0b..f75e33975ef 100644
--- a/sphinxman/master/autodir_options_c/efp__efp_qm_ind.html
+++ b/sphinxman/master/autodir_options_c/efp__efp_qm_ind.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/efp__efp_qm_ind.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/efp__efp_qm_ind.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/efp__print.html b/sphinxman/master/autodir_options_c/efp__print.html
index 7f67171fdd5..b20c4143333 100644
--- a/sphinxman/master/autodir_options_c/efp__print.html
+++ b/sphinxman/master/autodir_options_c/efp__print.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/efp__print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/efp__print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/efp__qmefp.html b/sphinxman/master/autodir_options_c/efp__qmefp.html
index 9f873c5df65..75c1f7d9170 100644
--- a/sphinxman/master/autodir_options_c/efp__qmefp.html
+++ b/sphinxman/master/autodir_options_c/efp__qmefp.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/efp__qmefp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/efp__qmefp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/findif__disp_size.html b/sphinxman/master/autodir_options_c/findif__disp_size.html
index b017773a6fb..1eeb25310a0 100644
--- a/sphinxman/master/autodir_options_c/findif__disp_size.html
+++ b/sphinxman/master/autodir_options_c/findif__disp_size.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/findif__disp_size.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/findif__disp_size.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/findif__fd_project.html b/sphinxman/master/autodir_options_c/findif__fd_project.html
index 6d5a0f39181..6d03f156ed3 100644
--- a/sphinxman/master/autodir_options_c/findif__fd_project.html
+++ b/sphinxman/master/autodir_options_c/findif__fd_project.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/findif__fd_project.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/findif__fd_project.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/findif__gradient_write.html b/sphinxman/master/autodir_options_c/findif__gradient_write.html
index ab36f0b011b..8fcc1835097 100644
--- a/sphinxman/master/autodir_options_c/findif__gradient_write.html
+++ b/sphinxman/master/autodir_options_c/findif__gradient_write.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/findif__gradient_write.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/findif__gradient_write.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/findif__hessian_write.html b/sphinxman/master/autodir_options_c/findif__hessian_write.html
index 50dc42b551f..ce506009fb6 100644
--- a/sphinxman/master/autodir_options_c/findif__hessian_write.html
+++ b/sphinxman/master/autodir_options_c/findif__hessian_write.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/findif__hessian_write.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/findif__hessian_write.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/findif__normal_modes_write.html b/sphinxman/master/autodir_options_c/findif__normal_modes_write.html
index 4dcb184a836..d9071dda12f 100644
--- a/sphinxman/master/autodir_options_c/findif__normal_modes_write.html
+++ b/sphinxman/master/autodir_options_c/findif__normal_modes_write.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/findif__normal_modes_write.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/findif__normal_modes_write.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/findif__points.html b/sphinxman/master/autodir_options_c/findif__points.html
index 2049c0f3077..0d8cc78af42 100644
--- a/sphinxman/master/autodir_options_c/findif__points.html
+++ b/sphinxman/master/autodir_options_c/findif__points.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/findif__points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/findif__points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fisapt__cphf_r_convergence.html b/sphinxman/master/autodir_options_c/fisapt__cphf_r_convergence.html
index 40d6d102e3c..4dd11bb36cc 100644
--- a/sphinxman/master/autodir_options_c/fisapt__cphf_r_convergence.html
+++ b/sphinxman/master/autodir_options_c/fisapt__cphf_r_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__cphf_r_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__cphf_r_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fisapt__cubic_basis_tolerance.html b/sphinxman/master/autodir_options_c/fisapt__cubic_basis_tolerance.html
index f315df03b7e..650bc570140 100644
--- a/sphinxman/master/autodir_options_c/fisapt__cubic_basis_tolerance.html
+++ b/sphinxman/master/autodir_options_c/fisapt__cubic_basis_tolerance.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__cubic_basis_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__cubic_basis_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fisapt__cubic_block_max_points.html b/sphinxman/master/autodir_options_c/fisapt__cubic_block_max_points.html
index 39603504fca..eae9d32a695 100644
--- a/sphinxman/master/autodir_options_c/fisapt__cubic_block_max_points.html
+++ b/sphinxman/master/autodir_options_c/fisapt__cubic_block_max_points.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__cubic_block_max_points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__cubic_block_max_points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fisapt__cubic_grid_overage.html b/sphinxman/master/autodir_options_c/fisapt__cubic_grid_overage.html
index 40461bcb0f4..c631fd093b2 100644
--- a/sphinxman/master/autodir_options_c/fisapt__cubic_grid_overage.html
+++ b/sphinxman/master/autodir_options_c/fisapt__cubic_grid_overage.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__cubic_grid_overage.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__cubic_grid_overage.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fisapt__cubic_grid_spacing.html b/sphinxman/master/autodir_options_c/fisapt__cubic_grid_spacing.html
index 205b7dc8576..615b8852769 100644
--- a/sphinxman/master/autodir_options_c/fisapt__cubic_grid_spacing.html
+++ b/sphinxman/master/autodir_options_c/fisapt__cubic_grid_spacing.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__cubic_grid_spacing.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__cubic_grid_spacing.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fisapt__fisapt_charge_completeness.html b/sphinxman/master/autodir_options_c/fisapt__fisapt_charge_completeness.html
index bec151c5109..0be72e99536 100644
--- a/sphinxman/master/autodir_options_c/fisapt__fisapt_charge_completeness.html
+++ b/sphinxman/master/autodir_options_c/fisapt__fisapt_charge_completeness.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__fisapt_charge_completeness.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__fisapt_charge_completeness.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fisapt__fisapt_cube_densmat.html b/sphinxman/master/autodir_options_c/fisapt__fisapt_cube_densmat.html
index a82556f01d4..981b0df4ef6 100644
--- a/sphinxman/master/autodir_options_c/fisapt__fisapt_cube_densmat.html
+++ b/sphinxman/master/autodir_options_c/fisapt__fisapt_cube_densmat.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__fisapt_cube_densmat.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__fisapt_cube_densmat.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fisapt__fisapt_cube_linkibos.html b/sphinxman/master/autodir_options_c/fisapt__fisapt_cube_linkibos.html
index 267cf1637ba..ade2a6cbb4a 100644
--- a/sphinxman/master/autodir_options_c/fisapt__fisapt_cube_linkibos.html
+++ b/sphinxman/master/autodir_options_c/fisapt__fisapt_cube_linkibos.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__fisapt_cube_linkibos.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__fisapt_cube_linkibos.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fisapt__fisapt_cube_linkihos.html b/sphinxman/master/autodir_options_c/fisapt__fisapt_cube_linkihos.html
index 96a66c82d60..44a3201d214 100644
--- a/sphinxman/master/autodir_options_c/fisapt__fisapt_cube_linkihos.html
+++ b/sphinxman/master/autodir_options_c/fisapt__fisapt_cube_linkihos.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__fisapt_cube_linkihos.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__fisapt_cube_linkihos.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fisapt__fisapt_do_fsapt.html b/sphinxman/master/autodir_options_c/fisapt__fisapt_do_fsapt.html
index d985e9468f5..2565fb62e72 100644
--- a/sphinxman/master/autodir_options_c/fisapt__fisapt_do_fsapt.html
+++ b/sphinxman/master/autodir_options_c/fisapt__fisapt_do_fsapt.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__fisapt_do_fsapt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__fisapt_do_fsapt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fisapt__fisapt_do_fsapt_disp.html b/sphinxman/master/autodir_options_c/fisapt__fisapt_do_fsapt_disp.html
index 8347e7fccd9..efe8d30c335 100644
--- a/sphinxman/master/autodir_options_c/fisapt__fisapt_do_fsapt_disp.html
+++ b/sphinxman/master/autodir_options_c/fisapt__fisapt_do_fsapt_disp.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__fisapt_do_fsapt_disp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__fisapt_do_fsapt_disp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fisapt__fisapt_do_plot.html b/sphinxman/master/autodir_options_c/fisapt__fisapt_do_plot.html
index 442804bb0dd..1fe934bb493 100644
--- a/sphinxman/master/autodir_options_c/fisapt__fisapt_do_plot.html
+++ b/sphinxman/master/autodir_options_c/fisapt__fisapt_do_plot.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__fisapt_do_plot.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__fisapt_do_plot.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fisapt__fisapt_exch_parperp.html b/sphinxman/master/autodir_options_c/fisapt__fisapt_exch_parperp.html
index 87ccd0598b4..2f93a11e711 100644
--- a/sphinxman/master/autodir_options_c/fisapt__fisapt_exch_parperp.html
+++ b/sphinxman/master/autodir_options_c/fisapt__fisapt_exch_parperp.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__fisapt_exch_parperp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__fisapt_exch_parperp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fisapt__fisapt_fsapt_exch_scale.html b/sphinxman/master/autodir_options_c/fisapt__fisapt_fsapt_exch_scale.html
index 92429acbd61..214a94116ac 100644
--- a/sphinxman/master/autodir_options_c/fisapt__fisapt_fsapt_exch_scale.html
+++ b/sphinxman/master/autodir_options_c/fisapt__fisapt_fsapt_exch_scale.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__fisapt_fsapt_exch_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__fisapt_fsapt_exch_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fisapt__fisapt_fsapt_filepath.html b/sphinxman/master/autodir_options_c/fisapt__fisapt_fsapt_filepath.html
index 2acef23737e..3e08f3d7998 100644
--- a/sphinxman/master/autodir_options_c/fisapt__fisapt_fsapt_filepath.html
+++ b/sphinxman/master/autodir_options_c/fisapt__fisapt_fsapt_filepath.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__fisapt_fsapt_filepath.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__fisapt_fsapt_filepath.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fisapt__fisapt_fsapt_ind_response.html b/sphinxman/master/autodir_options_c/fisapt__fisapt_fsapt_ind_response.html
index 046f2b8fa28..8606eb7f9c1 100644
--- a/sphinxman/master/autodir_options_c/fisapt__fisapt_fsapt_ind_response.html
+++ b/sphinxman/master/autodir_options_c/fisapt__fisapt_fsapt_ind_response.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__fisapt_fsapt_ind_response.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__fisapt_fsapt_ind_response.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fisapt__fisapt_fsapt_ind_scale.html b/sphinxman/master/autodir_options_c/fisapt__fisapt_fsapt_ind_scale.html
index 9bc8ae9da0e..bf1e4e480ed 100644
--- a/sphinxman/master/autodir_options_c/fisapt__fisapt_fsapt_ind_scale.html
+++ b/sphinxman/master/autodir_options_c/fisapt__fisapt_fsapt_ind_scale.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__fisapt_fsapt_ind_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__fisapt_fsapt_ind_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fisapt__fisapt_fssapt_filepath.html b/sphinxman/master/autodir_options_c/fisapt__fisapt_fssapt_filepath.html
index c05667b8878..7a794eaf9b5 100644
--- a/sphinxman/master/autodir_options_c/fisapt__fisapt_fssapt_filepath.html
+++ b/sphinxman/master/autodir_options_c/fisapt__fisapt_fssapt_filepath.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__fisapt_fssapt_filepath.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__fisapt_fssapt_filepath.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fisapt__fisapt_link_assignment.html b/sphinxman/master/autodir_options_c/fisapt__fisapt_link_assignment.html
index 8517b169447..b4dc0cf3056 100644
--- a/sphinxman/master/autodir_options_c/fisapt__fisapt_link_assignment.html
+++ b/sphinxman/master/autodir_options_c/fisapt__fisapt_link_assignment.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__fisapt_link_assignment.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__fisapt_link_assignment.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fisapt__fisapt_link_ortho.html b/sphinxman/master/autodir_options_c/fisapt__fisapt_link_ortho.html
index 62cd906e724..13204228449 100644
--- a/sphinxman/master/autodir_options_c/fisapt__fisapt_link_ortho.html
+++ b/sphinxman/master/autodir_options_c/fisapt__fisapt_link_ortho.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__fisapt_link_ortho.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__fisapt_link_ortho.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fisapt__fisapt_link_selection.html b/sphinxman/master/autodir_options_c/fisapt__fisapt_link_selection.html
index ee6b01c7787..02d1a527fdd 100644
--- a/sphinxman/master/autodir_options_c/fisapt__fisapt_link_selection.html
+++ b/sphinxman/master/autodir_options_c/fisapt__fisapt_link_selection.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__fisapt_link_selection.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__fisapt_link_selection.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fisapt__fisapt_manual_links.html b/sphinxman/master/autodir_options_c/fisapt__fisapt_manual_links.html
index fb9e41b6ea6..fe770e8cac6 100644
--- a/sphinxman/master/autodir_options_c/fisapt__fisapt_manual_links.html
+++ b/sphinxman/master/autodir_options_c/fisapt__fisapt_manual_links.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__fisapt_manual_links.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__fisapt_manual_links.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fisapt__fisapt_mem_safety_factor.html b/sphinxman/master/autodir_options_c/fisapt__fisapt_mem_safety_factor.html
index 30842ddda14..26642188d89 100644
--- a/sphinxman/master/autodir_options_c/fisapt__fisapt_mem_safety_factor.html
+++ b/sphinxman/master/autodir_options_c/fisapt__fisapt_mem_safety_factor.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__fisapt_mem_safety_factor.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__fisapt_mem_safety_factor.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fisapt__fisapt_plot_filepath.html b/sphinxman/master/autodir_options_c/fisapt__fisapt_plot_filepath.html
index 88fcaa9003a..dfb1f691df7 100644
--- a/sphinxman/master/autodir_options_c/fisapt__fisapt_plot_filepath.html
+++ b/sphinxman/master/autodir_options_c/fisapt__fisapt_plot_filepath.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__fisapt_plot_filepath.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__fisapt_plot_filepath.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fisapt__ints_tolerance.html b/sphinxman/master/autodir_options_c/fisapt__ints_tolerance.html
index 7be1c2deef8..286bb63e257 100644
--- a/sphinxman/master/autodir_options_c/fisapt__ints_tolerance.html
+++ b/sphinxman/master/autodir_options_c/fisapt__ints_tolerance.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__ints_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__ints_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fisapt__local_convergence.html b/sphinxman/master/autodir_options_c/fisapt__local_convergence.html
index 99492d5620a..67d73d780b3 100644
--- a/sphinxman/master/autodir_options_c/fisapt__local_convergence.html
+++ b/sphinxman/master/autodir_options_c/fisapt__local_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__local_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__local_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fisapt__local_ibo_condition.html b/sphinxman/master/autodir_options_c/fisapt__local_ibo_condition.html
index 173393e7f04..69b18e81664 100644
--- a/sphinxman/master/autodir_options_c/fisapt__local_ibo_condition.html
+++ b/sphinxman/master/autodir_options_c/fisapt__local_ibo_condition.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__local_ibo_condition.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__local_ibo_condition.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fisapt__local_ibo_power.html b/sphinxman/master/autodir_options_c/fisapt__local_ibo_power.html
index 8a782d7a817..8333f4ef39b 100644
--- a/sphinxman/master/autodir_options_c/fisapt__local_ibo_power.html
+++ b/sphinxman/master/autodir_options_c/fisapt__local_ibo_power.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__local_ibo_power.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__local_ibo_power.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fisapt__local_ibo_stars.html b/sphinxman/master/autodir_options_c/fisapt__local_ibo_stars.html
index 87bec7ad64d..46fbbe07518 100644
--- a/sphinxman/master/autodir_options_c/fisapt__local_ibo_stars.html
+++ b/sphinxman/master/autodir_options_c/fisapt__local_ibo_stars.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__local_ibo_stars.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__local_ibo_stars.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fisapt__local_ibo_stars_completeness.html b/sphinxman/master/autodir_options_c/fisapt__local_ibo_stars_completeness.html
index a68d8df007a..22449085b52 100644
--- a/sphinxman/master/autodir_options_c/fisapt__local_ibo_stars_completeness.html
+++ b/sphinxman/master/autodir_options_c/fisapt__local_ibo_stars_completeness.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__local_ibo_stars_completeness.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__local_ibo_stars_completeness.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fisapt__local_ibo_use_stars.html b/sphinxman/master/autodir_options_c/fisapt__local_ibo_use_stars.html
index 605467b2f32..346d900d66d 100644
--- a/sphinxman/master/autodir_options_c/fisapt__local_ibo_use_stars.html
+++ b/sphinxman/master/autodir_options_c/fisapt__local_ibo_use_stars.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__local_ibo_use_stars.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__local_ibo_use_stars.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fisapt__local_maxiter.html b/sphinxman/master/autodir_options_c/fisapt__local_maxiter.html
index 2803dab17d9..6e43a2b25ec 100644
--- a/sphinxman/master/autodir_options_c/fisapt__local_maxiter.html
+++ b/sphinxman/master/autodir_options_c/fisapt__local_maxiter.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__local_maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__local_maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fisapt__local_use_ghosts.html b/sphinxman/master/autodir_options_c/fisapt__local_use_ghosts.html
index 6cd313b127a..ca82f80507f 100644
--- a/sphinxman/master/autodir_options_c/fisapt__local_use_ghosts.html
+++ b/sphinxman/master/autodir_options_c/fisapt__local_use_ghosts.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__local_use_ghosts.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__local_use_ghosts.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fisapt__maxiter.html b/sphinxman/master/autodir_options_c/fisapt__maxiter.html
index e76c43bcd98..04453c4720c 100644
--- a/sphinxman/master/autodir_options_c/fisapt__maxiter.html
+++ b/sphinxman/master/autodir_options_c/fisapt__maxiter.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fisapt__minao_basis.html b/sphinxman/master/autodir_options_c/fisapt__minao_basis.html
index 4d5a8445d59..503fa1d6b97 100644
--- a/sphinxman/master/autodir_options_c/fisapt__minao_basis.html
+++ b/sphinxman/master/autodir_options_c/fisapt__minao_basis.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__minao_basis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__minao_basis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fisapt__ssapt0_scale.html b/sphinxman/master/autodir_options_c/fisapt__ssapt0_scale.html
index 4bbab0bb3a9..9c5176aeb3e 100644
--- a/sphinxman/master/autodir_options_c/fisapt__ssapt0_scale.html
+++ b/sphinxman/master/autodir_options_c/fisapt__ssapt0_scale.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__ssapt0_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fisapt__ssapt0_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fnocc__active_nat_orbs.html b/sphinxman/master/autodir_options_c/fnocc__active_nat_orbs.html
index 73a65cafca9..da97b3585bf 100644
--- a/sphinxman/master/autodir_options_c/fnocc__active_nat_orbs.html
+++ b/sphinxman/master/autodir_options_c/fnocc__active_nat_orbs.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__active_nat_orbs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__active_nat_orbs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fnocc__brueckner_maxiter.html b/sphinxman/master/autodir_options_c/fnocc__brueckner_maxiter.html
index 441e8d8fd85..2355f6e2ac6 100644
--- a/sphinxman/master/autodir_options_c/fnocc__brueckner_maxiter.html
+++ b/sphinxman/master/autodir_options_c/fnocc__brueckner_maxiter.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__brueckner_maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__brueckner_maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fnocc__cc_scale_os.html b/sphinxman/master/autodir_options_c/fnocc__cc_scale_os.html
index 6371a636ac0..a3a0c6ce758 100644
--- a/sphinxman/master/autodir_options_c/fnocc__cc_scale_os.html
+++ b/sphinxman/master/autodir_options_c/fnocc__cc_scale_os.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__cc_scale_os.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__cc_scale_os.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fnocc__cc_scale_ss.html b/sphinxman/master/autodir_options_c/fnocc__cc_scale_ss.html
index 369f0e902e5..68b84db1f06 100644
--- a/sphinxman/master/autodir_options_c/fnocc__cc_scale_ss.html
+++ b/sphinxman/master/autodir_options_c/fnocc__cc_scale_ss.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__cc_scale_ss.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__cc_scale_ss.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fnocc__cc_timings.html b/sphinxman/master/autodir_options_c/fnocc__cc_timings.html
index 71219c4ee22..7592a480e97 100644
--- a/sphinxman/master/autodir_options_c/fnocc__cc_timings.html
+++ b/sphinxman/master/autodir_options_c/fnocc__cc_timings.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__cc_timings.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__cc_timings.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fnocc__cepa_level.html b/sphinxman/master/autodir_options_c/fnocc__cepa_level.html
index a1e205463d3..5d386479658 100644
--- a/sphinxman/master/autodir_options_c/fnocc__cepa_level.html
+++ b/sphinxman/master/autodir_options_c/fnocc__cepa_level.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__cepa_level.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__cepa_level.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fnocc__cepa_no_singles.html b/sphinxman/master/autodir_options_c/fnocc__cepa_no_singles.html
index 4b2792d75c7..8e2f51793cd 100644
--- a/sphinxman/master/autodir_options_c/fnocc__cepa_no_singles.html
+++ b/sphinxman/master/autodir_options_c/fnocc__cepa_no_singles.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__cepa_no_singles.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__cepa_no_singles.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fnocc__cholesky_tolerance.html b/sphinxman/master/autodir_options_c/fnocc__cholesky_tolerance.html
index 5d78bc526ea..d808ee91056 100644
--- a/sphinxman/master/autodir_options_c/fnocc__cholesky_tolerance.html
+++ b/sphinxman/master/autodir_options_c/fnocc__cholesky_tolerance.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__cholesky_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__cholesky_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fnocc__compute_mp4_triples.html b/sphinxman/master/autodir_options_c/fnocc__compute_mp4_triples.html
index 97aa758808b..554b7b37d65 100644
--- a/sphinxman/master/autodir_options_c/fnocc__compute_mp4_triples.html
+++ b/sphinxman/master/autodir_options_c/fnocc__compute_mp4_triples.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__compute_mp4_triples.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__compute_mp4_triples.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fnocc__compute_triples.html b/sphinxman/master/autodir_options_c/fnocc__compute_triples.html
index 701bcd53a83..29e19265180 100644
--- a/sphinxman/master/autodir_options_c/fnocc__compute_triples.html
+++ b/sphinxman/master/autodir_options_c/fnocc__compute_triples.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__compute_triples.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__compute_triples.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fnocc__df_basis_cc.html b/sphinxman/master/autodir_options_c/fnocc__df_basis_cc.html
index a4553ead836..7f8a5708e74 100644
--- a/sphinxman/master/autodir_options_c/fnocc__df_basis_cc.html
+++ b/sphinxman/master/autodir_options_c/fnocc__df_basis_cc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__df_basis_cc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__df_basis_cc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fnocc__dfcc.html b/sphinxman/master/autodir_options_c/fnocc__dfcc.html
index 4bb2276f335..8eb53bb2ace 100644
--- a/sphinxman/master/autodir_options_c/fnocc__dfcc.html
+++ b/sphinxman/master/autodir_options_c/fnocc__dfcc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__dfcc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__dfcc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fnocc__diis_max_vecs.html b/sphinxman/master/autodir_options_c/fnocc__diis_max_vecs.html
index d58979e7f1c..0d025fbb140 100644
--- a/sphinxman/master/autodir_options_c/fnocc__diis_max_vecs.html
+++ b/sphinxman/master/autodir_options_c/fnocc__diis_max_vecs.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__diis_max_vecs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__diis_max_vecs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fnocc__dipmom.html b/sphinxman/master/autodir_options_c/fnocc__dipmom.html
index 57cb8ac96fb..27da67655f9 100644
--- a/sphinxman/master/autodir_options_c/fnocc__dipmom.html
+++ b/sphinxman/master/autodir_options_c/fnocc__dipmom.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__dipmom.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__dipmom.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fnocc__e_convergence.html b/sphinxman/master/autodir_options_c/fnocc__e_convergence.html
index 6b218b22e99..4aeb0c51408 100644
--- a/sphinxman/master/autodir_options_c/fnocc__e_convergence.html
+++ b/sphinxman/master/autodir_options_c/fnocc__e_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__e_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__e_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fnocc__maxiter.html b/sphinxman/master/autodir_options_c/fnocc__maxiter.html
index c263e1c1579..4d43f814c5c 100644
--- a/sphinxman/master/autodir_options_c/fnocc__maxiter.html
+++ b/sphinxman/master/autodir_options_c/fnocc__maxiter.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fnocc__mp2_scale_os.html b/sphinxman/master/autodir_options_c/fnocc__mp2_scale_os.html
index f9b62e6c6ac..b328ba5c485 100644
--- a/sphinxman/master/autodir_options_c/fnocc__mp2_scale_os.html
+++ b/sphinxman/master/autodir_options_c/fnocc__mp2_scale_os.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__mp2_scale_os.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__mp2_scale_os.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fnocc__mp2_scale_ss.html b/sphinxman/master/autodir_options_c/fnocc__mp2_scale_ss.html
index a6b73e0dbd4..3068b66a302 100644
--- a/sphinxman/master/autodir_options_c/fnocc__mp2_scale_ss.html
+++ b/sphinxman/master/autodir_options_c/fnocc__mp2_scale_ss.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__mp2_scale_ss.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__mp2_scale_ss.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fnocc__nat_orbs.html b/sphinxman/master/autodir_options_c/fnocc__nat_orbs.html
index 3ccfcbf2e66..b74447967e4 100644
--- a/sphinxman/master/autodir_options_c/fnocc__nat_orbs.html
+++ b/sphinxman/master/autodir_options_c/fnocc__nat_orbs.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__nat_orbs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__nat_orbs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fnocc__occ_percentage.html b/sphinxman/master/autodir_options_c/fnocc__occ_percentage.html
index eb0cb5381bf..2059e687edb 100644
--- a/sphinxman/master/autodir_options_c/fnocc__occ_percentage.html
+++ b/sphinxman/master/autodir_options_c/fnocc__occ_percentage.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__occ_percentage.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__occ_percentage.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fnocc__occ_tolerance.html b/sphinxman/master/autodir_options_c/fnocc__occ_tolerance.html
index 8de4200df1c..e2990cab7db 100644
--- a/sphinxman/master/autodir_options_c/fnocc__occ_tolerance.html
+++ b/sphinxman/master/autodir_options_c/fnocc__occ_tolerance.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__occ_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__occ_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fnocc__r_convergence.html b/sphinxman/master/autodir_options_c/fnocc__r_convergence.html
index 1e817419fae..d6fe88a2a97 100644
--- a/sphinxman/master/autodir_options_c/fnocc__r_convergence.html
+++ b/sphinxman/master/autodir_options_c/fnocc__r_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__r_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__r_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fnocc__run_ccsd.html b/sphinxman/master/autodir_options_c/fnocc__run_ccsd.html
index 2a58e9406fd..a3bac2faef4 100644
--- a/sphinxman/master/autodir_options_c/fnocc__run_ccsd.html
+++ b/sphinxman/master/autodir_options_c/fnocc__run_ccsd.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__run_ccsd.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__run_ccsd.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fnocc__run_cepa.html b/sphinxman/master/autodir_options_c/fnocc__run_cepa.html
index 75204a0ff15..9b69f50522b 100644
--- a/sphinxman/master/autodir_options_c/fnocc__run_cepa.html
+++ b/sphinxman/master/autodir_options_c/fnocc__run_cepa.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__run_cepa.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__run_cepa.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fnocc__run_mp2.html b/sphinxman/master/autodir_options_c/fnocc__run_mp2.html
index 17eba555914..e415812717b 100644
--- a/sphinxman/master/autodir_options_c/fnocc__run_mp2.html
+++ b/sphinxman/master/autodir_options_c/fnocc__run_mp2.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__run_mp2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__run_mp2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fnocc__run_mp3.html b/sphinxman/master/autodir_options_c/fnocc__run_mp3.html
index 5e57b372a63..48109312815 100644
--- a/sphinxman/master/autodir_options_c/fnocc__run_mp3.html
+++ b/sphinxman/master/autodir_options_c/fnocc__run_mp3.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__run_mp3.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__run_mp3.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fnocc__run_mp4.html b/sphinxman/master/autodir_options_c/fnocc__run_mp4.html
index d7f88b7a4ff..098db8bfcef 100644
--- a/sphinxman/master/autodir_options_c/fnocc__run_mp4.html
+++ b/sphinxman/master/autodir_options_c/fnocc__run_mp4.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__run_mp4.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__run_mp4.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fnocc__scs_ccsd.html b/sphinxman/master/autodir_options_c/fnocc__scs_ccsd.html
index 3db755b9bfd..f55386eb5fb 100644
--- a/sphinxman/master/autodir_options_c/fnocc__scs_ccsd.html
+++ b/sphinxman/master/autodir_options_c/fnocc__scs_ccsd.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__scs_ccsd.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__scs_ccsd.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fnocc__scs_cepa.html b/sphinxman/master/autodir_options_c/fnocc__scs_cepa.html
index 8937c3fdc6e..5a562da33bb 100644
--- a/sphinxman/master/autodir_options_c/fnocc__scs_cepa.html
+++ b/sphinxman/master/autodir_options_c/fnocc__scs_cepa.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__scs_cepa.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__scs_cepa.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fnocc__scs_mp2.html b/sphinxman/master/autodir_options_c/fnocc__scs_mp2.html
index ba00bb6d986..8cb6c019bee 100644
--- a/sphinxman/master/autodir_options_c/fnocc__scs_mp2.html
+++ b/sphinxman/master/autodir_options_c/fnocc__scs_mp2.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__scs_mp2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__scs_mp2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fnocc__triples_low_memory.html b/sphinxman/master/autodir_options_c/fnocc__triples_low_memory.html
index 69f74304dad..9af4a8ecd55 100644
--- a/sphinxman/master/autodir_options_c/fnocc__triples_low_memory.html
+++ b/sphinxman/master/autodir_options_c/fnocc__triples_low_memory.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__triples_low_memory.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__triples_low_memory.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/fnocc__use_df_ints.html b/sphinxman/master/autodir_options_c/fnocc__use_df_ints.html
index 4e68dca97ec..7ee0b3c2d12 100644
--- a/sphinxman/master/autodir_options_c/fnocc__use_df_ints.html
+++ b/sphinxman/master/autodir_options_c/fnocc__use_df_ints.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__use_df_ints.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/fnocc__use_df_ints.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/gdma__gdma_limit.html b/sphinxman/master/autodir_options_c/gdma__gdma_limit.html
index 50e766b0091..902bc98f161 100644
--- a/sphinxman/master/autodir_options_c/gdma__gdma_limit.html
+++ b/sphinxman/master/autodir_options_c/gdma__gdma_limit.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/gdma__gdma_limit.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/gdma__gdma_limit.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/gdma__gdma_multipole_units.html b/sphinxman/master/autodir_options_c/gdma__gdma_multipole_units.html
index ad724a11b8a..e597de68108 100644
--- a/sphinxman/master/autodir_options_c/gdma__gdma_multipole_units.html
+++ b/sphinxman/master/autodir_options_c/gdma__gdma_multipole_units.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/gdma__gdma_multipole_units.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/gdma__gdma_multipole_units.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/gdma__gdma_origin.html b/sphinxman/master/autodir_options_c/gdma__gdma_origin.html
index cc69e5a6682..3c08bbb8c9c 100644
--- a/sphinxman/master/autodir_options_c/gdma__gdma_origin.html
+++ b/sphinxman/master/autodir_options_c/gdma__gdma_origin.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/gdma__gdma_origin.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/gdma__gdma_origin.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/gdma__gdma_radius.html b/sphinxman/master/autodir_options_c/gdma__gdma_radius.html
index e80c3c497a9..9d296008843 100644
--- a/sphinxman/master/autodir_options_c/gdma__gdma_radius.html
+++ b/sphinxman/master/autodir_options_c/gdma__gdma_radius.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/gdma__gdma_radius.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/gdma__gdma_radius.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/gdma__gdma_switch.html b/sphinxman/master/autodir_options_c/gdma__gdma_switch.html
index fafed71d99a..a1fd2ee245e 100644
--- a/sphinxman/master/autodir_options_c/gdma__gdma_switch.html
+++ b/sphinxman/master/autodir_options_c/gdma__gdma_switch.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/gdma__gdma_switch.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/gdma__gdma_switch.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__active.html b/sphinxman/master/autodir_options_c/globals__active.html
index c8871d4d16e..6fda26d1d2f 100644
--- a/sphinxman/master/autodir_options_c/globals__active.html
+++ b/sphinxman/master/autodir_options_c/globals__active.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__active.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__active.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__basis_relativistic.html b/sphinxman/master/autodir_options_c/globals__basis_relativistic.html
index 0c38d0cabe6..91bfe139f77 100644
--- a/sphinxman/master/autodir_options_c/globals__basis_relativistic.html
+++ b/sphinxman/master/autodir_options_c/globals__basis_relativistic.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__basis_relativistic.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__basis_relativistic.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__bench.html b/sphinxman/master/autodir_options_c/globals__bench.html
index 386e24aaf95..1f278deb244 100644
--- a/sphinxman/master/autodir_options_c/globals__bench.html
+++ b/sphinxman/master/autodir_options_c/globals__bench.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__bench.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__bench.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__brianqc_enable.html b/sphinxman/master/autodir_options_c/globals__brianqc_enable.html
index e7a79949b5e..21d14d5aaa7 100644
--- a/sphinxman/master/autodir_options_c/globals__brianqc_enable.html
+++ b/sphinxman/master/autodir_options_c/globals__brianqc_enable.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__brianqc_enable.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__brianqc_enable.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__cc_type.html b/sphinxman/master/autodir_options_c/globals__cc_type.html
index 33fc4a4c555..b8ab141017d 100644
--- a/sphinxman/master/autodir_options_c/globals__cc_type.html
+++ b/sphinxman/master/autodir_options_c/globals__cc_type.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__cc_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__cc_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__ci_type.html b/sphinxman/master/autodir_options_c/globals__ci_type.html
index baafbe5f6dc..33e9d5560af 100644
--- a/sphinxman/master/autodir_options_c/globals__ci_type.html
+++ b/sphinxman/master/autodir_options_c/globals__ci_type.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__ci_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__ci_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__cubeprop_basis_functions.html b/sphinxman/master/autodir_options_c/globals__cubeprop_basis_functions.html
index f73f828c859..730425222a5 100644
--- a/sphinxman/master/autodir_options_c/globals__cubeprop_basis_functions.html
+++ b/sphinxman/master/autodir_options_c/globals__cubeprop_basis_functions.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__cubeprop_basis_functions.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__cubeprop_basis_functions.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__cubeprop_filepath.html b/sphinxman/master/autodir_options_c/globals__cubeprop_filepath.html
index c609e2e0a59..e88d07bc1f9 100644
--- a/sphinxman/master/autodir_options_c/globals__cubeprop_filepath.html
+++ b/sphinxman/master/autodir_options_c/globals__cubeprop_filepath.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__cubeprop_filepath.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__cubeprop_filepath.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__cubeprop_isocontour_threshold.html b/sphinxman/master/autodir_options_c/globals__cubeprop_isocontour_threshold.html
index fa46804976f..225b4600d11 100644
--- a/sphinxman/master/autodir_options_c/globals__cubeprop_isocontour_threshold.html
+++ b/sphinxman/master/autodir_options_c/globals__cubeprop_isocontour_threshold.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__cubeprop_isocontour_threshold.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__cubeprop_isocontour_threshold.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__cubeprop_orbitals.html b/sphinxman/master/autodir_options_c/globals__cubeprop_orbitals.html
index cf9be167a50..f0c31fffab3 100644
--- a/sphinxman/master/autodir_options_c/globals__cubeprop_orbitals.html
+++ b/sphinxman/master/autodir_options_c/globals__cubeprop_orbitals.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__cubeprop_orbitals.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__cubeprop_orbitals.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__cubeprop_tasks.html b/sphinxman/master/autodir_options_c/globals__cubeprop_tasks.html
index 579d618e7e6..8ae93ad32d4 100644
--- a/sphinxman/master/autodir_options_c/globals__cubeprop_tasks.html
+++ b/sphinxman/master/autodir_options_c/globals__cubeprop_tasks.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__cubeprop_tasks.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__cubeprop_tasks.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__cubic_basis_tolerance.html b/sphinxman/master/autodir_options_c/globals__cubic_basis_tolerance.html
index b875fb81459..cef6f926cd7 100644
--- a/sphinxman/master/autodir_options_c/globals__cubic_basis_tolerance.html
+++ b/sphinxman/master/autodir_options_c/globals__cubic_basis_tolerance.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__cubic_basis_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__cubic_basis_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__cubic_block_max_points.html b/sphinxman/master/autodir_options_c/globals__cubic_block_max_points.html
index 8b95d11e439..81b52f9d100 100644
--- a/sphinxman/master/autodir_options_c/globals__cubic_block_max_points.html
+++ b/sphinxman/master/autodir_options_c/globals__cubic_block_max_points.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__cubic_block_max_points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__cubic_block_max_points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__cubic_grid_overage.html b/sphinxman/master/autodir_options_c/globals__cubic_grid_overage.html
index eea56c83237..fb7a544c655 100644
--- a/sphinxman/master/autodir_options_c/globals__cubic_grid_overage.html
+++ b/sphinxman/master/autodir_options_c/globals__cubic_grid_overage.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__cubic_grid_overage.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__cubic_grid_overage.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__cubic_grid_spacing.html b/sphinxman/master/autodir_options_c/globals__cubic_grid_spacing.html
index ee771af4d09..22db18bac0b 100644
--- a/sphinxman/master/autodir_options_c/globals__cubic_grid_spacing.html
+++ b/sphinxman/master/autodir_options_c/globals__cubic_grid_spacing.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__cubic_grid_spacing.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__cubic_grid_spacing.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__ddx.html b/sphinxman/master/autodir_options_c/globals__ddx.html
index 6b6e5e4ca9a..93a965fe2ca 100644
--- a/sphinxman/master/autodir_options_c/globals__ddx.html
+++ b/sphinxman/master/autodir_options_c/globals__ddx.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__ddx.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__ddx.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__debug.html b/sphinxman/master/autodir_options_c/globals__debug.html
index dc691f83314..5a4300b1309 100644
--- a/sphinxman/master/autodir_options_c/globals__debug.html
+++ b/sphinxman/master/autodir_options_c/globals__debug.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__debug.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__debug.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__dertype.html b/sphinxman/master/autodir_options_c/globals__dertype.html
index 9a7855430e1..02273e72367 100644
--- a/sphinxman/master/autodir_options_c/globals__dertype.html
+++ b/sphinxman/master/autodir_options_c/globals__dertype.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__dertype.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__dertype.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__df_basis_cc.html b/sphinxman/master/autodir_options_c/globals__df_basis_cc.html
index 0d1ca046240..061e72f9573 100644
--- a/sphinxman/master/autodir_options_c/globals__df_basis_cc.html
+++ b/sphinxman/master/autodir_options_c/globals__df_basis_cc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__df_basis_cc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__df_basis_cc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__die_if_not_converged.html b/sphinxman/master/autodir_options_c/globals__die_if_not_converged.html
index c55745c8d8f..11946db5e19 100644
--- a/sphinxman/master/autodir_options_c/globals__die_if_not_converged.html
+++ b/sphinxman/master/autodir_options_c/globals__die_if_not_converged.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__die_if_not_converged.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__die_if_not_converged.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__dkh_order.html b/sphinxman/master/autodir_options_c/globals__dkh_order.html
index c21fcfc84af..4ca077db22c 100644
--- a/sphinxman/master/autodir_options_c/globals__dkh_order.html
+++ b/sphinxman/master/autodir_options_c/globals__dkh_order.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__dkh_order.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__dkh_order.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__docc.html b/sphinxman/master/autodir_options_c/globals__docc.html
index 27e1cc04009..01dda7884d4 100644
--- a/sphinxman/master/autodir_options_c/globals__docc.html
+++ b/sphinxman/master/autodir_options_c/globals__docc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__docc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__docc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__external_potential_symmetry.html b/sphinxman/master/autodir_options_c/globals__external_potential_symmetry.html
index cf24a7e46fb..1ec78f5d01a 100644
--- a/sphinxman/master/autodir_options_c/globals__external_potential_symmetry.html
+++ b/sphinxman/master/autodir_options_c/globals__external_potential_symmetry.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__external_potential_symmetry.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__external_potential_symmetry.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__freeze_core.html b/sphinxman/master/autodir_options_c/globals__freeze_core.html
index 515d77db551..d64915c80da 100644
--- a/sphinxman/master/autodir_options_c/globals__freeze_core.html
+++ b/sphinxman/master/autodir_options_c/globals__freeze_core.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__freeze_core.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__freeze_core.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__freeze_core_policy.html b/sphinxman/master/autodir_options_c/globals__freeze_core_policy.html
index 5f2f77ff2ba..ba95cc19424 100644
--- a/sphinxman/master/autodir_options_c/globals__freeze_core_policy.html
+++ b/sphinxman/master/autodir_options_c/globals__freeze_core_policy.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__freeze_core_policy.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__freeze_core_policy.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__frozen_docc.html b/sphinxman/master/autodir_options_c/globals__frozen_docc.html
index b5fc1b2c2a5..1ca2d554c65 100644
--- a/sphinxman/master/autodir_options_c/globals__frozen_docc.html
+++ b/sphinxman/master/autodir_options_c/globals__frozen_docc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__frozen_docc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__frozen_docc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__frozen_uocc.html b/sphinxman/master/autodir_options_c/globals__frozen_uocc.html
index 350fe29aec9..8076eddf40a 100644
--- a/sphinxman/master/autodir_options_c/globals__frozen_uocc.html
+++ b/sphinxman/master/autodir_options_c/globals__frozen_uocc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__frozen_uocc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__frozen_uocc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__integral_package.html b/sphinxman/master/autodir_options_c/globals__integral_package.html
index d91ab52d5f2..456e891cbb4 100644
--- a/sphinxman/master/autodir_options_c/globals__integral_package.html
+++ b/sphinxman/master/autodir_options_c/globals__integral_package.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__integral_package.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__integral_package.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__literal_cfour.html b/sphinxman/master/autodir_options_c/globals__literal_cfour.html
index 12d2bedfac4..fd1e0743222 100644
--- a/sphinxman/master/autodir_options_c/globals__literal_cfour.html
+++ b/sphinxman/master/autodir_options_c/globals__literal_cfour.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__literal_cfour.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__literal_cfour.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__ls_thc_basis_tolerance.html b/sphinxman/master/autodir_options_c/globals__ls_thc_basis_tolerance.html
index 0b3e534eb30..e5e28105c53 100644
--- a/sphinxman/master/autodir_options_c/globals__ls_thc_basis_tolerance.html
+++ b/sphinxman/master/autodir_options_c/globals__ls_thc_basis_tolerance.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__ls_thc_basis_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__ls_thc_basis_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__ls_thc_df.html b/sphinxman/master/autodir_options_c/globals__ls_thc_df.html
index 18680f21d03..9ece4cf6c68 100644
--- a/sphinxman/master/autodir_options_c/globals__ls_thc_df.html
+++ b/sphinxman/master/autodir_options_c/globals__ls_thc_df.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__ls_thc_df.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__ls_thc_df.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__ls_thc_pruning_scheme.html b/sphinxman/master/autodir_options_c/globals__ls_thc_pruning_scheme.html
index ea98bd8be71..1a369355167 100644
--- a/sphinxman/master/autodir_options_c/globals__ls_thc_pruning_scheme.html
+++ b/sphinxman/master/autodir_options_c/globals__ls_thc_pruning_scheme.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__ls_thc_pruning_scheme.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__ls_thc_pruning_scheme.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__ls_thc_radial_points.html b/sphinxman/master/autodir_options_c/globals__ls_thc_radial_points.html
index 6f48b665e2b..b35b4882cbd 100644
--- a/sphinxman/master/autodir_options_c/globals__ls_thc_radial_points.html
+++ b/sphinxman/master/autodir_options_c/globals__ls_thc_radial_points.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__ls_thc_radial_points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__ls_thc_radial_points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__ls_thc_s_epsilon.html b/sphinxman/master/autodir_options_c/globals__ls_thc_s_epsilon.html
index 81903db4425..c0a7eea17a2 100644
--- a/sphinxman/master/autodir_options_c/globals__ls_thc_s_epsilon.html
+++ b/sphinxman/master/autodir_options_c/globals__ls_thc_s_epsilon.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__ls_thc_s_epsilon.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__ls_thc_s_epsilon.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__ls_thc_spherical_points.html b/sphinxman/master/autodir_options_c/globals__ls_thc_spherical_points.html
index e433f5c1830..64e50200346 100644
--- a/sphinxman/master/autodir_options_c/globals__ls_thc_spherical_points.html
+++ b/sphinxman/master/autodir_options_c/globals__ls_thc_spherical_points.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__ls_thc_spherical_points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__ls_thc_spherical_points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__ls_thc_weights_tolerance.html b/sphinxman/master/autodir_options_c/globals__ls_thc_weights_tolerance.html
index 96b235751ab..9b64bfa74af 100644
--- a/sphinxman/master/autodir_options_c/globals__ls_thc_weights_tolerance.html
+++ b/sphinxman/master/autodir_options_c/globals__ls_thc_weights_tolerance.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__ls_thc_weights_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__ls_thc_weights_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__mat_num_column_print.html b/sphinxman/master/autodir_options_c/globals__mat_num_column_print.html
index e742372a0e7..eef99c939ec 100644
--- a/sphinxman/master/autodir_options_c/globals__mat_num_column_print.html
+++ b/sphinxman/master/autodir_options_c/globals__mat_num_column_print.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__mat_num_column_print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__mat_num_column_print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__max_radial_moment.html b/sphinxman/master/autodir_options_c/globals__max_radial_moment.html
index 177d425f9b5..7caada40ce8 100644
--- a/sphinxman/master/autodir_options_c/globals__max_radial_moment.html
+++ b/sphinxman/master/autodir_options_c/globals__max_radial_moment.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__max_radial_moment.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__max_radial_moment.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__mbis_d_convergence.html b/sphinxman/master/autodir_options_c/globals__mbis_d_convergence.html
index d6e836f26be..64ff1d085bd 100644
--- a/sphinxman/master/autodir_options_c/globals__mbis_d_convergence.html
+++ b/sphinxman/master/autodir_options_c/globals__mbis_d_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__mbis_d_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__mbis_d_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__mbis_maxiter.html b/sphinxman/master/autodir_options_c/globals__mbis_maxiter.html
index 95fc739255d..43c4ddd440d 100644
--- a/sphinxman/master/autodir_options_c/globals__mbis_maxiter.html
+++ b/sphinxman/master/autodir_options_c/globals__mbis_maxiter.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__mbis_maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__mbis_maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__mbis_pruning_scheme.html b/sphinxman/master/autodir_options_c/globals__mbis_pruning_scheme.html
index de16cd102ed..6e93401b859 100644
--- a/sphinxman/master/autodir_options_c/globals__mbis_pruning_scheme.html
+++ b/sphinxman/master/autodir_options_c/globals__mbis_pruning_scheme.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__mbis_pruning_scheme.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__mbis_pruning_scheme.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__mbis_radial_points.html b/sphinxman/master/autodir_options_c/globals__mbis_radial_points.html
index 98e32ab3415..3a7c8bf50ba 100644
--- a/sphinxman/master/autodir_options_c/globals__mbis_radial_points.html
+++ b/sphinxman/master/autodir_options_c/globals__mbis_radial_points.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__mbis_radial_points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__mbis_radial_points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__mbis_spherical_points.html b/sphinxman/master/autodir_options_c/globals__mbis_spherical_points.html
index 5388ccae197..25eda0dc5a7 100644
--- a/sphinxman/master/autodir_options_c/globals__mbis_spherical_points.html
+++ b/sphinxman/master/autodir_options_c/globals__mbis_spherical_points.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__mbis_spherical_points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__mbis_spherical_points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__molden_with_virtual.html b/sphinxman/master/autodir_options_c/globals__molden_with_virtual.html
index 2fdbf67dbbe..a357d24a0ba 100644
--- a/sphinxman/master/autodir_options_c/globals__molden_with_virtual.html
+++ b/sphinxman/master/autodir_options_c/globals__molden_with_virtual.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__molden_with_virtual.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__molden_with_virtual.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__mp2_type.html b/sphinxman/master/autodir_options_c/globals__mp2_type.html
index e07e2b8089f..426d6fea2ec 100644
--- a/sphinxman/master/autodir_options_c/globals__mp2_type.html
+++ b/sphinxman/master/autodir_options_c/globals__mp2_type.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__mp2_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__mp2_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__mp_type.html b/sphinxman/master/autodir_options_c/globals__mp_type.html
index b28166df2a3..b58e28a5edb 100644
--- a/sphinxman/master/autodir_options_c/globals__mp_type.html
+++ b/sphinxman/master/autodir_options_c/globals__mp_type.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__mp_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__mp_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__num_frozen_docc.html b/sphinxman/master/autodir_options_c/globals__num_frozen_docc.html
index 9392a12d2c1..2b026340ce7 100644
--- a/sphinxman/master/autodir_options_c/globals__num_frozen_docc.html
+++ b/sphinxman/master/autodir_options_c/globals__num_frozen_docc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__num_frozen_docc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__num_frozen_docc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__num_frozen_uocc.html b/sphinxman/master/autodir_options_c/globals__num_frozen_uocc.html
index f82ed134937..2375975775d 100644
--- a/sphinxman/master/autodir_options_c/globals__num_frozen_uocc.html
+++ b/sphinxman/master/autodir_options_c/globals__num_frozen_uocc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__num_frozen_uocc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__num_frozen_uocc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__parent_symmetry.html b/sphinxman/master/autodir_options_c/globals__parent_symmetry.html
index cc4c83370ae..25b89dfa7d0 100644
--- a/sphinxman/master/autodir_options_c/globals__parent_symmetry.html
+++ b/sphinxman/master/autodir_options_c/globals__parent_symmetry.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__parent_symmetry.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__parent_symmetry.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__pcm.html b/sphinxman/master/autodir_options_c/globals__pcm.html
index 8272476c375..2288e553c8b 100644
--- a/sphinxman/master/autodir_options_c/globals__pcm.html
+++ b/sphinxman/master/autodir_options_c/globals__pcm.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__pcm.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__pcm.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__pe.html b/sphinxman/master/autodir_options_c/globals__pe.html
index 4b161be33fc..c9a2597a9d5 100644
--- a/sphinxman/master/autodir_options_c/globals__pe.html
+++ b/sphinxman/master/autodir_options_c/globals__pe.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__pe.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__pe.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__print.html b/sphinxman/master/autodir_options_c/globals__print.html
index 2f3e231770f..1955807a582 100644
--- a/sphinxman/master/autodir_options_c/globals__print.html
+++ b/sphinxman/master/autodir_options_c/globals__print.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__print_noons.html b/sphinxman/master/autodir_options_c/globals__print_noons.html
index 83b125298ea..df8c159b6fa 100644
--- a/sphinxman/master/autodir_options_c/globals__print_noons.html
+++ b/sphinxman/master/autodir_options_c/globals__print_noons.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__print_noons.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__print_noons.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__properties.html b/sphinxman/master/autodir_options_c/globals__properties.html
index 9b5077b0501..9b649dbe34f 100644
--- a/sphinxman/master/autodir_options_c/globals__properties.html
+++ b/sphinxman/master/autodir_options_c/globals__properties.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__properties.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__properties.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__properties_origin.html b/sphinxman/master/autodir_options_c/globals__properties_origin.html
index b63fdcdcf80..b728c6762bc 100644
--- a/sphinxman/master/autodir_options_c/globals__properties_origin.html
+++ b/sphinxman/master/autodir_options_c/globals__properties_origin.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__properties_origin.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__properties_origin.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__puream.html b/sphinxman/master/autodir_options_c/globals__puream.html
index 3f31a8ff9d5..b7577871bdb 100644
--- a/sphinxman/master/autodir_options_c/globals__puream.html
+++ b/sphinxman/master/autodir_options_c/globals__puream.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__puream.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__puream.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__qc_module.html b/sphinxman/master/autodir_options_c/globals__qc_module.html
index 5457adcee0d..bb46706e9ee 100644
--- a/sphinxman/master/autodir_options_c/globals__qc_module.html
+++ b/sphinxman/master/autodir_options_c/globals__qc_module.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__qc_module.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__qc_module.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__ras1.html b/sphinxman/master/autodir_options_c/globals__ras1.html
index dfc62cd8bc6..be2884911a8 100644
--- a/sphinxman/master/autodir_options_c/globals__ras1.html
+++ b/sphinxman/master/autodir_options_c/globals__ras1.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__ras1.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__ras1.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__ras2.html b/sphinxman/master/autodir_options_c/globals__ras2.html
index 2f58fec40a5..a3b77afe713 100644
--- a/sphinxman/master/autodir_options_c/globals__ras2.html
+++ b/sphinxman/master/autodir_options_c/globals__ras2.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__ras2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__ras2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__ras3.html b/sphinxman/master/autodir_options_c/globals__ras3.html
index 88289985d0e..3fcb1438488 100644
--- a/sphinxman/master/autodir_options_c/globals__ras3.html
+++ b/sphinxman/master/autodir_options_c/globals__ras3.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__ras3.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__ras3.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__ras4.html b/sphinxman/master/autodir_options_c/globals__ras4.html
index 81e2aebfb02..ba3512efb9b 100644
--- a/sphinxman/master/autodir_options_c/globals__ras4.html
+++ b/sphinxman/master/autodir_options_c/globals__ras4.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__ras4.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__ras4.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__relativistic.html b/sphinxman/master/autodir_options_c/globals__relativistic.html
index a83101e580a..580afe4e786 100644
--- a/sphinxman/master/autodir_options_c/globals__relativistic.html
+++ b/sphinxman/master/autodir_options_c/globals__relativistic.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__relativistic.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__relativistic.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__restricted_docc.html b/sphinxman/master/autodir_options_c/globals__restricted_docc.html
index 9ae094f181d..84f743cb992 100644
--- a/sphinxman/master/autodir_options_c/globals__restricted_docc.html
+++ b/sphinxman/master/autodir_options_c/globals__restricted_docc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__restricted_docc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__restricted_docc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__restricted_uocc.html b/sphinxman/master/autodir_options_c/globals__restricted_uocc.html
index d4a63e962ea..16558beb801 100644
--- a/sphinxman/master/autodir_options_c/globals__restricted_uocc.html
+++ b/sphinxman/master/autodir_options_c/globals__restricted_uocc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__restricted_uocc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__restricted_uocc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__scf_type.html b/sphinxman/master/autodir_options_c/globals__scf_type.html
index 62c92db7b1c..14f48972f9c 100644
--- a/sphinxman/master/autodir_options_c/globals__scf_type.html
+++ b/sphinxman/master/autodir_options_c/globals__scf_type.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__scf_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__scf_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__screening.html b/sphinxman/master/autodir_options_c/globals__screening.html
index 356cc3dfd93..c2a542c37da 100644
--- a/sphinxman/master/autodir_options_c/globals__screening.html
+++ b/sphinxman/master/autodir_options_c/globals__screening.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__screening.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__screening.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__socc.html b/sphinxman/master/autodir_options_c/globals__socc.html
index 8b73cb8ae91..f0bc4dd9812 100644
--- a/sphinxman/master/autodir_options_c/globals__socc.html
+++ b/sphinxman/master/autodir_options_c/globals__socc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__socc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__socc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__wfn.html b/sphinxman/master/autodir_options_c/globals__wfn.html
index 1862278e5e8..aed83e8212a 100644
--- a/sphinxman/master/autodir_options_c/globals__wfn.html
+++ b/sphinxman/master/autodir_options_c/globals__wfn.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__wfn.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__wfn.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/globals__writer_file_label.html b/sphinxman/master/autodir_options_c/globals__writer_file_label.html
index d77841dff93..5334c67a85f 100644
--- a/sphinxman/master/autodir_options_c/globals__writer_file_label.html
+++ b/sphinxman/master/autodir_options_c/globals__writer_file_label.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__writer_file_label.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/globals__writer_file_label.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/mcscf__canonicalize_active_favg.html b/sphinxman/master/autodir_options_c/mcscf__canonicalize_active_favg.html
index 6ea243180a8..ad38510494c 100644
--- a/sphinxman/master/autodir_options_c/mcscf__canonicalize_active_favg.html
+++ b/sphinxman/master/autodir_options_c/mcscf__canonicalize_active_favg.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mcscf__canonicalize_active_favg.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mcscf__canonicalize_active_favg.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/mcscf__canonicalize_inactive_favg.html b/sphinxman/master/autodir_options_c/mcscf__canonicalize_inactive_favg.html
index f227c31104d..6cdc28f8133 100644
--- a/sphinxman/master/autodir_options_c/mcscf__canonicalize_inactive_favg.html
+++ b/sphinxman/master/autodir_options_c/mcscf__canonicalize_inactive_favg.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mcscf__canonicalize_inactive_favg.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mcscf__canonicalize_inactive_favg.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/mcscf__ci_diis.html b/sphinxman/master/autodir_options_c/mcscf__ci_diis.html
index cfd540d4221..5a65be48842 100644
--- a/sphinxman/master/autodir_options_c/mcscf__ci_diis.html
+++ b/sphinxman/master/autodir_options_c/mcscf__ci_diis.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mcscf__ci_diis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mcscf__ci_diis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/mcscf__d_convergence.html b/sphinxman/master/autodir_options_c/mcscf__d_convergence.html
index 1b6a78c38ec..d2810b03996 100644
--- a/sphinxman/master/autodir_options_c/mcscf__d_convergence.html
+++ b/sphinxman/master/autodir_options_c/mcscf__d_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mcscf__d_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mcscf__d_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/mcscf__diis.html b/sphinxman/master/autodir_options_c/mcscf__diis.html
index 097804790dd..edef3d02f46 100644
--- a/sphinxman/master/autodir_options_c/mcscf__diis.html
+++ b/sphinxman/master/autodir_options_c/mcscf__diis.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mcscf__diis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mcscf__diis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/mcscf__diis_max_vecs.html b/sphinxman/master/autodir_options_c/mcscf__diis_max_vecs.html
index c9ae6a100e4..b22f61abde6 100644
--- a/sphinxman/master/autodir_options_c/mcscf__diis_max_vecs.html
+++ b/sphinxman/master/autodir_options_c/mcscf__diis_max_vecs.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mcscf__diis_max_vecs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mcscf__diis_max_vecs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/mcscf__docc.html b/sphinxman/master/autodir_options_c/mcscf__docc.html
index c9476a08036..27c9e3745ed 100644
--- a/sphinxman/master/autodir_options_c/mcscf__docc.html
+++ b/sphinxman/master/autodir_options_c/mcscf__docc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mcscf__docc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mcscf__docc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/mcscf__e_convergence.html b/sphinxman/master/autodir_options_c/mcscf__e_convergence.html
index 3c4893a1057..a7244224f82 100644
--- a/sphinxman/master/autodir_options_c/mcscf__e_convergence.html
+++ b/sphinxman/master/autodir_options_c/mcscf__e_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mcscf__e_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mcscf__e_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/mcscf__favg.html b/sphinxman/master/autodir_options_c/mcscf__favg.html
index d733f793e8c..307196760b5 100644
--- a/sphinxman/master/autodir_options_c/mcscf__favg.html
+++ b/sphinxman/master/autodir_options_c/mcscf__favg.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mcscf__favg.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mcscf__favg.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/mcscf__favg_start.html b/sphinxman/master/autodir_options_c/mcscf__favg_start.html
index 025fa8f4893..c0bde9761e2 100644
--- a/sphinxman/master/autodir_options_c/mcscf__favg_start.html
+++ b/sphinxman/master/autodir_options_c/mcscf__favg_start.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mcscf__favg_start.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mcscf__favg_start.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/mcscf__follow_root.html b/sphinxman/master/autodir_options_c/mcscf__follow_root.html
index d39206459df..4c4958613c2 100644
--- a/sphinxman/master/autodir_options_c/mcscf__follow_root.html
+++ b/sphinxman/master/autodir_options_c/mcscf__follow_root.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mcscf__follow_root.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mcscf__follow_root.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/mcscf__force_twocon.html b/sphinxman/master/autodir_options_c/mcscf__force_twocon.html
index eab42ed7263..74e767f08ad 100644
--- a/sphinxman/master/autodir_options_c/mcscf__force_twocon.html
+++ b/sphinxman/master/autodir_options_c/mcscf__force_twocon.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mcscf__force_twocon.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mcscf__force_twocon.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/mcscf__internal_rotations.html b/sphinxman/master/autodir_options_c/mcscf__internal_rotations.html
index 2bc5c42623b..b8b78a55a33 100644
--- a/sphinxman/master/autodir_options_c/mcscf__internal_rotations.html
+++ b/sphinxman/master/autodir_options_c/mcscf__internal_rotations.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mcscf__internal_rotations.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mcscf__internal_rotations.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/mcscf__level_shift.html b/sphinxman/master/autodir_options_c/mcscf__level_shift.html
index 3bc1cf1df0c..a719dafe4c1 100644
--- a/sphinxman/master/autodir_options_c/mcscf__level_shift.html
+++ b/sphinxman/master/autodir_options_c/mcscf__level_shift.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mcscf__level_shift.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mcscf__level_shift.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/mcscf__maxiter.html b/sphinxman/master/autodir_options_c/mcscf__maxiter.html
index 9cfbc6b5402..947052399a1 100644
--- a/sphinxman/master/autodir_options_c/mcscf__maxiter.html
+++ b/sphinxman/master/autodir_options_c/mcscf__maxiter.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mcscf__maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mcscf__maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/mcscf__mo_read.html b/sphinxman/master/autodir_options_c/mcscf__mo_read.html
index 459922b67e3..9a4b211527b 100644
--- a/sphinxman/master/autodir_options_c/mcscf__mo_read.html
+++ b/sphinxman/master/autodir_options_c/mcscf__mo_read.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mcscf__mo_read.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mcscf__mo_read.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/mcscf__reference.html b/sphinxman/master/autodir_options_c/mcscf__reference.html
index 0d72b99b5aa..8a17456b090 100644
--- a/sphinxman/master/autodir_options_c/mcscf__reference.html
+++ b/sphinxman/master/autodir_options_c/mcscf__reference.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mcscf__reference.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mcscf__reference.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/mcscf__rotate_mo_angle.html b/sphinxman/master/autodir_options_c/mcscf__rotate_mo_angle.html
index 7f535e21954..1a8cf38f729 100644
--- a/sphinxman/master/autodir_options_c/mcscf__rotate_mo_angle.html
+++ b/sphinxman/master/autodir_options_c/mcscf__rotate_mo_angle.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mcscf__rotate_mo_angle.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mcscf__rotate_mo_angle.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/mcscf__rotate_mo_irrep.html b/sphinxman/master/autodir_options_c/mcscf__rotate_mo_irrep.html
index 1f6d85ceb12..6bad59d9c8d 100644
--- a/sphinxman/master/autodir_options_c/mcscf__rotate_mo_irrep.html
+++ b/sphinxman/master/autodir_options_c/mcscf__rotate_mo_irrep.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mcscf__rotate_mo_irrep.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mcscf__rotate_mo_irrep.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/mcscf__rotate_mo_p.html b/sphinxman/master/autodir_options_c/mcscf__rotate_mo_p.html
index e85fd5ec9c1..e747f9b854f 100644
--- a/sphinxman/master/autodir_options_c/mcscf__rotate_mo_p.html
+++ b/sphinxman/master/autodir_options_c/mcscf__rotate_mo_p.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mcscf__rotate_mo_p.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mcscf__rotate_mo_p.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/mcscf__rotate_mo_q.html b/sphinxman/master/autodir_options_c/mcscf__rotate_mo_q.html
index 8f7a27c12ca..2a26a0e8bfe 100644
--- a/sphinxman/master/autodir_options_c/mcscf__rotate_mo_q.html
+++ b/sphinxman/master/autodir_options_c/mcscf__rotate_mo_q.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mcscf__rotate_mo_q.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mcscf__rotate_mo_q.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/mcscf__socc.html b/sphinxman/master/autodir_options_c/mcscf__socc.html
index 6b63047d8c2..a093cc14b96 100644
--- a/sphinxman/master/autodir_options_c/mcscf__socc.html
+++ b/sphinxman/master/autodir_options_c/mcscf__socc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mcscf__socc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mcscf__socc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/mcscf__turn_on_actv.html b/sphinxman/master/autodir_options_c/mcscf__turn_on_actv.html
index 075371aac8c..680eefd0ef7 100644
--- a/sphinxman/master/autodir_options_c/mcscf__turn_on_actv.html
+++ b/sphinxman/master/autodir_options_c/mcscf__turn_on_actv.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mcscf__turn_on_actv.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -197,7 +197,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mcscf__turn_on_actv.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -213,7 +213,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/mcscf__wfn_sym.html b/sphinxman/master/autodir_options_c/mcscf__wfn_sym.html
index 1eebf26f2e9..3fb66a675b3 100644
--- a/sphinxman/master/autodir_options_c/mcscf__wfn_sym.html
+++ b/sphinxman/master/autodir_options_c/mcscf__wfn_sym.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mcscf__wfn_sym.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mcscf__wfn_sym.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/mints__basis.html b/sphinxman/master/autodir_options_c/mints__basis.html
index 2969125a008..063222cbab8 100644
--- a/sphinxman/master/autodir_options_c/mints__basis.html
+++ b/sphinxman/master/autodir_options_c/mints__basis.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mints__basis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mints__basis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/mints__omega_erf.html b/sphinxman/master/autodir_options_c/mints__omega_erf.html
index 72f98d80d9c..a02b4ba59ff 100644
--- a/sphinxman/master/autodir_options_c/mints__omega_erf.html
+++ b/sphinxman/master/autodir_options_c/mints__omega_erf.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mints__omega_erf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mints__omega_erf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/module__adc.html b/sphinxman/master/autodir_options_c/module__adc.html
index b3587488e08..6615a791168 100644
--- a/sphinxman/master/autodir_options_c/module__adc.html
+++ b/sphinxman/master/autodir_options_c/module__adc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__adc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -320,7 +320,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__adc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -335,7 +335,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/module__ccdensity.html b/sphinxman/master/autodir_options_c/module__ccdensity.html
index 0078e77b944..4e6f1f430d7 100644
--- a/sphinxman/master/autodir_options_c/module__ccdensity.html
+++ b/sphinxman/master/autodir_options_c/module__ccdensity.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__ccdensity.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -401,7 +401,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__ccdensity.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -416,7 +416,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/module__ccenergy.html b/sphinxman/master/autodir_options_c/module__ccenergy.html
index 12e56fdc5e7..ab5e80c1bf1 100644
--- a/sphinxman/master/autodir_options_c/module__ccenergy.html
+++ b/sphinxman/master/autodir_options_c/module__ccenergy.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__ccenergy.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -627,7 +627,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__ccenergy.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -642,7 +642,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/module__cceom.html b/sphinxman/master/autodir_options_c/module__cceom.html
index b00c6b91b2a..307e455b6d9 100644
--- a/sphinxman/master/autodir_options_c/module__cceom.html
+++ b/sphinxman/master/autodir_options_c/module__cceom.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__cceom.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -683,7 +683,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__cceom.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -698,7 +698,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/module__cchbar.html b/sphinxman/master/autodir_options_c/module__cchbar.html
index 5a0da3fae55..67e0bfe3509 100644
--- a/sphinxman/master/autodir_options_c/module__cchbar.html
+++ b/sphinxman/master/autodir_options_c/module__cchbar.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__cchbar.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -268,7 +268,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__cchbar.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -283,7 +283,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/module__cclambda.html b/sphinxman/master/autodir_options_c/module__cclambda.html
index d1144cd843d..fdc29ee4654 100644
--- a/sphinxman/master/autodir_options_c/module__cclambda.html
+++ b/sphinxman/master/autodir_options_c/module__cclambda.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__cclambda.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -467,7 +467,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__cclambda.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -482,7 +482,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/module__ccresponse.html b/sphinxman/master/autodir_options_c/module__ccresponse.html
index e877af4b1b7..c6a8e18053f 100644
--- a/sphinxman/master/autodir_options_c/module__ccresponse.html
+++ b/sphinxman/master/autodir_options_c/module__ccresponse.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__ccresponse.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -457,7 +457,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__ccresponse.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -472,7 +472,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/module__cctransort.html b/sphinxman/master/autodir_options_c/module__cctransort.html
index 928866998f3..4efd6175a11 100644
--- a/sphinxman/master/autodir_options_c/module__cctransort.html
+++ b/sphinxman/master/autodir_options_c/module__cctransort.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__cctransort.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -291,7 +291,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__cctransort.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -306,7 +306,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/module__cctriples.html b/sphinxman/master/autodir_options_c/module__cctriples.html
index e736b511a7a..7c95a2230f7 100644
--- a/sphinxman/master/autodir_options_c/module__cctriples.html
+++ b/sphinxman/master/autodir_options_c/module__cctriples.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__cctriples.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -257,7 +257,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__cctriples.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -272,7 +272,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/module__cfour.html b/sphinxman/master/autodir_options_c/module__cfour.html
index 1c57e4c2aeb..e0772ae80fa 100644
--- a/sphinxman/master/autodir_options_c/module__cfour.html
+++ b/sphinxman/master/autodir_options_c/module__cfour.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__cfour.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1878,7 +1878,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__cfour.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1893,7 +1893,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/module__cphf.html b/sphinxman/master/autodir_options_c/module__cphf.html
index 38824b8a818..f468019afb8 100644
--- a/sphinxman/master/autodir_options_c/module__cphf.html
+++ b/sphinxman/master/autodir_options_c/module__cphf.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__cphf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -342,7 +342,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__cphf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -357,7 +357,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/module__dct.html b/sphinxman/master/autodir_options_c/module__dct.html
index d4072a4bb76..73fb93090c3 100644
--- a/sphinxman/master/autodir_options_c/module__dct.html
+++ b/sphinxman/master/autodir_options_c/module__dct.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__dct.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -597,7 +597,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__dct.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -612,7 +612,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/module__ddx.html b/sphinxman/master/autodir_options_c/module__ddx.html
index bbf236d0742..eeb4ad02e46 100644
--- a/sphinxman/master/autodir_options_c/module__ddx.html
+++ b/sphinxman/master/autodir_options_c/module__ddx.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__ddx.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -457,7 +457,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__ddx.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -472,7 +472,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/module__detci.html b/sphinxman/master/autodir_options_c/module__detci.html
index fd132b28e1a..f14edfaa0ba 100644
--- a/sphinxman/master/autodir_options_c/module__detci.html
+++ b/sphinxman/master/autodir_options_c/module__detci.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__detci.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1531,7 +1531,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__detci.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1546,7 +1546,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/module__dfep2.html b/sphinxman/master/autodir_options_c/module__dfep2.html
index 556f731fdaf..a2a7aacbef1 100644
--- a/sphinxman/master/autodir_options_c/module__dfep2.html
+++ b/sphinxman/master/autodir_options_c/module__dfep2.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__dfep2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -274,7 +274,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__dfep2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -289,7 +289,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/module__dfmp2.html b/sphinxman/master/autodir_options_c/module__dfmp2.html
index 40bfdb60c22..dd9faaf3057 100644
--- a/sphinxman/master/autodir_options_c/module__dfmp2.html
+++ b/sphinxman/master/autodir_options_c/module__dfmp2.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__dfmp2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -359,7 +359,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__dfmp2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -374,7 +374,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/module__dfocc.html b/sphinxman/master/autodir_options_c/module__dfocc.html
index 0f388bd97a8..70edcb97a41 100644
--- a/sphinxman/master/autodir_options_c/module__dfocc.html
+++ b/sphinxman/master/autodir_options_c/module__dfocc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__dfocc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -790,7 +790,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__dfocc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -805,7 +805,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/module__dlpno.html b/sphinxman/master/autodir_options_c/module__dlpno.html
index ba06a9e8cd4..957d66e1a47 100644
--- a/sphinxman/master/autodir_options_c/module__dlpno.html
+++ b/sphinxman/master/autodir_options_c/module__dlpno.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__dlpno.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -477,7 +477,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__dlpno.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -492,7 +492,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/module__dmrg.html b/sphinxman/master/autodir_options_c/module__dmrg.html
index 7f1fc757ede..f0091c88409 100644
--- a/sphinxman/master/autodir_options_c/module__dmrg.html
+++ b/sphinxman/master/autodir_options_c/module__dmrg.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__dmrg.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -484,7 +484,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__dmrg.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -499,7 +499,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/module__efp.html b/sphinxman/master/autodir_options_c/module__efp.html
index 6f6ac59ccbd..35b4ec34be6 100644
--- a/sphinxman/master/autodir_options_c/module__efp.html
+++ b/sphinxman/master/autodir_options_c/module__efp.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__efp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -349,7 +349,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__efp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -364,7 +364,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/module__findif.html b/sphinxman/master/autodir_options_c/module__findif.html
index 13ab6ecbf71..854e520e5cf 100644
--- a/sphinxman/master/autodir_options_c/module__findif.html
+++ b/sphinxman/master/autodir_options_c/module__findif.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__findif.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -273,7 +273,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__findif.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -288,7 +288,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/module__fisapt.html b/sphinxman/master/autodir_options_c/module__fisapt.html
index 5cb58b658ca..3cdeebe7750 100644
--- a/sphinxman/master/autodir_options_c/module__fisapt.html
+++ b/sphinxman/master/autodir_options_c/module__fisapt.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__fisapt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -611,7 +611,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__fisapt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -626,7 +626,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/module__fnocc.html b/sphinxman/master/autodir_options_c/module__fnocc.html
index 0d3b8cf4a0c..235aa41b6ce 100644
--- a/sphinxman/master/autodir_options_c/module__fnocc.html
+++ b/sphinxman/master/autodir_options_c/module__fnocc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__fnocc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -565,7 +565,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__fnocc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -580,7 +580,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/module__gdma.html b/sphinxman/master/autodir_options_c/module__gdma.html
index 0f4de60e111..127ecbc9824 100644
--- a/sphinxman/master/autodir_options_c/module__gdma.html
+++ b/sphinxman/master/autodir_options_c/module__gdma.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__gdma.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -263,7 +263,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__gdma.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -278,7 +278,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/module__globals.html b/sphinxman/master/autodir_options_c/module__globals.html
index 327a7791cab..20199de6d5a 100644
--- a/sphinxman/master/autodir_options_c/module__globals.html
+++ b/sphinxman/master/autodir_options_c/module__globals.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__globals.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -983,7 +983,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__globals.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -998,7 +998,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/module__mcscf.html b/sphinxman/master/autodir_options_c/module__mcscf.html
index f06a7528311..6c5a0299677 100644
--- a/sphinxman/master/autodir_options_c/module__mcscf.html
+++ b/sphinxman/master/autodir_options_c/module__mcscf.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__mcscf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -477,7 +477,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__mcscf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -492,7 +492,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/module__mints.html b/sphinxman/master/autodir_options_c/module__mints.html
index 663c49bc567..ca6040da6ef 100644
--- a/sphinxman/master/autodir_options_c/module__mints.html
+++ b/sphinxman/master/autodir_options_c/module__mints.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__mints.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -230,7 +230,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__mints.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -245,7 +245,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/module__mrcc.html b/sphinxman/master/autodir_options_c/module__mrcc.html
index 7dade903eb6..4d2ab3c9a85 100644
--- a/sphinxman/master/autodir_options_c/module__mrcc.html
+++ b/sphinxman/master/autodir_options_c/module__mrcc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__mrcc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -312,7 +312,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__mrcc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -327,7 +327,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/module__occ.html b/sphinxman/master/autodir_options_c/module__occ.html
index 5e19a550244..de10e31c7f5 100644
--- a/sphinxman/master/autodir_options_c/module__occ.html
+++ b/sphinxman/master/autodir_options_c/module__occ.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__occ.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -839,7 +839,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__occ.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -854,7 +854,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/module__optking.html b/sphinxman/master/autodir_options_c/module__optking.html
index 3d844b8023a..e82c86286c0 100644
--- a/sphinxman/master/autodir_options_c/module__optking.html
+++ b/sphinxman/master/autodir_options_c/module__optking.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__optking.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1088,7 +1088,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__optking.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1103,7 +1103,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/module__pcm.html b/sphinxman/master/autodir_options_c/module__pcm.html
index 9180231933c..2f5356fb573 100644
--- a/sphinxman/master/autodir_options_c/module__pcm.html
+++ b/sphinxman/master/autodir_options_c/module__pcm.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__pcm.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -248,7 +248,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__pcm.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -263,7 +263,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/module__pe.html b/sphinxman/master/autodir_options_c/module__pe.html
index 6b5da68e2b1..3027218baa1 100644
--- a/sphinxman/master/autodir_options_c/module__pe.html
+++ b/sphinxman/master/autodir_options_c/module__pe.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__pe.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -419,7 +419,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__pe.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -434,7 +434,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/module__psimrcc.html b/sphinxman/master/autodir_options_c/module__psimrcc.html
index 205aed97f3c..fdebf9b5355 100644
--- a/sphinxman/master/autodir_options_c/module__psimrcc.html
+++ b/sphinxman/master/autodir_options_c/module__psimrcc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__psimrcc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -636,7 +636,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__psimrcc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -651,7 +651,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/module__sapt.html b/sphinxman/master/autodir_options_c/module__sapt.html
index 565377e11a1..00b8ffafb0b 100644
--- a/sphinxman/master/autodir_options_c/module__sapt.html
+++ b/sphinxman/master/autodir_options_c/module__sapt.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__sapt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -773,7 +773,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__sapt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -788,7 +788,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/module__scf.html b/sphinxman/master/autodir_options_c/module__scf.html
index e4b58b22381..bdb9561a987 100644
--- a/sphinxman/master/autodir_options_c/module__scf.html
+++ b/sphinxman/master/autodir_options_c/module__scf.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__scf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -2335,7 +2335,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__scf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -2350,7 +2350,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/module__thermo.html b/sphinxman/master/autodir_options_c/module__thermo.html
index 2145addc2eb..c3c9dd727ff 100644
--- a/sphinxman/master/autodir_options_c/module__thermo.html
+++ b/sphinxman/master/autodir_options_c/module__thermo.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__thermo.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -239,7 +239,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/module__thermo.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -254,7 +254,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/mrcc__e_convergence.html b/sphinxman/master/autodir_options_c/mrcc__e_convergence.html
index f8d3e027398..c5e1014ce05 100644
--- a/sphinxman/master/autodir_options_c/mrcc__e_convergence.html
+++ b/sphinxman/master/autodir_options_c/mrcc__e_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mrcc__e_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mrcc__e_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/mrcc__ints_tolerance.html b/sphinxman/master/autodir_options_c/mrcc__ints_tolerance.html
index 9ae04a7396f..a3a58d51b4c 100644
--- a/sphinxman/master/autodir_options_c/mrcc__ints_tolerance.html
+++ b/sphinxman/master/autodir_options_c/mrcc__ints_tolerance.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mrcc__ints_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mrcc__ints_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/mrcc__mrcc_level.html b/sphinxman/master/autodir_options_c/mrcc__mrcc_level.html
index fe93be17b31..c99874ac2ba 100644
--- a/sphinxman/master/autodir_options_c/mrcc__mrcc_level.html
+++ b/sphinxman/master/autodir_options_c/mrcc__mrcc_level.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mrcc__mrcc_level.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mrcc__mrcc_level.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/mrcc__mrcc_method.html b/sphinxman/master/autodir_options_c/mrcc__mrcc_method.html
index 1a7964aeb8f..792991da21b 100644
--- a/sphinxman/master/autodir_options_c/mrcc__mrcc_method.html
+++ b/sphinxman/master/autodir_options_c/mrcc__mrcc_method.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mrcc__mrcc_method.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mrcc__mrcc_method.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/mrcc__mrcc_num_doublet_roots.html b/sphinxman/master/autodir_options_c/mrcc__mrcc_num_doublet_roots.html
index 16f56b50df0..be844fd1060 100644
--- a/sphinxman/master/autodir_options_c/mrcc__mrcc_num_doublet_roots.html
+++ b/sphinxman/master/autodir_options_c/mrcc__mrcc_num_doublet_roots.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mrcc__mrcc_num_doublet_roots.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mrcc__mrcc_num_doublet_roots.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/mrcc__mrcc_num_singlet_roots.html b/sphinxman/master/autodir_options_c/mrcc__mrcc_num_singlet_roots.html
index 99ecf45e8f2..a1bf3862ba3 100644
--- a/sphinxman/master/autodir_options_c/mrcc__mrcc_num_singlet_roots.html
+++ b/sphinxman/master/autodir_options_c/mrcc__mrcc_num_singlet_roots.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mrcc__mrcc_num_singlet_roots.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mrcc__mrcc_num_singlet_roots.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/mrcc__mrcc_num_triplet_roots.html b/sphinxman/master/autodir_options_c/mrcc__mrcc_num_triplet_roots.html
index c0c85a81d69..495acc01675 100644
--- a/sphinxman/master/autodir_options_c/mrcc__mrcc_num_triplet_roots.html
+++ b/sphinxman/master/autodir_options_c/mrcc__mrcc_num_triplet_roots.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mrcc__mrcc_num_triplet_roots.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mrcc__mrcc_num_triplet_roots.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/mrcc__mrcc_omp_num_threads.html b/sphinxman/master/autodir_options_c/mrcc__mrcc_omp_num_threads.html
index bf396d2d4d5..9d3fbbd569f 100644
--- a/sphinxman/master/autodir_options_c/mrcc__mrcc_omp_num_threads.html
+++ b/sphinxman/master/autodir_options_c/mrcc__mrcc_omp_num_threads.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mrcc__mrcc_omp_num_threads.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mrcc__mrcc_omp_num_threads.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/mrcc__mrcc_restart.html b/sphinxman/master/autodir_options_c/mrcc__mrcc_restart.html
index f404cfd45ea..24e5b4dfe6d 100644
--- a/sphinxman/master/autodir_options_c/mrcc__mrcc_restart.html
+++ b/sphinxman/master/autodir_options_c/mrcc__mrcc_restart.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mrcc__mrcc_restart.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/mrcc__mrcc_restart.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__cachelevel.html b/sphinxman/master/autodir_options_c/occ__cachelevel.html
index b030852be56..bd9f0da1a77 100644
--- a/sphinxman/master/autodir_options_c/occ__cachelevel.html
+++ b/sphinxman/master/autodir_options_c/occ__cachelevel.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__cachelevel.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__cachelevel.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__cc_maxiter.html b/sphinxman/master/autodir_options_c/occ__cc_maxiter.html
index b5dc35635be..61a0645b264 100644
--- a/sphinxman/master/autodir_options_c/occ__cc_maxiter.html
+++ b/sphinxman/master/autodir_options_c/occ__cc_maxiter.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__cc_maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__cc_maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__ccl_energy.html b/sphinxman/master/autodir_options_c/occ__ccl_energy.html
index d8b7ce94ff4..f8b4fe98f58 100644
--- a/sphinxman/master/autodir_options_c/occ__ccl_energy.html
+++ b/sphinxman/master/autodir_options_c/occ__ccl_energy.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__ccl_energy.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__ccl_energy.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__cepa_os_scale.html b/sphinxman/master/autodir_options_c/occ__cepa_os_scale.html
index ab84066fef1..079bfc7dd28 100644
--- a/sphinxman/master/autodir_options_c/occ__cepa_os_scale.html
+++ b/sphinxman/master/autodir_options_c/occ__cepa_os_scale.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__cepa_os_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__cepa_os_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__cepa_sos_scale.html b/sphinxman/master/autodir_options_c/occ__cepa_sos_scale.html
index 9ff48bd49b9..df684d1be26 100644
--- a/sphinxman/master/autodir_options_c/occ__cepa_sos_scale.html
+++ b/sphinxman/master/autodir_options_c/occ__cepa_sos_scale.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__cepa_sos_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__cepa_sos_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__cepa_ss_scale.html b/sphinxman/master/autodir_options_c/occ__cepa_ss_scale.html
index 0541fb6cf63..0c000ca40c3 100644
--- a/sphinxman/master/autodir_options_c/occ__cepa_ss_scale.html
+++ b/sphinxman/master/autodir_options_c/occ__cepa_ss_scale.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__cepa_ss_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__cepa_ss_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__cepa_type.html b/sphinxman/master/autodir_options_c/occ__cepa_type.html
index e200d585ac4..032a4e71680 100644
--- a/sphinxman/master/autodir_options_c/occ__cepa_type.html
+++ b/sphinxman/master/autodir_options_c/occ__cepa_type.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__cepa_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__cepa_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__cutoff.html b/sphinxman/master/autodir_options_c/occ__cutoff.html
index 9f8040d6a16..83bdea69f98 100644
--- a/sphinxman/master/autodir_options_c/occ__cutoff.html
+++ b/sphinxman/master/autodir_options_c/occ__cutoff.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__cutoff.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__cutoff.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__diis_max_vecs.html b/sphinxman/master/autodir_options_c/occ__diis_max_vecs.html
index cb406844680..e19d26aac9e 100644
--- a/sphinxman/master/autodir_options_c/occ__diis_max_vecs.html
+++ b/sphinxman/master/autodir_options_c/occ__diis_max_vecs.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__diis_max_vecs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__diis_max_vecs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__diis_min_vecs.html b/sphinxman/master/autodir_options_c/occ__diis_min_vecs.html
index 02a898673c2..60d20627f4b 100644
--- a/sphinxman/master/autodir_options_c/occ__diis_min_vecs.html
+++ b/sphinxman/master/autodir_options_c/occ__diis_min_vecs.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__diis_min_vecs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__diis_min_vecs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__do_diis.html b/sphinxman/master/autodir_options_c/occ__do_diis.html
index c9bd47fd75c..41788acde9e 100644
--- a/sphinxman/master/autodir_options_c/occ__do_diis.html
+++ b/sphinxman/master/autodir_options_c/occ__do_diis.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__do_diis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__do_diis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__do_level_shift.html b/sphinxman/master/autodir_options_c/occ__do_level_shift.html
index b9660c8fe0e..e6ea6e3eca3 100644
--- a/sphinxman/master/autodir_options_c/occ__do_level_shift.html
+++ b/sphinxman/master/autodir_options_c/occ__do_level_shift.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__do_level_shift.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__do_level_shift.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__do_scs.html b/sphinxman/master/autodir_options_c/occ__do_scs.html
index 68034ef445c..c79344babf8 100644
--- a/sphinxman/master/autodir_options_c/occ__do_scs.html
+++ b/sphinxman/master/autodir_options_c/occ__do_scs.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__do_scs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__do_scs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__do_sos.html b/sphinxman/master/autodir_options_c/occ__do_sos.html
index 19b173d014d..0f96b44bc32 100644
--- a/sphinxman/master/autodir_options_c/occ__do_sos.html
+++ b/sphinxman/master/autodir_options_c/occ__do_sos.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__do_sos.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__do_sos.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__e3_scale.html b/sphinxman/master/autodir_options_c/occ__e3_scale.html
index 172317109bb..0d88c1392ed 100644
--- a/sphinxman/master/autodir_options_c/occ__e3_scale.html
+++ b/sphinxman/master/autodir_options_c/occ__e3_scale.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__e3_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__e3_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__e_convergence.html b/sphinxman/master/autodir_options_c/occ__e_convergence.html
index 238cb453463..58ac8ff86ba 100644
--- a/sphinxman/master/autodir_options_c/occ__e_convergence.html
+++ b/sphinxman/master/autodir_options_c/occ__e_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__e_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__e_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__ea_poles.html b/sphinxman/master/autodir_options_c/occ__ea_poles.html
index fee856c705c..77dec5e77aa 100644
--- a/sphinxman/master/autodir_options_c/occ__ea_poles.html
+++ b/sphinxman/master/autodir_options_c/occ__ea_poles.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__ea_poles.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__ea_poles.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__ekt_ea.html b/sphinxman/master/autodir_options_c/occ__ekt_ea.html
index be8de84d928..98db9860389 100644
--- a/sphinxman/master/autodir_options_c/occ__ekt_ea.html
+++ b/sphinxman/master/autodir_options_c/occ__ekt_ea.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__ekt_ea.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__ekt_ea.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__ekt_ip.html b/sphinxman/master/autodir_options_c/occ__ekt_ip.html
index d2439726c91..d6c18ff93e9 100644
--- a/sphinxman/master/autodir_options_c/occ__ekt_ip.html
+++ b/sphinxman/master/autodir_options_c/occ__ekt_ip.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__ekt_ip.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__ekt_ip.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__ep_ea_poles.html b/sphinxman/master/autodir_options_c/occ__ep_ea_poles.html
index 5245b527459..a45f4b9cd9a 100644
--- a/sphinxman/master/autodir_options_c/occ__ep_ea_poles.html
+++ b/sphinxman/master/autodir_options_c/occ__ep_ea_poles.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__ep_ea_poles.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__ep_ea_poles.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__ep_ip_poles.html b/sphinxman/master/autodir_options_c/occ__ep_ip_poles.html
index 6fc648a2804..5859b9f86ab 100644
--- a/sphinxman/master/autodir_options_c/occ__ep_ip_poles.html
+++ b/sphinxman/master/autodir_options_c/occ__ep_ip_poles.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__ep_ip_poles.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__ep_ip_poles.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__ep_maxiter.html b/sphinxman/master/autodir_options_c/occ__ep_maxiter.html
index 381e069215b..ce1655c928e 100644
--- a/sphinxman/master/autodir_options_c/occ__ep_maxiter.html
+++ b/sphinxman/master/autodir_options_c/occ__ep_maxiter.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__ep_maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__ep_maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__ip_poles.html b/sphinxman/master/autodir_options_c/occ__ip_poles.html
index 77a1e89c331..040fef12e0a 100644
--- a/sphinxman/master/autodir_options_c/occ__ip_poles.html
+++ b/sphinxman/master/autodir_options_c/occ__ip_poles.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__ip_poles.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__ip_poles.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__level_shift.html b/sphinxman/master/autodir_options_c/occ__level_shift.html
index 81481ced84c..41cf9eac889 100644
--- a/sphinxman/master/autodir_options_c/occ__level_shift.html
+++ b/sphinxman/master/autodir_options_c/occ__level_shift.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__level_shift.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__level_shift.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__max_mograd_convergence.html b/sphinxman/master/autodir_options_c/occ__max_mograd_convergence.html
index 4bea449dd74..454eb0e8f4b 100644
--- a/sphinxman/master/autodir_options_c/occ__max_mograd_convergence.html
+++ b/sphinxman/master/autodir_options_c/occ__max_mograd_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__max_mograd_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__max_mograd_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__mo_maxiter.html b/sphinxman/master/autodir_options_c/occ__mo_maxiter.html
index 3e4924ef900..f5b23c44202 100644
--- a/sphinxman/master/autodir_options_c/occ__mo_maxiter.html
+++ b/sphinxman/master/autodir_options_c/occ__mo_maxiter.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__mo_maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__mo_maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__mo_read.html b/sphinxman/master/autodir_options_c/occ__mo_read.html
index 3b5b5e4615c..3fdd8df9f43 100644
--- a/sphinxman/master/autodir_options_c/occ__mo_read.html
+++ b/sphinxman/master/autodir_options_c/occ__mo_read.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__mo_read.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__mo_read.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__mo_step_max.html b/sphinxman/master/autodir_options_c/occ__mo_step_max.html
index e1e45677f12..0a797563f90 100644
--- a/sphinxman/master/autodir_options_c/occ__mo_step_max.html
+++ b/sphinxman/master/autodir_options_c/occ__mo_step_max.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__mo_step_max.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__mo_step_max.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__mo_write.html b/sphinxman/master/autodir_options_c/occ__mo_write.html
index f2dbd85019f..1adbab6a9ce 100644
--- a/sphinxman/master/autodir_options_c/occ__mo_write.html
+++ b/sphinxman/master/autodir_options_c/occ__mo_write.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__mo_write.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__mo_write.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__mograd_damping.html b/sphinxman/master/autodir_options_c/occ__mograd_damping.html
index c2ecd751c2b..36352f55c49 100644
--- a/sphinxman/master/autodir_options_c/occ__mograd_damping.html
+++ b/sphinxman/master/autodir_options_c/occ__mograd_damping.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__mograd_damping.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__mograd_damping.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__mp2_os_scale.html b/sphinxman/master/autodir_options_c/occ__mp2_os_scale.html
index 001f00d0c96..1d5be093470 100644
--- a/sphinxman/master/autodir_options_c/occ__mp2_os_scale.html
+++ b/sphinxman/master/autodir_options_c/occ__mp2_os_scale.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__mp2_os_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__mp2_os_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__mp2_sos_scale.html b/sphinxman/master/autodir_options_c/occ__mp2_sos_scale.html
index f51cd144173..db3e28fd5ee 100644
--- a/sphinxman/master/autodir_options_c/occ__mp2_sos_scale.html
+++ b/sphinxman/master/autodir_options_c/occ__mp2_sos_scale.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__mp2_sos_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__mp2_sos_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__mp2_sos_scale2.html b/sphinxman/master/autodir_options_c/occ__mp2_sos_scale2.html
index 0267d7a99fa..0bf95c37ca3 100644
--- a/sphinxman/master/autodir_options_c/occ__mp2_sos_scale2.html
+++ b/sphinxman/master/autodir_options_c/occ__mp2_sos_scale2.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__mp2_sos_scale2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__mp2_sos_scale2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__mp2_ss_scale.html b/sphinxman/master/autodir_options_c/occ__mp2_ss_scale.html
index dec400ba569..70401c1fac7 100644
--- a/sphinxman/master/autodir_options_c/occ__mp2_ss_scale.html
+++ b/sphinxman/master/autodir_options_c/occ__mp2_ss_scale.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__mp2_ss_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__mp2_ss_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__nat_orbs.html b/sphinxman/master/autodir_options_c/occ__nat_orbs.html
index 876d8c41592..e7f16ab5d2f 100644
--- a/sphinxman/master/autodir_options_c/occ__nat_orbs.html
+++ b/sphinxman/master/autodir_options_c/occ__nat_orbs.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__nat_orbs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__nat_orbs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__occ_orbs_print.html b/sphinxman/master/autodir_options_c/occ__occ_orbs_print.html
index f666748f26d..f2b7c048313 100644
--- a/sphinxman/master/autodir_options_c/occ__occ_orbs_print.html
+++ b/sphinxman/master/autodir_options_c/occ__occ_orbs_print.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__occ_orbs_print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__occ_orbs_print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__oeprop.html b/sphinxman/master/autodir_options_c/occ__oeprop.html
index 0453399e655..b54010fd483 100644
--- a/sphinxman/master/autodir_options_c/occ__oeprop.html
+++ b/sphinxman/master/autodir_options_c/occ__oeprop.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__oeprop.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__oeprop.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__opt_method.html b/sphinxman/master/autodir_options_c/occ__opt_method.html
index 5036352f1b4..b4a8f021c7d 100644
--- a/sphinxman/master/autodir_options_c/occ__opt_method.html
+++ b/sphinxman/master/autodir_options_c/occ__opt_method.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__opt_method.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__opt_method.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__orb_opt.html b/sphinxman/master/autodir_options_c/occ__orb_opt.html
index 7140bc32735..4341681ac89 100644
--- a/sphinxman/master/autodir_options_c/occ__orb_opt.html
+++ b/sphinxman/master/autodir_options_c/occ__orb_opt.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__orb_opt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__orb_opt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__orb_resp_solver.html b/sphinxman/master/autodir_options_c/occ__orb_resp_solver.html
index 60166351930..3f0e9041b03 100644
--- a/sphinxman/master/autodir_options_c/occ__orb_resp_solver.html
+++ b/sphinxman/master/autodir_options_c/occ__orb_resp_solver.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__orb_resp_solver.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__orb_resp_solver.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__orth_type.html b/sphinxman/master/autodir_options_c/occ__orth_type.html
index ade03ab301e..2e7c52dba5c 100644
--- a/sphinxman/master/autodir_options_c/occ__orth_type.html
+++ b/sphinxman/master/autodir_options_c/occ__orth_type.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__orth_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__orth_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__os_scale.html b/sphinxman/master/autodir_options_c/occ__os_scale.html
index dacfac35f31..5e657731aeb 100644
--- a/sphinxman/master/autodir_options_c/occ__os_scale.html
+++ b/sphinxman/master/autodir_options_c/occ__os_scale.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__os_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__os_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__pcg_beta_type.html b/sphinxman/master/autodir_options_c/occ__pcg_beta_type.html
index 3b8ec0df038..fc5ecf231f1 100644
--- a/sphinxman/master/autodir_options_c/occ__pcg_beta_type.html
+++ b/sphinxman/master/autodir_options_c/occ__pcg_beta_type.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__pcg_beta_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__pcg_beta_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__pcg_convergence.html b/sphinxman/master/autodir_options_c/occ__pcg_convergence.html
index 8081801db17..c24335c8ae2 100644
--- a/sphinxman/master/autodir_options_c/occ__pcg_convergence.html
+++ b/sphinxman/master/autodir_options_c/occ__pcg_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__pcg_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__pcg_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__pcg_maxiter.html b/sphinxman/master/autodir_options_c/occ__pcg_maxiter.html
index e837467355e..4432153c033 100644
--- a/sphinxman/master/autodir_options_c/occ__pcg_maxiter.html
+++ b/sphinxman/master/autodir_options_c/occ__pcg_maxiter.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__pcg_maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__pcg_maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__r_convergence.html b/sphinxman/master/autodir_options_c/occ__r_convergence.html
index 4f15385345a..a481855a89c 100644
--- a/sphinxman/master/autodir_options_c/occ__r_convergence.html
+++ b/sphinxman/master/autodir_options_c/occ__r_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__r_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__r_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__relaxed.html b/sphinxman/master/autodir_options_c/occ__relaxed.html
index 402c4d112fe..054f70f707d 100644
--- a/sphinxman/master/autodir_options_c/occ__relaxed.html
+++ b/sphinxman/master/autodir_options_c/occ__relaxed.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__relaxed.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__relaxed.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__remp_a.html b/sphinxman/master/autodir_options_c/occ__remp_a.html
index 7202b399430..47ac933d179 100644
--- a/sphinxman/master/autodir_options_c/occ__remp_a.html
+++ b/sphinxman/master/autodir_options_c/occ__remp_a.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__remp_a.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__remp_a.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__rms_mograd_convergence.html b/sphinxman/master/autodir_options_c/occ__rms_mograd_convergence.html
index c0d5d690eed..f60c481725f 100644
--- a/sphinxman/master/autodir_options_c/occ__rms_mograd_convergence.html
+++ b/sphinxman/master/autodir_options_c/occ__rms_mograd_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__rms_mograd_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__rms_mograd_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__scs_type.html b/sphinxman/master/autodir_options_c/occ__scs_type.html
index 69a27c70584..f911b4941a8 100644
--- a/sphinxman/master/autodir_options_c/occ__scs_type.html
+++ b/sphinxman/master/autodir_options_c/occ__scs_type.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__scs_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__scs_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__sos_type.html b/sphinxman/master/autodir_options_c/occ__sos_type.html
index 1d17bb13805..5e6feee3154 100644
--- a/sphinxman/master/autodir_options_c/occ__sos_type.html
+++ b/sphinxman/master/autodir_options_c/occ__sos_type.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__sos_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__sos_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__spin_scale_type.html b/sphinxman/master/autodir_options_c/occ__spin_scale_type.html
index c23a9a4cd2a..b2793ccfd94 100644
--- a/sphinxman/master/autodir_options_c/occ__spin_scale_type.html
+++ b/sphinxman/master/autodir_options_c/occ__spin_scale_type.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__spin_scale_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__spin_scale_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__ss_scale.html b/sphinxman/master/autodir_options_c/occ__ss_scale.html
index 35e9c7fe637..e1c606b6f7b 100644
--- a/sphinxman/master/autodir_options_c/occ__ss_scale.html
+++ b/sphinxman/master/autodir_options_c/occ__ss_scale.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__ss_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__ss_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__symmetrize.html b/sphinxman/master/autodir_options_c/occ__symmetrize.html
index 0f931a0b974..c2ded9fd5dc 100644
--- a/sphinxman/master/autodir_options_c/occ__symmetrize.html
+++ b/sphinxman/master/autodir_options_c/occ__symmetrize.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__symmetrize.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__symmetrize.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__tpdm_abcd_type.html b/sphinxman/master/autodir_options_c/occ__tpdm_abcd_type.html
index 29678363497..6b60ea33a9a 100644
--- a/sphinxman/master/autodir_options_c/occ__tpdm_abcd_type.html
+++ b/sphinxman/master/autodir_options_c/occ__tpdm_abcd_type.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__tpdm_abcd_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__tpdm_abcd_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/occ__wfn_type.html b/sphinxman/master/autodir_options_c/occ__wfn_type.html
index 9d5c055fdf8..ca19127fa93 100644
--- a/sphinxman/master/autodir_options_c/occ__wfn_type.html
+++ b/sphinxman/master/autodir_options_c/occ__wfn_type.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__wfn_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/occ__wfn_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__add_auxiliary_bonds.html b/sphinxman/master/autodir_options_c/optking__add_auxiliary_bonds.html
index 1d7b1d40cf4..6b7f07b31e3 100644
--- a/sphinxman/master/autodir_options_c/optking__add_auxiliary_bonds.html
+++ b/sphinxman/master/autodir_options_c/optking__add_auxiliary_bonds.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__add_auxiliary_bonds.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__add_auxiliary_bonds.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__auxiliary_bond_factor.html b/sphinxman/master/autodir_options_c/optking__auxiliary_bond_factor.html
index 8b9ae6f64af..1be25ba5986 100644
--- a/sphinxman/master/autodir_options_c/optking__auxiliary_bond_factor.html
+++ b/sphinxman/master/autodir_options_c/optking__auxiliary_bond_factor.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__auxiliary_bond_factor.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__auxiliary_bond_factor.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__cart_hess_read.html b/sphinxman/master/autodir_options_c/optking__cart_hess_read.html
index 4e499e655d2..ffa3e81321d 100644
--- a/sphinxman/master/autodir_options_c/optking__cart_hess_read.html
+++ b/sphinxman/master/autodir_options_c/optking__cart_hess_read.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__cart_hess_read.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__cart_hess_read.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__cartesian_sym_tolerance.html b/sphinxman/master/autodir_options_c/optking__cartesian_sym_tolerance.html
index ef0df1aa378..da79329ebd9 100644
--- a/sphinxman/master/autodir_options_c/optking__cartesian_sym_tolerance.html
+++ b/sphinxman/master/autodir_options_c/optking__cartesian_sym_tolerance.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__cartesian_sym_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__cartesian_sym_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__consecutive_backsteps.html b/sphinxman/master/autodir_options_c/optking__consecutive_backsteps.html
index ea1e1ee8a49..01f668dbb6e 100644
--- a/sphinxman/master/autodir_options_c/optking__consecutive_backsteps.html
+++ b/sphinxman/master/autodir_options_c/optking__consecutive_backsteps.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__consecutive_backsteps.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__consecutive_backsteps.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__covalent_connect.html b/sphinxman/master/autodir_options_c/optking__covalent_connect.html
index 821d0bbdd9c..019183f757c 100644
--- a/sphinxman/master/autodir_options_c/optking__covalent_connect.html
+++ b/sphinxman/master/autodir_options_c/optking__covalent_connect.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__covalent_connect.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__covalent_connect.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__custom_coords.html b/sphinxman/master/autodir_options_c/optking__custom_coords.html
index ecc2e9e4ba4..9eae3d67be7 100644
--- a/sphinxman/master/autodir_options_c/optking__custom_coords.html
+++ b/sphinxman/master/autodir_options_c/optking__custom_coords.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__custom_coords.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__custom_coords.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__dynamic_level.html b/sphinxman/master/autodir_options_c/optking__dynamic_level.html
index 70411288951..b401c77309f 100644
--- a/sphinxman/master/autodir_options_c/optking__dynamic_level.html
+++ b/sphinxman/master/autodir_options_c/optking__dynamic_level.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__dynamic_level.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__dynamic_level.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__ensure_bt_convergence.html b/sphinxman/master/autodir_options_c/optking__ensure_bt_convergence.html
index b98314f0300..abbcece79dc 100644
--- a/sphinxman/master/autodir_options_c/optking__ensure_bt_convergence.html
+++ b/sphinxman/master/autodir_options_c/optking__ensure_bt_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__ensure_bt_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__ensure_bt_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__ext_force_bend.html b/sphinxman/master/autodir_options_c/optking__ext_force_bend.html
index 6344845b212..1d774626413 100644
--- a/sphinxman/master/autodir_options_c/optking__ext_force_bend.html
+++ b/sphinxman/master/autodir_options_c/optking__ext_force_bend.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__ext_force_bend.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__ext_force_bend.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__ext_force_cartesian.html b/sphinxman/master/autodir_options_c/optking__ext_force_cartesian.html
index db50b06a60c..3acb2ef9b09 100644
--- a/sphinxman/master/autodir_options_c/optking__ext_force_cartesian.html
+++ b/sphinxman/master/autodir_options_c/optking__ext_force_cartesian.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__ext_force_cartesian.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__ext_force_cartesian.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__ext_force_dihedral.html b/sphinxman/master/autodir_options_c/optking__ext_force_dihedral.html
index abec8dcd4e0..50a65ea202e 100644
--- a/sphinxman/master/autodir_options_c/optking__ext_force_dihedral.html
+++ b/sphinxman/master/autodir_options_c/optking__ext_force_dihedral.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__ext_force_dihedral.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__ext_force_dihedral.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__ext_force_distance.html b/sphinxman/master/autodir_options_c/optking__ext_force_distance.html
index 287d38a2306..e25b7ca6237 100644
--- a/sphinxman/master/autodir_options_c/optking__ext_force_distance.html
+++ b/sphinxman/master/autodir_options_c/optking__ext_force_distance.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__ext_force_distance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__ext_force_distance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__ext_force_oofp.html b/sphinxman/master/autodir_options_c/optking__ext_force_oofp.html
index babd0122f86..ce69993afab 100644
--- a/sphinxman/master/autodir_options_c/optking__ext_force_oofp.html
+++ b/sphinxman/master/autodir_options_c/optking__ext_force_oofp.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__ext_force_oofp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__ext_force_oofp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__flexible_g_convergence.html b/sphinxman/master/autodir_options_c/optking__flexible_g_convergence.html
index 678a69676f8..ea9c7b0096c 100644
--- a/sphinxman/master/autodir_options_c/optking__flexible_g_convergence.html
+++ b/sphinxman/master/autodir_options_c/optking__flexible_g_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__flexible_g_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__flexible_g_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__frag_mode.html b/sphinxman/master/autodir_options_c/optking__frag_mode.html
index b528c8ac7df..bd39e77521b 100644
--- a/sphinxman/master/autodir_options_c/optking__frag_mode.html
+++ b/sphinxman/master/autodir_options_c/optking__frag_mode.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__frag_mode.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__frag_mode.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__frag_ref_atoms.html b/sphinxman/master/autodir_options_c/optking__frag_ref_atoms.html
index 434b0ce0131..67191275fbd 100644
--- a/sphinxman/master/autodir_options_c/optking__frag_ref_atoms.html
+++ b/sphinxman/master/autodir_options_c/optking__frag_ref_atoms.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__frag_ref_atoms.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__frag_ref_atoms.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__freeze_all_dihedrals.html b/sphinxman/master/autodir_options_c/optking__freeze_all_dihedrals.html
index 541810f9ace..8694682721c 100644
--- a/sphinxman/master/autodir_options_c/optking__freeze_all_dihedrals.html
+++ b/sphinxman/master/autodir_options_c/optking__freeze_all_dihedrals.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__freeze_all_dihedrals.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__freeze_all_dihedrals.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__freeze_interfrag.html b/sphinxman/master/autodir_options_c/optking__freeze_interfrag.html
index 72893680ce0..c3badee8291 100644
--- a/sphinxman/master/autodir_options_c/optking__freeze_interfrag.html
+++ b/sphinxman/master/autodir_options_c/optking__freeze_interfrag.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__freeze_interfrag.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__freeze_interfrag.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__freeze_intrafrag.html b/sphinxman/master/autodir_options_c/optking__freeze_intrafrag.html
index 4a16d4207e2..c56e99612ba 100644
--- a/sphinxman/master/autodir_options_c/optking__freeze_intrafrag.html
+++ b/sphinxman/master/autodir_options_c/optking__freeze_intrafrag.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__freeze_intrafrag.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__freeze_intrafrag.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__frozen_bend.html b/sphinxman/master/autodir_options_c/optking__frozen_bend.html
index 4b548412449..3162014431e 100644
--- a/sphinxman/master/autodir_options_c/optking__frozen_bend.html
+++ b/sphinxman/master/autodir_options_c/optking__frozen_bend.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__frozen_bend.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__frozen_bend.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__frozen_cartesian.html b/sphinxman/master/autodir_options_c/optking__frozen_cartesian.html
index 25cb71512d3..dde8f92f7e2 100644
--- a/sphinxman/master/autodir_options_c/optking__frozen_cartesian.html
+++ b/sphinxman/master/autodir_options_c/optking__frozen_cartesian.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__frozen_cartesian.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__frozen_cartesian.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__frozen_dihedral.html b/sphinxman/master/autodir_options_c/optking__frozen_dihedral.html
index 1bce6b5ad68..10a4127cbef 100644
--- a/sphinxman/master/autodir_options_c/optking__frozen_dihedral.html
+++ b/sphinxman/master/autodir_options_c/optking__frozen_dihedral.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__frozen_dihedral.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__frozen_dihedral.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__frozen_distance.html b/sphinxman/master/autodir_options_c/optking__frozen_distance.html
index 8ce3923dc77..473869194f9 100644
--- a/sphinxman/master/autodir_options_c/optking__frozen_distance.html
+++ b/sphinxman/master/autodir_options_c/optking__frozen_distance.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__frozen_distance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__frozen_distance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__frozen_oofp.html b/sphinxman/master/autodir_options_c/optking__frozen_oofp.html
index 48a1c894a51..a893302d5e0 100644
--- a/sphinxman/master/autodir_options_c/optking__frozen_oofp.html
+++ b/sphinxman/master/autodir_options_c/optking__frozen_oofp.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__frozen_oofp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__frozen_oofp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__full_hess_every.html b/sphinxman/master/autodir_options_c/optking__full_hess_every.html
index 329d7e4bbb6..5225becfeeb 100644
--- a/sphinxman/master/autodir_options_c/optking__full_hess_every.html
+++ b/sphinxman/master/autodir_options_c/optking__full_hess_every.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__full_hess_every.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__full_hess_every.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__g_convergence.html b/sphinxman/master/autodir_options_c/optking__g_convergence.html
index 77a80c3d24d..a731c5903bf 100644
--- a/sphinxman/master/autodir_options_c/optking__g_convergence.html
+++ b/sphinxman/master/autodir_options_c/optking__g_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__g_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__g_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__geom_maxiter.html b/sphinxman/master/autodir_options_c/optking__geom_maxiter.html
index 1dd66e2402d..69b43e4de6f 100644
--- a/sphinxman/master/autodir_options_c/optking__geom_maxiter.html
+++ b/sphinxman/master/autodir_options_c/optking__geom_maxiter.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__geom_maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__geom_maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__h_bond_connect.html b/sphinxman/master/autodir_options_c/optking__h_bond_connect.html
index 654e7dab8f8..1cab90459c6 100644
--- a/sphinxman/master/autodir_options_c/optking__h_bond_connect.html
+++ b/sphinxman/master/autodir_options_c/optking__h_bond_connect.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__h_bond_connect.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__h_bond_connect.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__h_guess_every.html b/sphinxman/master/autodir_options_c/optking__h_guess_every.html
index a0a6cb292b5..19b4d264619 100644
--- a/sphinxman/master/autodir_options_c/optking__h_guess_every.html
+++ b/sphinxman/master/autodir_options_c/optking__h_guess_every.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__h_guess_every.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__h_guess_every.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__h_update_den_tol.html b/sphinxman/master/autodir_options_c/optking__h_update_den_tol.html
index 30771cc9557..64315c802be 100644
--- a/sphinxman/master/autodir_options_c/optking__h_update_den_tol.html
+++ b/sphinxman/master/autodir_options_c/optking__h_update_den_tol.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__h_update_den_tol.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__h_update_den_tol.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__hess_update.html b/sphinxman/master/autodir_options_c/optking__hess_update.html
index c5a8a0f9f35..8454633c9ed 100644
--- a/sphinxman/master/autodir_options_c/optking__hess_update.html
+++ b/sphinxman/master/autodir_options_c/optking__hess_update.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__hess_update.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__hess_update.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__hess_update_limit.html b/sphinxman/master/autodir_options_c/optking__hess_update_limit.html
index c4506f492fb..09df63d21ea 100644
--- a/sphinxman/master/autodir_options_c/optking__hess_update_limit.html
+++ b/sphinxman/master/autodir_options_c/optking__hess_update_limit.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__hess_update_limit.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__hess_update_limit.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__hess_update_limit_max.html b/sphinxman/master/autodir_options_c/optking__hess_update_limit_max.html
index 13fcb633b47..40cc88a53b1 100644
--- a/sphinxman/master/autodir_options_c/optking__hess_update_limit_max.html
+++ b/sphinxman/master/autodir_options_c/optking__hess_update_limit_max.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__hess_update_limit_max.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__hess_update_limit_max.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__hess_update_limit_scale.html b/sphinxman/master/autodir_options_c/optking__hess_update_limit_scale.html
index cf84649896f..1f28712abae 100644
--- a/sphinxman/master/autodir_options_c/optking__hess_update_limit_scale.html
+++ b/sphinxman/master/autodir_options_c/optking__hess_update_limit_scale.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__hess_update_limit_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__hess_update_limit_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__hess_update_use_last.html b/sphinxman/master/autodir_options_c/optking__hess_update_use_last.html
index b0479d0d05b..fa8e218be68 100644
--- a/sphinxman/master/autodir_options_c/optking__hess_update_use_last.html
+++ b/sphinxman/master/autodir_options_c/optking__hess_update_use_last.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__hess_update_use_last.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__hess_update_use_last.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__intcos_generate_exit.html b/sphinxman/master/autodir_options_c/optking__intcos_generate_exit.html
index 1002f2b1643..9fbd85fe773 100644
--- a/sphinxman/master/autodir_options_c/optking__intcos_generate_exit.html
+++ b/sphinxman/master/autodir_options_c/optking__intcos_generate_exit.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__intcos_generate_exit.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__intcos_generate_exit.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__interfrag_collinear_tol.html b/sphinxman/master/autodir_options_c/optking__interfrag_collinear_tol.html
index 7fe05389160..a6123af514d 100644
--- a/sphinxman/master/autodir_options_c/optking__interfrag_collinear_tol.html
+++ b/sphinxman/master/autodir_options_c/optking__interfrag_collinear_tol.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__interfrag_collinear_tol.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__interfrag_collinear_tol.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__interfrag_coords.html b/sphinxman/master/autodir_options_c/optking__interfrag_coords.html
index c76bd03bc1d..507b9ef0148 100644
--- a/sphinxman/master/autodir_options_c/optking__interfrag_coords.html
+++ b/sphinxman/master/autodir_options_c/optking__interfrag_coords.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__interfrag_coords.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__interfrag_coords.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__interfrag_dist_inv.html b/sphinxman/master/autodir_options_c/optking__interfrag_dist_inv.html
index 097a960f14d..e0c86779fe7 100644
--- a/sphinxman/master/autodir_options_c/optking__interfrag_dist_inv.html
+++ b/sphinxman/master/autodir_options_c/optking__interfrag_dist_inv.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__interfrag_dist_inv.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__interfrag_dist_inv.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__interfrag_hess.html b/sphinxman/master/autodir_options_c/optking__interfrag_hess.html
index 73b0e2abd03..e1345ed763f 100644
--- a/sphinxman/master/autodir_options_c/optking__interfrag_hess.html
+++ b/sphinxman/master/autodir_options_c/optking__interfrag_hess.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__interfrag_hess.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__interfrag_hess.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__interfrag_mode.html b/sphinxman/master/autodir_options_c/optking__interfrag_mode.html
index 076d4ea7fae..6c3fd5b6bc4 100644
--- a/sphinxman/master/autodir_options_c/optking__interfrag_mode.html
+++ b/sphinxman/master/autodir_options_c/optking__interfrag_mode.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__interfrag_mode.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__interfrag_mode.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__interfrag_step_limit.html b/sphinxman/master/autodir_options_c/optking__interfrag_step_limit.html
index 1421d97766c..f52c434b380 100644
--- a/sphinxman/master/autodir_options_c/optking__interfrag_step_limit.html
+++ b/sphinxman/master/autodir_options_c/optking__interfrag_step_limit.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__interfrag_step_limit.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__interfrag_step_limit.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__interfragment_connect.html b/sphinxman/master/autodir_options_c/optking__interfragment_connect.html
index 02cf0ceeb67..26171d1f5ca 100644
--- a/sphinxman/master/autodir_options_c/optking__interfragment_connect.html
+++ b/sphinxman/master/autodir_options_c/optking__interfragment_connect.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__interfragment_connect.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__interfragment_connect.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__intrafrag_hess.html b/sphinxman/master/autodir_options_c/optking__intrafrag_hess.html
index 9c1eacffeaf..93ffe11c5bc 100644
--- a/sphinxman/master/autodir_options_c/optking__intrafrag_hess.html
+++ b/sphinxman/master/autodir_options_c/optking__intrafrag_hess.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__intrafrag_hess.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__intrafrag_hess.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__intrafrag_step_limit.html b/sphinxman/master/autodir_options_c/optking__intrafrag_step_limit.html
index bac3002ab74..c6bdcfc3f9f 100644
--- a/sphinxman/master/autodir_options_c/optking__intrafrag_step_limit.html
+++ b/sphinxman/master/autodir_options_c/optking__intrafrag_step_limit.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__intrafrag_step_limit.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__intrafrag_step_limit.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__intrafrag_step_limit_max.html b/sphinxman/master/autodir_options_c/optking__intrafrag_step_limit_max.html
index ac43038145e..7b0784e7b1e 100644
--- a/sphinxman/master/autodir_options_c/optking__intrafrag_step_limit_max.html
+++ b/sphinxman/master/autodir_options_c/optking__intrafrag_step_limit_max.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__intrafrag_step_limit_max.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__intrafrag_step_limit_max.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__intrafrag_step_limit_min.html b/sphinxman/master/autodir_options_c/optking__intrafrag_step_limit_min.html
index 93a9eb5242e..82012f50c94 100644
--- a/sphinxman/master/autodir_options_c/optking__intrafrag_step_limit_min.html
+++ b/sphinxman/master/autodir_options_c/optking__intrafrag_step_limit_min.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__intrafrag_step_limit_min.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__intrafrag_step_limit_min.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__irc_direction.html b/sphinxman/master/autodir_options_c/optking__irc_direction.html
index 71c6445c7c5..f2906d22ed7 100644
--- a/sphinxman/master/autodir_options_c/optking__irc_direction.html
+++ b/sphinxman/master/autodir_options_c/optking__irc_direction.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__irc_direction.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__irc_direction.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__irc_points.html b/sphinxman/master/autodir_options_c/optking__irc_points.html
index e78ec208fcc..f7c7a5d667b 100644
--- a/sphinxman/master/autodir_options_c/optking__irc_points.html
+++ b/sphinxman/master/autodir_options_c/optking__irc_points.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__irc_points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__irc_points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__irc_step_size.html b/sphinxman/master/autodir_options_c/optking__irc_step_size.html
index 7c28771c78c..feaa2df61db 100644
--- a/sphinxman/master/autodir_options_c/optking__irc_step_size.html
+++ b/sphinxman/master/autodir_options_c/optking__irc_step_size.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__irc_step_size.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__irc_step_size.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__max_disp_g_convergence.html b/sphinxman/master/autodir_options_c/optking__max_disp_g_convergence.html
index a67e2ed7ae7..6d331082c52 100644
--- a/sphinxman/master/autodir_options_c/optking__max_disp_g_convergence.html
+++ b/sphinxman/master/autodir_options_c/optking__max_disp_g_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__max_disp_g_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__max_disp_g_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__max_energy_g_convergence.html b/sphinxman/master/autodir_options_c/optking__max_energy_g_convergence.html
index b27ef7dba49..9b718c20a06 100644
--- a/sphinxman/master/autodir_options_c/optking__max_energy_g_convergence.html
+++ b/sphinxman/master/autodir_options_c/optking__max_energy_g_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__max_energy_g_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__max_energy_g_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__max_force_g_convergence.html b/sphinxman/master/autodir_options_c/optking__max_force_g_convergence.html
index 1eac97f8cde..12235c88df9 100644
--- a/sphinxman/master/autodir_options_c/optking__max_force_g_convergence.html
+++ b/sphinxman/master/autodir_options_c/optking__max_force_g_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__max_force_g_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__max_force_g_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__opt_coordinates.html b/sphinxman/master/autodir_options_c/optking__opt_coordinates.html
index 3a4caa1be17..be89341d7cf 100644
--- a/sphinxman/master/autodir_options_c/optking__opt_coordinates.html
+++ b/sphinxman/master/autodir_options_c/optking__opt_coordinates.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__opt_coordinates.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__opt_coordinates.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__opt_restart.html b/sphinxman/master/autodir_options_c/optking__opt_restart.html
index 71ba8bad45f..b1da1a64916 100644
--- a/sphinxman/master/autodir_options_c/optking__opt_restart.html
+++ b/sphinxman/master/autodir_options_c/optking__opt_restart.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__opt_restart.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__opt_restart.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__opt_type.html b/sphinxman/master/autodir_options_c/optking__opt_type.html
index ebe3c5eeec7..2775c852ecb 100644
--- a/sphinxman/master/autodir_options_c/optking__opt_type.html
+++ b/sphinxman/master/autodir_options_c/optking__opt_type.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__opt_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__opt_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__print_opt_params.html b/sphinxman/master/autodir_options_c/optking__print_opt_params.html
index 2894fe3334f..54cdb499f54 100644
--- a/sphinxman/master/autodir_options_c/optking__print_opt_params.html
+++ b/sphinxman/master/autodir_options_c/optking__print_opt_params.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__print_opt_params.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__print_opt_params.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__print_trajectory_xyz_file.html b/sphinxman/master/autodir_options_c/optking__print_trajectory_xyz_file.html
index b6826a6a346..300ddfc87bc 100644
--- a/sphinxman/master/autodir_options_c/optking__print_trajectory_xyz_file.html
+++ b/sphinxman/master/autodir_options_c/optking__print_trajectory_xyz_file.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__print_trajectory_xyz_file.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__print_trajectory_xyz_file.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__ranged_bend.html b/sphinxman/master/autodir_options_c/optking__ranged_bend.html
index 8e330e3a6b4..f80aa2fde0b 100644
--- a/sphinxman/master/autodir_options_c/optking__ranged_bend.html
+++ b/sphinxman/master/autodir_options_c/optking__ranged_bend.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__ranged_bend.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__ranged_bend.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__ranged_dihedral.html b/sphinxman/master/autodir_options_c/optking__ranged_dihedral.html
index 3884ef89f57..8e99c7a581c 100644
--- a/sphinxman/master/autodir_options_c/optking__ranged_dihedral.html
+++ b/sphinxman/master/autodir_options_c/optking__ranged_dihedral.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__ranged_dihedral.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__ranged_dihedral.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__ranged_distance.html b/sphinxman/master/autodir_options_c/optking__ranged_distance.html
index 3a09957c407..99df6408b7e 100644
--- a/sphinxman/master/autodir_options_c/optking__ranged_distance.html
+++ b/sphinxman/master/autodir_options_c/optking__ranged_distance.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__ranged_distance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__ranged_distance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__ranged_oofp.html b/sphinxman/master/autodir_options_c/optking__ranged_oofp.html
index 9babf42526b..8021a54d703 100644
--- a/sphinxman/master/autodir_options_c/optking__ranged_oofp.html
+++ b/sphinxman/master/autodir_options_c/optking__ranged_oofp.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__ranged_oofp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__ranged_oofp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__rfo_follow_root.html b/sphinxman/master/autodir_options_c/optking__rfo_follow_root.html
index 27f45cd64ee..8e082b04bb5 100644
--- a/sphinxman/master/autodir_options_c/optking__rfo_follow_root.html
+++ b/sphinxman/master/autodir_options_c/optking__rfo_follow_root.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__rfo_follow_root.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__rfo_follow_root.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__rfo_normalization_max.html b/sphinxman/master/autodir_options_c/optking__rfo_normalization_max.html
index 01bce92e334..68e03013bd6 100644
--- a/sphinxman/master/autodir_options_c/optking__rfo_normalization_max.html
+++ b/sphinxman/master/autodir_options_c/optking__rfo_normalization_max.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__rfo_normalization_max.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__rfo_normalization_max.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__rfo_root.html b/sphinxman/master/autodir_options_c/optking__rfo_root.html
index 633e8cfe592..63a03a53560 100644
--- a/sphinxman/master/autodir_options_c/optking__rfo_root.html
+++ b/sphinxman/master/autodir_options_c/optking__rfo_root.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__rfo_root.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__rfo_root.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__rms_disp_g_convergence.html b/sphinxman/master/autodir_options_c/optking__rms_disp_g_convergence.html
index dd52ec87dee..2153828bf94 100644
--- a/sphinxman/master/autodir_options_c/optking__rms_disp_g_convergence.html
+++ b/sphinxman/master/autodir_options_c/optking__rms_disp_g_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__rms_disp_g_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__rms_disp_g_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__rms_force_g_convergence.html b/sphinxman/master/autodir_options_c/optking__rms_force_g_convergence.html
index 9b6e7187652..12ea95dc6ac 100644
--- a/sphinxman/master/autodir_options_c/optking__rms_force_g_convergence.html
+++ b/sphinxman/master/autodir_options_c/optking__rms_force_g_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__rms_force_g_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__rms_force_g_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__rsrfo_alpha_max.html b/sphinxman/master/autodir_options_c/optking__rsrfo_alpha_max.html
index ac6fbcf0b0c..112a894b90c 100644
--- a/sphinxman/master/autodir_options_c/optking__rsrfo_alpha_max.html
+++ b/sphinxman/master/autodir_options_c/optking__rsrfo_alpha_max.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__rsrfo_alpha_max.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__rsrfo_alpha_max.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__save_optimization.html b/sphinxman/master/autodir_options_c/optking__save_optimization.html
index e2ecd8817d4..110248a7976 100644
--- a/sphinxman/master/autodir_options_c/optking__save_optimization.html
+++ b/sphinxman/master/autodir_options_c/optking__save_optimization.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__save_optimization.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__save_optimization.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__step_type.html b/sphinxman/master/autodir_options_c/optking__step_type.html
index 2fc8c2c5d06..baedba3d617 100644
--- a/sphinxman/master/autodir_options_c/optking__step_type.html
+++ b/sphinxman/master/autodir_options_c/optking__step_type.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__step_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__step_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__test_b.html b/sphinxman/master/autodir_options_c/optking__test_b.html
index c49b203b787..18a0a40998d 100644
--- a/sphinxman/master/autodir_options_c/optking__test_b.html
+++ b/sphinxman/master/autodir_options_c/optking__test_b.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__test_b.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__test_b.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__test_derivative_b.html b/sphinxman/master/autodir_options_c/optking__test_derivative_b.html
index 48c56c9baed..4b4dd0cfc29 100644
--- a/sphinxman/master/autodir_options_c/optking__test_derivative_b.html
+++ b/sphinxman/master/autodir_options_c/optking__test_derivative_b.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__test_derivative_b.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__test_derivative_b.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__unfreeze_dihedrals.html b/sphinxman/master/autodir_options_c/optking__unfreeze_dihedrals.html
index 24fa34604ef..03cb6c9c35d 100644
--- a/sphinxman/master/autodir_options_c/optking__unfreeze_dihedrals.html
+++ b/sphinxman/master/autodir_options_c/optking__unfreeze_dihedrals.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__unfreeze_dihedrals.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__unfreeze_dihedrals.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__write_opt_history.html b/sphinxman/master/autodir_options_c/optking__write_opt_history.html
index 297f47748a3..7c564ce33c9 100644
--- a/sphinxman/master/autodir_options_c/optking__write_opt_history.html
+++ b/sphinxman/master/autodir_options_c/optking__write_opt_history.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__write_opt_history.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__write_opt_history.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__write_opt_result.html b/sphinxman/master/autodir_options_c/optking__write_opt_result.html
index 4b8b62ac026..e54a64ed908 100644
--- a/sphinxman/master/autodir_options_c/optking__write_opt_result.html
+++ b/sphinxman/master/autodir_options_c/optking__write_opt_result.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__write_opt_result.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__write_opt_result.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/optking__write_trajectory.html b/sphinxman/master/autodir_options_c/optking__write_trajectory.html
index dc4c3cbd315..5c2b72310e2 100644
--- a/sphinxman/master/autodir_options_c/optking__write_trajectory.html
+++ b/sphinxman/master/autodir_options_c/optking__write_trajectory.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__write_trajectory.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/optking__write_trajectory.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/pcm__pcm_cc_type.html b/sphinxman/master/autodir_options_c/pcm__pcm_cc_type.html
index 6433a23bf07..1a965aeb1fc 100644
--- a/sphinxman/master/autodir_options_c/pcm__pcm_cc_type.html
+++ b/sphinxman/master/autodir_options_c/pcm__pcm_cc_type.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/pcm__pcm_cc_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/pcm__pcm_cc_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/pcm__pcm_scf_type.html b/sphinxman/master/autodir_options_c/pcm__pcm_scf_type.html
index 1269d9c4a44..937b30428d3 100644
--- a/sphinxman/master/autodir_options_c/pcm__pcm_scf_type.html
+++ b/sphinxman/master/autodir_options_c/pcm__pcm_scf_type.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/pcm__pcm_scf_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/pcm__pcm_scf_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/pcm__pcmsolver_parsed_fname.html b/sphinxman/master/autodir_options_c/pcm__pcmsolver_parsed_fname.html
index 6e4673f4b17..600dd98b0e3 100644
--- a/sphinxman/master/autodir_options_c/pcm__pcmsolver_parsed_fname.html
+++ b/sphinxman/master/autodir_options_c/pcm__pcmsolver_parsed_fname.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/pcm__pcmsolver_parsed_fname.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/pcm__pcmsolver_parsed_fname.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/pe__border.html b/sphinxman/master/autodir_options_c/pe__border.html
index 393849a4607..1577b0e3964 100644
--- a/sphinxman/master/autodir_options_c/pe__border.html
+++ b/sphinxman/master/autodir_options_c/pe__border.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/pe__border.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/pe__border.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/pe__border_n_redist.html b/sphinxman/master/autodir_options_c/pe__border_n_redist.html
index 21b7638a4c8..e306f7eb4e9 100644
--- a/sphinxman/master/autodir_options_c/pe__border_n_redist.html
+++ b/sphinxman/master/autodir_options_c/pe__border_n_redist.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/pe__border_n_redist.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/pe__border_n_redist.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/pe__border_redist_order.html b/sphinxman/master/autodir_options_c/pe__border_redist_order.html
index ee02aa418d6..13646373532 100644
--- a/sphinxman/master/autodir_options_c/pe__border_redist_order.html
+++ b/sphinxman/master/autodir_options_c/pe__border_redist_order.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/pe__border_redist_order.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/pe__border_redist_order.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/pe__border_redist_pol.html b/sphinxman/master/autodir_options_c/pe__border_redist_pol.html
index b622af26875..f8e577059f1 100644
--- a/sphinxman/master/autodir_options_c/pe__border_redist_pol.html
+++ b/sphinxman/master/autodir_options_c/pe__border_redist_pol.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/pe__border_redist_pol.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/pe__border_redist_pol.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/pe__border_rmin.html b/sphinxman/master/autodir_options_c/pe__border_rmin.html
index 93eb4cc5ddd..5ab070e9202 100644
--- a/sphinxman/master/autodir_options_c/pe__border_rmin.html
+++ b/sphinxman/master/autodir_options_c/pe__border_rmin.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/pe__border_rmin.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/pe__border_rmin.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/pe__border_rmin_unit.html b/sphinxman/master/autodir_options_c/pe__border_rmin_unit.html
index 9d3d79ad3d8..69ade7a378e 100644
--- a/sphinxman/master/autodir_options_c/pe__border_rmin_unit.html
+++ b/sphinxman/master/autodir_options_c/pe__border_rmin_unit.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/pe__border_rmin_unit.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/pe__border_rmin_unit.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/pe__border_type.html b/sphinxman/master/autodir_options_c/pe__border_type.html
index c323b85101e..c938c68a7aa 100644
--- a/sphinxman/master/autodir_options_c/pe__border_type.html
+++ b/sphinxman/master/autodir_options_c/pe__border_type.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/pe__border_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/pe__border_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/pe__damp_induced.html b/sphinxman/master/autodir_options_c/pe__damp_induced.html
index 9947c3f78f4..ece855c9485 100644
--- a/sphinxman/master/autodir_options_c/pe__damp_induced.html
+++ b/sphinxman/master/autodir_options_c/pe__damp_induced.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/pe__damp_induced.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/pe__damp_induced.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/pe__damp_multipole.html b/sphinxman/master/autodir_options_c/pe__damp_multipole.html
index b4855c8ed80..4529923a46c 100644
--- a/sphinxman/master/autodir_options_c/pe__damp_multipole.html
+++ b/sphinxman/master/autodir_options_c/pe__damp_multipole.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/pe__damp_multipole.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/pe__damp_multipole.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/pe__damping_factor_induced.html b/sphinxman/master/autodir_options_c/pe__damping_factor_induced.html
index 81f7e2881f4..6b5e0980b67 100644
--- a/sphinxman/master/autodir_options_c/pe__damping_factor_induced.html
+++ b/sphinxman/master/autodir_options_c/pe__damping_factor_induced.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/pe__damping_factor_induced.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/pe__damping_factor_induced.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/pe__damping_factor_multipole.html b/sphinxman/master/autodir_options_c/pe__damping_factor_multipole.html
index 7f34668957e..76089426712 100644
--- a/sphinxman/master/autodir_options_c/pe__damping_factor_multipole.html
+++ b/sphinxman/master/autodir_options_c/pe__damping_factor_multipole.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/pe__damping_factor_multipole.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/pe__damping_factor_multipole.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/pe__induced_convergence.html b/sphinxman/master/autodir_options_c/pe__induced_convergence.html
index ba262a871de..c3aae8b01dd 100644
--- a/sphinxman/master/autodir_options_c/pe__induced_convergence.html
+++ b/sphinxman/master/autodir_options_c/pe__induced_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/pe__induced_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/pe__induced_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/pe__isotropic_pol.html b/sphinxman/master/autodir_options_c/pe__isotropic_pol.html
index b6b0bea9981..2ea84397ff3 100644
--- a/sphinxman/master/autodir_options_c/pe__isotropic_pol.html
+++ b/sphinxman/master/autodir_options_c/pe__isotropic_pol.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/pe__isotropic_pol.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/pe__isotropic_pol.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/pe__maxiter.html b/sphinxman/master/autodir_options_c/pe__maxiter.html
index efc89976922..d0f6d3256d7 100644
--- a/sphinxman/master/autodir_options_c/pe__maxiter.html
+++ b/sphinxman/master/autodir_options_c/pe__maxiter.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/pe__maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/pe__maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/pe__pe_ecp.html b/sphinxman/master/autodir_options_c/pe__pe_ecp.html
index ad0b80f8424..5322c807f51 100644
--- a/sphinxman/master/autodir_options_c/pe__pe_ecp.html
+++ b/sphinxman/master/autodir_options_c/pe__pe_ecp.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/pe__pe_ecp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/pe__pe_ecp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/pe__potfile.html b/sphinxman/master/autodir_options_c/pe__potfile.html
index efd56973c4b..3c82c5ab1f3 100644
--- a/sphinxman/master/autodir_options_c/pe__potfile.html
+++ b/sphinxman/master/autodir_options_c/pe__potfile.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/pe__potfile.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/pe__potfile.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/pe__summation_fields.html b/sphinxman/master/autodir_options_c/pe__summation_fields.html
index 62035529534..c613dc5fafe 100644
--- a/sphinxman/master/autodir_options_c/pe__summation_fields.html
+++ b/sphinxman/master/autodir_options_c/pe__summation_fields.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/pe__summation_fields.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/pe__summation_fields.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/pe__tree_expansion_order.html b/sphinxman/master/autodir_options_c/pe__tree_expansion_order.html
index 956ac96000c..b4b9a5a6b95 100644
--- a/sphinxman/master/autodir_options_c/pe__tree_expansion_order.html
+++ b/sphinxman/master/autodir_options_c/pe__tree_expansion_order.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/pe__tree_expansion_order.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/pe__tree_expansion_order.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/pe__tree_theta.html b/sphinxman/master/autodir_options_c/pe__tree_theta.html
index 9937b7e5972..d3e49bfa411 100644
--- a/sphinxman/master/autodir_options_c/pe__tree_theta.html
+++ b/sphinxman/master/autodir_options_c/pe__tree_theta.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/pe__tree_theta.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/pe__tree_theta.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/psimrcc__cc_num_threads.html b/sphinxman/master/autodir_options_c/psimrcc__cc_num_threads.html
index 7a0a12452b2..b547e0b9544 100644
--- a/sphinxman/master/autodir_options_c/psimrcc__cc_num_threads.html
+++ b/sphinxman/master/autodir_options_c/psimrcc__cc_num_threads.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__cc_num_threads.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__cc_num_threads.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/psimrcc__corr_ansatz.html b/sphinxman/master/autodir_options_c/psimrcc__corr_ansatz.html
index 62acd837ccc..73029568407 100644
--- a/sphinxman/master/autodir_options_c/psimrcc__corr_ansatz.html
+++ b/sphinxman/master/autodir_options_c/psimrcc__corr_ansatz.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__corr_ansatz.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__corr_ansatz.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/psimrcc__corr_ccsd_t.html b/sphinxman/master/autodir_options_c/psimrcc__corr_ccsd_t.html
index d8db26afa3a..446683506e9 100644
--- a/sphinxman/master/autodir_options_c/psimrcc__corr_ccsd_t.html
+++ b/sphinxman/master/autodir_options_c/psimrcc__corr_ccsd_t.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__corr_ccsd_t.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__corr_ccsd_t.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/psimrcc__corr_charge.html b/sphinxman/master/autodir_options_c/psimrcc__corr_charge.html
index 9f37dbe3b31..00bf4743a3b 100644
--- a/sphinxman/master/autodir_options_c/psimrcc__corr_charge.html
+++ b/sphinxman/master/autodir_options_c/psimrcc__corr_charge.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__corr_charge.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__corr_charge.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/psimrcc__corr_multp.html b/sphinxman/master/autodir_options_c/psimrcc__corr_multp.html
index 0966e31bc37..ab8b800e509 100644
--- a/sphinxman/master/autodir_options_c/psimrcc__corr_multp.html
+++ b/sphinxman/master/autodir_options_c/psimrcc__corr_multp.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__corr_multp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__corr_multp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/psimrcc__corr_wfn.html b/sphinxman/master/autodir_options_c/psimrcc__corr_wfn.html
index dd89fc21a44..d284600f76a 100644
--- a/sphinxman/master/autodir_options_c/psimrcc__corr_wfn.html
+++ b/sphinxman/master/autodir_options_c/psimrcc__corr_wfn.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__corr_wfn.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__corr_wfn.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/psimrcc__coupling.html b/sphinxman/master/autodir_options_c/psimrcc__coupling.html
index ca249fe1dc2..3746f274b3c 100644
--- a/sphinxman/master/autodir_options_c/psimrcc__coupling.html
+++ b/sphinxman/master/autodir_options_c/psimrcc__coupling.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__coupling.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__coupling.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/psimrcc__coupling_terms.html b/sphinxman/master/autodir_options_c/psimrcc__coupling_terms.html
index 38b2d88d4df..aa13bb3f007 100644
--- a/sphinxman/master/autodir_options_c/psimrcc__coupling_terms.html
+++ b/sphinxman/master/autodir_options_c/psimrcc__coupling_terms.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__coupling_terms.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__coupling_terms.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/psimrcc__damping_percentage.html b/sphinxman/master/autodir_options_c/psimrcc__damping_percentage.html
index 5f6f3e13d82..f23a455f4e5 100644
--- a/sphinxman/master/autodir_options_c/psimrcc__damping_percentage.html
+++ b/sphinxman/master/autodir_options_c/psimrcc__damping_percentage.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__damping_percentage.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__damping_percentage.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/psimrcc__diagonal_ccsd_t.html b/sphinxman/master/autodir_options_c/psimrcc__diagonal_ccsd_t.html
index 0f78649a16f..6fe4ee522c6 100644
--- a/sphinxman/master/autodir_options_c/psimrcc__diagonal_ccsd_t.html
+++ b/sphinxman/master/autodir_options_c/psimrcc__diagonal_ccsd_t.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__diagonal_ccsd_t.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__diagonal_ccsd_t.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/psimrcc__diagonalize_heff.html b/sphinxman/master/autodir_options_c/psimrcc__diagonalize_heff.html
index 1f77e42e5db..20a9476d549 100644
--- a/sphinxman/master/autodir_options_c/psimrcc__diagonalize_heff.html
+++ b/sphinxman/master/autodir_options_c/psimrcc__diagonalize_heff.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__diagonalize_heff.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__diagonalize_heff.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/psimrcc__diis_max_vecs.html b/sphinxman/master/autodir_options_c/psimrcc__diis_max_vecs.html
index 05d06f33e63..680086afe2f 100644
--- a/sphinxman/master/autodir_options_c/psimrcc__diis_max_vecs.html
+++ b/sphinxman/master/autodir_options_c/psimrcc__diis_max_vecs.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__diis_max_vecs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__diis_max_vecs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/psimrcc__diis_start.html b/sphinxman/master/autodir_options_c/psimrcc__diis_start.html
index 824b1d0dcd7..c0766eab53c 100644
--- a/sphinxman/master/autodir_options_c/psimrcc__diis_start.html
+++ b/sphinxman/master/autodir_options_c/psimrcc__diis_start.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__diis_start.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__diis_start.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/psimrcc__e_convergence.html b/sphinxman/master/autodir_options_c/psimrcc__e_convergence.html
index 94c909fc39e..4f1380c8f2f 100644
--- a/sphinxman/master/autodir_options_c/psimrcc__e_convergence.html
+++ b/sphinxman/master/autodir_options_c/psimrcc__e_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__e_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__e_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/psimrcc__favg_ccsd_t.html b/sphinxman/master/autodir_options_c/psimrcc__favg_ccsd_t.html
index e0872388df6..8b115fe8684 100644
--- a/sphinxman/master/autodir_options_c/psimrcc__favg_ccsd_t.html
+++ b/sphinxman/master/autodir_options_c/psimrcc__favg_ccsd_t.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__favg_ccsd_t.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__favg_ccsd_t.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/psimrcc__follow_root.html b/sphinxman/master/autodir_options_c/psimrcc__follow_root.html
index afe0a3084ff..ca490db7886 100644
--- a/sphinxman/master/autodir_options_c/psimrcc__follow_root.html
+++ b/sphinxman/master/autodir_options_c/psimrcc__follow_root.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__follow_root.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__follow_root.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/psimrcc__heff4.html b/sphinxman/master/autodir_options_c/psimrcc__heff4.html
index 1469a02d0b4..7038e674e04 100644
--- a/sphinxman/master/autodir_options_c/psimrcc__heff4.html
+++ b/sphinxman/master/autodir_options_c/psimrcc__heff4.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__heff4.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__heff4.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/psimrcc__heff_print.html b/sphinxman/master/autodir_options_c/psimrcc__heff_print.html
index 24c16b45629..5625d855615 100644
--- a/sphinxman/master/autodir_options_c/psimrcc__heff_print.html
+++ b/sphinxman/master/autodir_options_c/psimrcc__heff_print.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__heff_print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__heff_print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/psimrcc__lock_singlet.html b/sphinxman/master/autodir_options_c/psimrcc__lock_singlet.html
index 1c962a7b2d0..12423732851 100644
--- a/sphinxman/master/autodir_options_c/psimrcc__lock_singlet.html
+++ b/sphinxman/master/autodir_options_c/psimrcc__lock_singlet.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__lock_singlet.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__lock_singlet.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/psimrcc__maxiter.html b/sphinxman/master/autodir_options_c/psimrcc__maxiter.html
index 4ba4ec6a55c..35cf8b33afd 100644
--- a/sphinxman/master/autodir_options_c/psimrcc__maxiter.html
+++ b/sphinxman/master/autodir_options_c/psimrcc__maxiter.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/psimrcc__mp2_ccsd_method.html b/sphinxman/master/autodir_options_c/psimrcc__mp2_ccsd_method.html
index 9657ea16cdd..efc56b486e1 100644
--- a/sphinxman/master/autodir_options_c/psimrcc__mp2_ccsd_method.html
+++ b/sphinxman/master/autodir_options_c/psimrcc__mp2_ccsd_method.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__mp2_ccsd_method.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__mp2_ccsd_method.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/psimrcc__mp2_guess.html b/sphinxman/master/autodir_options_c/psimrcc__mp2_guess.html
index 5c77cefd906..a770fc7895a 100644
--- a/sphinxman/master/autodir_options_c/psimrcc__mp2_guess.html
+++ b/sphinxman/master/autodir_options_c/psimrcc__mp2_guess.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__mp2_guess.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__mp2_guess.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/psimrcc__no_singles.html b/sphinxman/master/autodir_options_c/psimrcc__no_singles.html
index ce065b953fa..6545852e740 100644
--- a/sphinxman/master/autodir_options_c/psimrcc__no_singles.html
+++ b/sphinxman/master/autodir_options_c/psimrcc__no_singles.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__no_singles.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__no_singles.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/psimrcc__offdiagonal_ccsd_t.html b/sphinxman/master/autodir_options_c/psimrcc__offdiagonal_ccsd_t.html
index f49483bcfb5..fa7372355bf 100644
--- a/sphinxman/master/autodir_options_c/psimrcc__offdiagonal_ccsd_t.html
+++ b/sphinxman/master/autodir_options_c/psimrcc__offdiagonal_ccsd_t.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__offdiagonal_ccsd_t.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__offdiagonal_ccsd_t.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/psimrcc__perturb_cbs.html b/sphinxman/master/autodir_options_c/psimrcc__perturb_cbs.html
index 4f9438b3ff5..9f923faf6a1 100644
--- a/sphinxman/master/autodir_options_c/psimrcc__perturb_cbs.html
+++ b/sphinxman/master/autodir_options_c/psimrcc__perturb_cbs.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__perturb_cbs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__perturb_cbs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/psimrcc__perturb_cbs_coupling.html b/sphinxman/master/autodir_options_c/psimrcc__perturb_cbs_coupling.html
index dbcfa39f92c..06a5354a19d 100644
--- a/sphinxman/master/autodir_options_c/psimrcc__perturb_cbs_coupling.html
+++ b/sphinxman/master/autodir_options_c/psimrcc__perturb_cbs_coupling.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__perturb_cbs_coupling.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__perturb_cbs_coupling.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/psimrcc__pt_energy.html b/sphinxman/master/autodir_options_c/psimrcc__pt_energy.html
index b332096a5b5..23bd6caf91d 100644
--- a/sphinxman/master/autodir_options_c/psimrcc__pt_energy.html
+++ b/sphinxman/master/autodir_options_c/psimrcc__pt_energy.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__pt_energy.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__pt_energy.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/psimrcc__r_convergence.html b/sphinxman/master/autodir_options_c/psimrcc__r_convergence.html
index 527660c1250..a4e43ee8c0c 100644
--- a/sphinxman/master/autodir_options_c/psimrcc__r_convergence.html
+++ b/sphinxman/master/autodir_options_c/psimrcc__r_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__r_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__r_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/psimrcc__small_cutoff.html b/sphinxman/master/autodir_options_c/psimrcc__small_cutoff.html
index a73c324891e..987c7fb3939 100644
--- a/sphinxman/master/autodir_options_c/psimrcc__small_cutoff.html
+++ b/sphinxman/master/autodir_options_c/psimrcc__small_cutoff.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__small_cutoff.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -197,7 +197,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__small_cutoff.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -213,7 +213,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/psimrcc__tikhonow_max.html b/sphinxman/master/autodir_options_c/psimrcc__tikhonow_max.html
index 5b6b03105dc..93315ca80e9 100644
--- a/sphinxman/master/autodir_options_c/psimrcc__tikhonow_max.html
+++ b/sphinxman/master/autodir_options_c/psimrcc__tikhonow_max.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__tikhonow_max.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__tikhonow_max.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/psimrcc__tikhonow_omega.html b/sphinxman/master/autodir_options_c/psimrcc__tikhonow_omega.html
index cc616658158..2e183eb9ff5 100644
--- a/sphinxman/master/autodir_options_c/psimrcc__tikhonow_omega.html
+++ b/sphinxman/master/autodir_options_c/psimrcc__tikhonow_omega.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__tikhonow_omega.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__tikhonow_omega.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/psimrcc__tikhonow_triples.html b/sphinxman/master/autodir_options_c/psimrcc__tikhonow_triples.html
index a575a9e45ba..c0630ca3ae6 100644
--- a/sphinxman/master/autodir_options_c/psimrcc__tikhonow_triples.html
+++ b/sphinxman/master/autodir_options_c/psimrcc__tikhonow_triples.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__tikhonow_triples.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__tikhonow_triples.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/psimrcc__triples_algorithm.html b/sphinxman/master/autodir_options_c/psimrcc__triples_algorithm.html
index 69cd089061e..40869eb0ee5 100644
--- a/sphinxman/master/autodir_options_c/psimrcc__triples_algorithm.html
+++ b/sphinxman/master/autodir_options_c/psimrcc__triples_algorithm.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__triples_algorithm.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__triples_algorithm.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/psimrcc__triples_diis.html b/sphinxman/master/autodir_options_c/psimrcc__triples_diis.html
index ca4fdc1bb2e..5014bafa6b9 100644
--- a/sphinxman/master/autodir_options_c/psimrcc__triples_diis.html
+++ b/sphinxman/master/autodir_options_c/psimrcc__triples_diis.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__triples_diis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__triples_diis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/psimrcc__use_spin_sym.html b/sphinxman/master/autodir_options_c/psimrcc__use_spin_sym.html
index 80175331f29..fff42910094 100644
--- a/sphinxman/master/autodir_options_c/psimrcc__use_spin_sym.html
+++ b/sphinxman/master/autodir_options_c/psimrcc__use_spin_sym.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__use_spin_sym.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__use_spin_sym.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/psimrcc__use_spin_symmetry.html b/sphinxman/master/autodir_options_c/psimrcc__use_spin_symmetry.html
index ae963bf7f65..9100f277ec8 100644
--- a/sphinxman/master/autodir_options_c/psimrcc__use_spin_symmetry.html
+++ b/sphinxman/master/autodir_options_c/psimrcc__use_spin_symmetry.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__use_spin_symmetry.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__use_spin_symmetry.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/psimrcc__wfn_sym.html b/sphinxman/master/autodir_options_c/psimrcc__wfn_sym.html
index 03cb689b9bd..84741eecbe5 100644
--- a/sphinxman/master/autodir_options_c/psimrcc__wfn_sym.html
+++ b/sphinxman/master/autodir_options_c/psimrcc__wfn_sym.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__wfn_sym.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__wfn_sym.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/psimrcc__zero_internal_amps.html b/sphinxman/master/autodir_options_c/psimrcc__zero_internal_amps.html
index ade238dd6d3..8dd8b241f7e 100644
--- a/sphinxman/master/autodir_options_c/psimrcc__zero_internal_amps.html
+++ b/sphinxman/master/autodir_options_c/psimrcc__zero_internal_amps.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__zero_internal_amps.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/psimrcc__zero_internal_amps.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/sapt__aio_cphf.html b/sphinxman/master/autodir_options_c/sapt__aio_cphf.html
index 537014083a4..ba3a2376156 100644
--- a/sphinxman/master/autodir_options_c/sapt__aio_cphf.html
+++ b/sphinxman/master/autodir_options_c/sapt__aio_cphf.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__aio_cphf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__aio_cphf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/sapt__aio_df_ints.html b/sphinxman/master/autodir_options_c/sapt__aio_df_ints.html
index 57ca9f887ff..ee365811033 100644
--- a/sphinxman/master/autodir_options_c/sapt__aio_df_ints.html
+++ b/sphinxman/master/autodir_options_c/sapt__aio_df_ints.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__aio_df_ints.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__aio_df_ints.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/sapt__basis.html b/sphinxman/master/autodir_options_c/sapt__basis.html
index dc3196ffd8b..ea32c42d637 100644
--- a/sphinxman/master/autodir_options_c/sapt__basis.html
+++ b/sphinxman/master/autodir_options_c/sapt__basis.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__basis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__basis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/sapt__ccd_e_convergence.html b/sphinxman/master/autodir_options_c/sapt__ccd_e_convergence.html
index e545fa31d0a..90355603080 100644
--- a/sphinxman/master/autodir_options_c/sapt__ccd_e_convergence.html
+++ b/sphinxman/master/autodir_options_c/sapt__ccd_e_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__ccd_e_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__ccd_e_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/sapt__ccd_maxiter.html b/sphinxman/master/autodir_options_c/sapt__ccd_maxiter.html
index 985267e89d5..ea2d4b50833 100644
--- a/sphinxman/master/autodir_options_c/sapt__ccd_maxiter.html
+++ b/sphinxman/master/autodir_options_c/sapt__ccd_maxiter.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__ccd_maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__ccd_maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/sapt__ccd_t_convergence.html b/sphinxman/master/autodir_options_c/sapt__ccd_t_convergence.html
index bb33a3d96c0..83589616206 100644
--- a/sphinxman/master/autodir_options_c/sapt__ccd_t_convergence.html
+++ b/sphinxman/master/autodir_options_c/sapt__ccd_t_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__ccd_t_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__ccd_t_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/sapt__coupled_induction.html b/sphinxman/master/autodir_options_c/sapt__coupled_induction.html
index 828d134dd61..11839c13275 100644
--- a/sphinxman/master/autodir_options_c/sapt__coupled_induction.html
+++ b/sphinxman/master/autodir_options_c/sapt__coupled_induction.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__coupled_induction.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__coupled_induction.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/sapt__cphf_r_convergence.html b/sphinxman/master/autodir_options_c/sapt__cphf_r_convergence.html
index e7737157498..27e1b75c6e6 100644
--- a/sphinxman/master/autodir_options_c/sapt__cphf_r_convergence.html
+++ b/sphinxman/master/autodir_options_c/sapt__cphf_r_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__cphf_r_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__cphf_r_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/sapt__denominator_algorithm.html b/sphinxman/master/autodir_options_c/sapt__denominator_algorithm.html
index 72ae0982002..c74e3b98d01 100644
--- a/sphinxman/master/autodir_options_c/sapt__denominator_algorithm.html
+++ b/sphinxman/master/autodir_options_c/sapt__denominator_algorithm.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__denominator_algorithm.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__denominator_algorithm.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/sapt__denominator_delta.html b/sphinxman/master/autodir_options_c/sapt__denominator_delta.html
index d0050eb8c49..0525b948823 100644
--- a/sphinxman/master/autodir_options_c/sapt__denominator_delta.html
+++ b/sphinxman/master/autodir_options_c/sapt__denominator_delta.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__denominator_delta.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__denominator_delta.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/sapt__df_basis_elst.html b/sphinxman/master/autodir_options_c/sapt__df_basis_elst.html
index c803f7b9058..be4e939aaa4 100644
--- a/sphinxman/master/autodir_options_c/sapt__df_basis_elst.html
+++ b/sphinxman/master/autodir_options_c/sapt__df_basis_elst.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__df_basis_elst.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__df_basis_elst.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/sapt__df_basis_sapt.html b/sphinxman/master/autodir_options_c/sapt__df_basis_sapt.html
index dc749a71a70..40d49c35ee5 100644
--- a/sphinxman/master/autodir_options_c/sapt__df_basis_sapt.html
+++ b/sphinxman/master/autodir_options_c/sapt__df_basis_sapt.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__df_basis_sapt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__df_basis_sapt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/sapt__do_ccd_disp.html b/sphinxman/master/autodir_options_c/sapt__do_ccd_disp.html
index c2041249373..457bff6704c 100644
--- a/sphinxman/master/autodir_options_c/sapt__do_ccd_disp.html
+++ b/sphinxman/master/autodir_options_c/sapt__do_ccd_disp.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__do_ccd_disp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__do_ccd_disp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/sapt__do_disp_exch_sinf.html b/sphinxman/master/autodir_options_c/sapt__do_disp_exch_sinf.html
index 5d6d005ac0e..e9a512d26b4 100644
--- a/sphinxman/master/autodir_options_c/sapt__do_disp_exch_sinf.html
+++ b/sphinxman/master/autodir_options_c/sapt__do_disp_exch_sinf.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__do_disp_exch_sinf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__do_disp_exch_sinf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/sapt__do_ind30_exch_sinf.html b/sphinxman/master/autodir_options_c/sapt__do_ind30_exch_sinf.html
index 8b835ac1c59..81f77a26d2f 100644
--- a/sphinxman/master/autodir_options_c/sapt__do_ind30_exch_sinf.html
+++ b/sphinxman/master/autodir_options_c/sapt__do_ind30_exch_sinf.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__do_ind30_exch_sinf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__do_ind30_exch_sinf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/sapt__do_ind_exch_sinf.html b/sphinxman/master/autodir_options_c/sapt__do_ind_exch_sinf.html
index 5b11f1b1323..e45cbb3b107 100644
--- a/sphinxman/master/autodir_options_c/sapt__do_ind_exch_sinf.html
+++ b/sphinxman/master/autodir_options_c/sapt__do_ind_exch_sinf.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__do_ind_exch_sinf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__do_ind_exch_sinf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/sapt__do_mbpt_disp.html b/sphinxman/master/autodir_options_c/sapt__do_mbpt_disp.html
index 28d34780b47..5075281ee5b 100644
--- a/sphinxman/master/autodir_options_c/sapt__do_mbpt_disp.html
+++ b/sphinxman/master/autodir_options_c/sapt__do_mbpt_disp.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__do_mbpt_disp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__do_mbpt_disp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/sapt__do_third_order.html b/sphinxman/master/autodir_options_c/sapt__do_third_order.html
index 0373d3a83e8..949601f4147 100644
--- a/sphinxman/master/autodir_options_c/sapt__do_third_order.html
+++ b/sphinxman/master/autodir_options_c/sapt__do_third_order.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__do_third_order.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__do_third_order.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/sapt__exch_scale_alpha.html b/sphinxman/master/autodir_options_c/sapt__exch_scale_alpha.html
index b1cde1f2e54..1a663dfb02d 100644
--- a/sphinxman/master/autodir_options_c/sapt__exch_scale_alpha.html
+++ b/sphinxman/master/autodir_options_c/sapt__exch_scale_alpha.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__exch_scale_alpha.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__exch_scale_alpha.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/sapt__freeze_core.html b/sphinxman/master/autodir_options_c/sapt__freeze_core.html
index b4bb9ffab54..f3cb9f0eea1 100644
--- a/sphinxman/master/autodir_options_c/sapt__freeze_core.html
+++ b/sphinxman/master/autodir_options_c/sapt__freeze_core.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__freeze_core.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__freeze_core.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/sapt__ints_tolerance.html b/sphinxman/master/autodir_options_c/sapt__ints_tolerance.html
index b347bec5f73..4f882840fba 100644
--- a/sphinxman/master/autodir_options_c/sapt__ints_tolerance.html
+++ b/sphinxman/master/autodir_options_c/sapt__ints_tolerance.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__ints_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__ints_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/sapt__max_ccd_diisvecs.html b/sphinxman/master/autodir_options_c/sapt__max_ccd_diisvecs.html
index f702953d0af..ef0c88f3b30 100644
--- a/sphinxman/master/autodir_options_c/sapt__max_ccd_diisvecs.html
+++ b/sphinxman/master/autodir_options_c/sapt__max_ccd_diisvecs.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__max_ccd_diisvecs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__max_ccd_diisvecs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/sapt__maxiter.html b/sphinxman/master/autodir_options_c/sapt__maxiter.html
index 572d2e08090..e6fe8baa5bd 100644
--- a/sphinxman/master/autodir_options_c/sapt__maxiter.html
+++ b/sphinxman/master/autodir_options_c/sapt__maxiter.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/sapt__min_ccd_diisvecs.html b/sphinxman/master/autodir_options_c/sapt__min_ccd_diisvecs.html
index d91d968022c..22aa4f2520f 100644
--- a/sphinxman/master/autodir_options_c/sapt__min_ccd_diisvecs.html
+++ b/sphinxman/master/autodir_options_c/sapt__min_ccd_diisvecs.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__min_ccd_diisvecs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__min_ccd_diisvecs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/sapt__nat_orbs_t2.html b/sphinxman/master/autodir_options_c/sapt__nat_orbs_t2.html
index 1a12419d905..ca6e80c8f49 100644
--- a/sphinxman/master/autodir_options_c/sapt__nat_orbs_t2.html
+++ b/sphinxman/master/autodir_options_c/sapt__nat_orbs_t2.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__nat_orbs_t2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__nat_orbs_t2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/sapt__nat_orbs_t3.html b/sphinxman/master/autodir_options_c/sapt__nat_orbs_t3.html
index 59c3ded8952..2f393c3efb4 100644
--- a/sphinxman/master/autodir_options_c/sapt__nat_orbs_t3.html
+++ b/sphinxman/master/autodir_options_c/sapt__nat_orbs_t3.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__nat_orbs_t3.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__nat_orbs_t3.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/sapt__nat_orbs_v4.html b/sphinxman/master/autodir_options_c/sapt__nat_orbs_v4.html
index 805d8c49a08..fdf1eaf0335 100644
--- a/sphinxman/master/autodir_options_c/sapt__nat_orbs_v4.html
+++ b/sphinxman/master/autodir_options_c/sapt__nat_orbs_v4.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__nat_orbs_v4.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__nat_orbs_v4.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/sapt__occ_tolerance.html b/sphinxman/master/autodir_options_c/sapt__occ_tolerance.html
index 57515912f8e..0603e400a40 100644
--- a/sphinxman/master/autodir_options_c/sapt__occ_tolerance.html
+++ b/sphinxman/master/autodir_options_c/sapt__occ_tolerance.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__occ_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__occ_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/sapt__print.html b/sphinxman/master/autodir_options_c/sapt__print.html
index f147e47d99a..ab496923e01 100644
--- a/sphinxman/master/autodir_options_c/sapt__print.html
+++ b/sphinxman/master/autodir_options_c/sapt__print.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/sapt__sapt0_e10.html b/sphinxman/master/autodir_options_c/sapt__sapt0_e10.html
index 5eeba937966..27ae9dc2ac2 100644
--- a/sphinxman/master/autodir_options_c/sapt__sapt0_e10.html
+++ b/sphinxman/master/autodir_options_c/sapt__sapt0_e10.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__sapt0_e10.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__sapt0_e10.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/sapt__sapt0_e20disp.html b/sphinxman/master/autodir_options_c/sapt__sapt0_e20disp.html
index 82c5e5bf91c..a11463c9300 100644
--- a/sphinxman/master/autodir_options_c/sapt__sapt0_e20disp.html
+++ b/sphinxman/master/autodir_options_c/sapt__sapt0_e20disp.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__sapt0_e20disp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__sapt0_e20disp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/sapt__sapt0_e20ind.html b/sphinxman/master/autodir_options_c/sapt__sapt0_e20ind.html
index 1c58287764e..a2685a32e6d 100644
--- a/sphinxman/master/autodir_options_c/sapt__sapt0_e20ind.html
+++ b/sphinxman/master/autodir_options_c/sapt__sapt0_e20ind.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__sapt0_e20ind.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__sapt0_e20ind.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/sapt__sapt_dft_do_dhf.html b/sphinxman/master/autodir_options_c/sapt__sapt_dft_do_dhf.html
index 33ce9a78261..6e440acbcfd 100644
--- a/sphinxman/master/autodir_options_c/sapt__sapt_dft_do_dhf.html
+++ b/sphinxman/master/autodir_options_c/sapt__sapt_dft_do_dhf.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__sapt_dft_do_dhf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__sapt_dft_do_dhf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/sapt__sapt_dft_do_hybrid.html b/sphinxman/master/autodir_options_c/sapt__sapt_dft_do_hybrid.html
index cff1503b8fb..8ce944b46b8 100644
--- a/sphinxman/master/autodir_options_c/sapt__sapt_dft_do_hybrid.html
+++ b/sphinxman/master/autodir_options_c/sapt__sapt_dft_do_hybrid.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__sapt_dft_do_hybrid.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__sapt_dft_do_hybrid.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/sapt__sapt_dft_exch_disp_fixed_scale.html b/sphinxman/master/autodir_options_c/sapt__sapt_dft_exch_disp_fixed_scale.html
index f06fc04996b..cb05749f4c0 100644
--- a/sphinxman/master/autodir_options_c/sapt__sapt_dft_exch_disp_fixed_scale.html
+++ b/sphinxman/master/autodir_options_c/sapt__sapt_dft_exch_disp_fixed_scale.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__sapt_dft_exch_disp_fixed_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__sapt_dft_exch_disp_fixed_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/sapt__sapt_dft_exch_disp_scale_scheme.html b/sphinxman/master/autodir_options_c/sapt__sapt_dft_exch_disp_scale_scheme.html
index f05ad8e17de..4f70c0f6fe1 100644
--- a/sphinxman/master/autodir_options_c/sapt__sapt_dft_exch_disp_scale_scheme.html
+++ b/sphinxman/master/autodir_options_c/sapt__sapt_dft_exch_disp_scale_scheme.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__sapt_dft_exch_disp_scale_scheme.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__sapt_dft_exch_disp_scale_scheme.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/sapt__sapt_dft_functional.html b/sphinxman/master/autodir_options_c/sapt__sapt_dft_functional.html
index e132bdba9a1..0f3f680ba7e 100644
--- a/sphinxman/master/autodir_options_c/sapt__sapt_dft_functional.html
+++ b/sphinxman/master/autodir_options_c/sapt__sapt_dft_functional.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__sapt_dft_functional.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__sapt_dft_functional.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/sapt__sapt_dft_grac_determination.html b/sphinxman/master/autodir_options_c/sapt__sapt_dft_grac_determination.html
index a289144fd01..cb69ccbac1e 100644
--- a/sphinxman/master/autodir_options_c/sapt__sapt_dft_grac_determination.html
+++ b/sphinxman/master/autodir_options_c/sapt__sapt_dft_grac_determination.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__sapt_dft_grac_determination.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__sapt_dft_grac_determination.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/sapt__sapt_dft_grac_shift_a.html b/sphinxman/master/autodir_options_c/sapt__sapt_dft_grac_shift_a.html
index dce36a0006c..2ad35add652 100644
--- a/sphinxman/master/autodir_options_c/sapt__sapt_dft_grac_shift_a.html
+++ b/sphinxman/master/autodir_options_c/sapt__sapt_dft_grac_shift_a.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__sapt_dft_grac_shift_a.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__sapt_dft_grac_shift_a.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/sapt__sapt_dft_grac_shift_b.html b/sphinxman/master/autodir_options_c/sapt__sapt_dft_grac_shift_b.html
index 0dca3607f12..c1c40dc6c83 100644
--- a/sphinxman/master/autodir_options_c/sapt__sapt_dft_grac_shift_b.html
+++ b/sphinxman/master/autodir_options_c/sapt__sapt_dft_grac_shift_b.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__sapt_dft_grac_shift_b.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__sapt_dft_grac_shift_b.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/sapt__sapt_dft_mp2_disp_alg.html b/sphinxman/master/autodir_options_c/sapt__sapt_dft_mp2_disp_alg.html
index 83a74eaed25..8fd1f719f60 100644
--- a/sphinxman/master/autodir_options_c/sapt__sapt_dft_mp2_disp_alg.html
+++ b/sphinxman/master/autodir_options_c/sapt__sapt_dft_mp2_disp_alg.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__sapt_dft_mp2_disp_alg.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__sapt_dft_mp2_disp_alg.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/sapt__sapt_fdds_disp_leg_lambda.html b/sphinxman/master/autodir_options_c/sapt__sapt_fdds_disp_leg_lambda.html
index 1099cec5722..f991279f7fc 100644
--- a/sphinxman/master/autodir_options_c/sapt__sapt_fdds_disp_leg_lambda.html
+++ b/sphinxman/master/autodir_options_c/sapt__sapt_fdds_disp_leg_lambda.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__sapt_fdds_disp_leg_lambda.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__sapt_fdds_disp_leg_lambda.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/sapt__sapt_fdds_disp_num_points.html b/sphinxman/master/autodir_options_c/sapt__sapt_fdds_disp_num_points.html
index b0ba2599104..361dd14cdd4 100644
--- a/sphinxman/master/autodir_options_c/sapt__sapt_fdds_disp_num_points.html
+++ b/sphinxman/master/autodir_options_c/sapt__sapt_fdds_disp_num_points.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__sapt_fdds_disp_num_points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__sapt_fdds_disp_num_points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/sapt__sapt_fdds_v2_rho_cutoff.html b/sphinxman/master/autodir_options_c/sapt__sapt_fdds_v2_rho_cutoff.html
index c9456dbcd3f..36bc139a314 100644
--- a/sphinxman/master/autodir_options_c/sapt__sapt_fdds_v2_rho_cutoff.html
+++ b/sphinxman/master/autodir_options_c/sapt__sapt_fdds_v2_rho_cutoff.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__sapt_fdds_v2_rho_cutoff.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__sapt_fdds_v2_rho_cutoff.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/sapt__sapt_level.html b/sphinxman/master/autodir_options_c/sapt__sapt_level.html
index eaced64367b..bd695334d8c 100644
--- a/sphinxman/master/autodir_options_c/sapt__sapt_level.html
+++ b/sphinxman/master/autodir_options_c/sapt__sapt_level.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__sapt_level.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__sapt_level.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/sapt__sapt_mem_check.html b/sphinxman/master/autodir_options_c/sapt__sapt_mem_check.html
index fbec0554b11..81a2fe611f5 100644
--- a/sphinxman/master/autodir_options_c/sapt__sapt_mem_check.html
+++ b/sphinxman/master/autodir_options_c/sapt__sapt_mem_check.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__sapt_mem_check.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__sapt_mem_check.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/sapt__sapt_mem_factor.html b/sphinxman/master/autodir_options_c/sapt__sapt_mem_factor.html
index 44fc6d31480..d59e4de74fc 100644
--- a/sphinxman/master/autodir_options_c/sapt__sapt_mem_factor.html
+++ b/sphinxman/master/autodir_options_c/sapt__sapt_mem_factor.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__sapt_mem_factor.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__sapt_mem_factor.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/sapt__sapt_mem_safety.html b/sphinxman/master/autodir_options_c/sapt__sapt_mem_safety.html
index 3f6e08768dd..ea3dc867328 100644
--- a/sphinxman/master/autodir_options_c/sapt__sapt_mem_safety.html
+++ b/sphinxman/master/autodir_options_c/sapt__sapt_mem_safety.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__sapt_mem_safety.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__sapt_mem_safety.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/sapt__sapt_quiet.html b/sphinxman/master/autodir_options_c/sapt__sapt_quiet.html
index 4c713b3b2dc..0abf1cc6454 100644
--- a/sphinxman/master/autodir_options_c/sapt__sapt_quiet.html
+++ b/sphinxman/master/autodir_options_c/sapt__sapt_quiet.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__sapt_quiet.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/sapt__sapt_quiet.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__basis.html b/sphinxman/master/autodir_options_c/scf__basis.html
index 727c22d925a..a201f136657 100644
--- a/sphinxman/master/autodir_options_c/scf__basis.html
+++ b/sphinxman/master/autodir_options_c/scf__basis.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__basis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__basis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__basis_guess.html b/sphinxman/master/autodir_options_c/scf__basis_guess.html
index a73ccce63b3..1424e58ce8a 100644
--- a/sphinxman/master/autodir_options_c/scf__basis_guess.html
+++ b/sphinxman/master/autodir_options_c/scf__basis_guess.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__basis_guess.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__basis_guess.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__cholesky_tolerance.html b/sphinxman/master/autodir_options_c/scf__cholesky_tolerance.html
index 1927e6c4e31..c24aa3a5743 100644
--- a/sphinxman/master/autodir_options_c/scf__cholesky_tolerance.html
+++ b/sphinxman/master/autodir_options_c/scf__cholesky_tolerance.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__cholesky_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__cholesky_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__cosx_basis_tolerance.html b/sphinxman/master/autodir_options_c/scf__cosx_basis_tolerance.html
index 5e3f677dc8d..18ac63362bf 100644
--- a/sphinxman/master/autodir_options_c/scf__cosx_basis_tolerance.html
+++ b/sphinxman/master/autodir_options_c/scf__cosx_basis_tolerance.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__cosx_basis_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__cosx_basis_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__cosx_density_tolerance.html b/sphinxman/master/autodir_options_c/scf__cosx_density_tolerance.html
index 919c7531592..b771e9ffc82 100644
--- a/sphinxman/master/autodir_options_c/scf__cosx_density_tolerance.html
+++ b/sphinxman/master/autodir_options_c/scf__cosx_density_tolerance.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__cosx_density_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__cosx_density_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__cosx_ints_tolerance.html b/sphinxman/master/autodir_options_c/scf__cosx_ints_tolerance.html
index e064ee7eb5f..47440becd9a 100644
--- a/sphinxman/master/autodir_options_c/scf__cosx_ints_tolerance.html
+++ b/sphinxman/master/autodir_options_c/scf__cosx_ints_tolerance.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__cosx_ints_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__cosx_ints_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__cosx_maxiter_final.html b/sphinxman/master/autodir_options_c/scf__cosx_maxiter_final.html
index 0b560997aaa..cb2097b21e7 100644
--- a/sphinxman/master/autodir_options_c/scf__cosx_maxiter_final.html
+++ b/sphinxman/master/autodir_options_c/scf__cosx_maxiter_final.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__cosx_maxiter_final.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__cosx_maxiter_final.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__cosx_overlap_fitting.html b/sphinxman/master/autodir_options_c/scf__cosx_overlap_fitting.html
index da3e12a336f..2b3d88e4728 100644
--- a/sphinxman/master/autodir_options_c/scf__cosx_overlap_fitting.html
+++ b/sphinxman/master/autodir_options_c/scf__cosx_overlap_fitting.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__cosx_overlap_fitting.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__cosx_overlap_fitting.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__cosx_pruning_scheme.html b/sphinxman/master/autodir_options_c/scf__cosx_pruning_scheme.html
index 04f4cb05c30..c91104cb363 100644
--- a/sphinxman/master/autodir_options_c/scf__cosx_pruning_scheme.html
+++ b/sphinxman/master/autodir_options_c/scf__cosx_pruning_scheme.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__cosx_pruning_scheme.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__cosx_pruning_scheme.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__cosx_radial_points_final.html b/sphinxman/master/autodir_options_c/scf__cosx_radial_points_final.html
index 4e24043c516..3b1917e5408 100644
--- a/sphinxman/master/autodir_options_c/scf__cosx_radial_points_final.html
+++ b/sphinxman/master/autodir_options_c/scf__cosx_radial_points_final.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__cosx_radial_points_final.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__cosx_radial_points_final.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__cosx_radial_points_initial.html b/sphinxman/master/autodir_options_c/scf__cosx_radial_points_initial.html
index 02c69078476..6a67bf1e866 100644
--- a/sphinxman/master/autodir_options_c/scf__cosx_radial_points_initial.html
+++ b/sphinxman/master/autodir_options_c/scf__cosx_radial_points_initial.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__cosx_radial_points_initial.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__cosx_radial_points_initial.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__cosx_spherical_points_final.html b/sphinxman/master/autodir_options_c/scf__cosx_spherical_points_final.html
index a8ee2f448c3..4c4c7fec5ed 100644
--- a/sphinxman/master/autodir_options_c/scf__cosx_spherical_points_final.html
+++ b/sphinxman/master/autodir_options_c/scf__cosx_spherical_points_final.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__cosx_spherical_points_final.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__cosx_spherical_points_final.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__cosx_spherical_points_initial.html b/sphinxman/master/autodir_options_c/scf__cosx_spherical_points_initial.html
index a79bfed6500..3061dc6d8fc 100644
--- a/sphinxman/master/autodir_options_c/scf__cosx_spherical_points_initial.html
+++ b/sphinxman/master/autodir_options_c/scf__cosx_spherical_points_initial.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__cosx_spherical_points_initial.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__cosx_spherical_points_initial.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__d_convergence.html b/sphinxman/master/autodir_options_c/scf__d_convergence.html
index c40a3dd4590..34c79cabf53 100644
--- a/sphinxman/master/autodir_options_c/scf__d_convergence.html
+++ b/sphinxman/master/autodir_options_c/scf__d_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__d_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__d_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__damping_convergence.html b/sphinxman/master/autodir_options_c/scf__damping_convergence.html
index 4aefe786bc4..5c27034d0dd 100644
--- a/sphinxman/master/autodir_options_c/scf__damping_convergence.html
+++ b/sphinxman/master/autodir_options_c/scf__damping_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__damping_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__damping_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__damping_percentage.html b/sphinxman/master/autodir_options_c/scf__damping_percentage.html
index e5cd67a0f1f..23fd9a9943c 100644
--- a/sphinxman/master/autodir_options_c/scf__damping_percentage.html
+++ b/sphinxman/master/autodir_options_c/scf__damping_percentage.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__damping_percentage.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__damping_percentage.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__df_basis_guess.html b/sphinxman/master/autodir_options_c/scf__df_basis_guess.html
index 5e8cdff1b2c..878684f5882 100644
--- a/sphinxman/master/autodir_options_c/scf__df_basis_guess.html
+++ b/sphinxman/master/autodir_options_c/scf__df_basis_guess.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__df_basis_guess.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__df_basis_guess.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__df_basis_sad.html b/sphinxman/master/autodir_options_c/scf__df_basis_sad.html
index 5b8fda7b240..a9d664e6c8d 100644
--- a/sphinxman/master/autodir_options_c/scf__df_basis_sad.html
+++ b/sphinxman/master/autodir_options_c/scf__df_basis_sad.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__df_basis_sad.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__df_basis_sad.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__df_basis_scf.html b/sphinxman/master/autodir_options_c/scf__df_basis_scf.html
index 535d6563e36..f549150cdf4 100644
--- a/sphinxman/master/autodir_options_c/scf__df_basis_scf.html
+++ b/sphinxman/master/autodir_options_c/scf__df_basis_scf.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__df_basis_scf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__df_basis_scf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__df_bump_r0.html b/sphinxman/master/autodir_options_c/scf__df_bump_r0.html
index f4895202595..10dc8f40f12 100644
--- a/sphinxman/master/autodir_options_c/scf__df_bump_r0.html
+++ b/sphinxman/master/autodir_options_c/scf__df_bump_r0.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__df_bump_r0.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__df_bump_r0.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__df_bump_r1.html b/sphinxman/master/autodir_options_c/scf__df_bump_r1.html
index 839a855fb14..a2ab65c84ab 100644
--- a/sphinxman/master/autodir_options_c/scf__df_bump_r1.html
+++ b/sphinxman/master/autodir_options_c/scf__df_bump_r1.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__df_bump_r1.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__df_bump_r1.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__df_domains.html b/sphinxman/master/autodir_options_c/scf__df_domains.html
index 573c320ada1..c5a7298773b 100644
--- a/sphinxman/master/autodir_options_c/scf__df_domains.html
+++ b/sphinxman/master/autodir_options_c/scf__df_domains.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__df_domains.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__df_domains.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__df_fitting_condition.html b/sphinxman/master/autodir_options_c/scf__df_fitting_condition.html
index 6af649bf5ce..582f173e231 100644
--- a/sphinxman/master/autodir_options_c/scf__df_fitting_condition.html
+++ b/sphinxman/master/autodir_options_c/scf__df_fitting_condition.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__df_fitting_condition.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__df_fitting_condition.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__df_ints_io.html b/sphinxman/master/autodir_options_c/scf__df_ints_io.html
index 1e47bb6be63..9877d612296 100644
--- a/sphinxman/master/autodir_options_c/scf__df_ints_io.html
+++ b/sphinxman/master/autodir_options_c/scf__df_ints_io.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__df_ints_io.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__df_ints_io.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__df_ints_num_threads.html b/sphinxman/master/autodir_options_c/scf__df_ints_num_threads.html
index 89641b92edf..2b64667331e 100644
--- a/sphinxman/master/autodir_options_c/scf__df_ints_num_threads.html
+++ b/sphinxman/master/autodir_options_c/scf__df_ints_num_threads.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__df_ints_num_threads.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__df_ints_num_threads.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__df_metric.html b/sphinxman/master/autodir_options_c/scf__df_metric.html
index 782dabea815..b61746b9608 100644
--- a/sphinxman/master/autodir_options_c/scf__df_metric.html
+++ b/sphinxman/master/autodir_options_c/scf__df_metric.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__df_metric.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__df_metric.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__df_scf_guess.html b/sphinxman/master/autodir_options_c/scf__df_scf_guess.html
index 6e63c8ed589..9ee5d241bf2 100644
--- a/sphinxman/master/autodir_options_c/scf__df_scf_guess.html
+++ b/sphinxman/master/autodir_options_c/scf__df_scf_guess.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__df_scf_guess.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__df_scf_guess.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__df_theta.html b/sphinxman/master/autodir_options_c/scf__df_theta.html
index f96dc61bc30..0a6754d0509 100644
--- a/sphinxman/master/autodir_options_c/scf__df_theta.html
+++ b/sphinxman/master/autodir_options_c/scf__df_theta.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__df_theta.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__df_theta.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__dft_alpha.html b/sphinxman/master/autodir_options_c/scf__dft_alpha.html
index da678ec67ed..191ffa98dcf 100644
--- a/sphinxman/master/autodir_options_c/scf__dft_alpha.html
+++ b/sphinxman/master/autodir_options_c/scf__dft_alpha.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_alpha.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_alpha.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__dft_alpha_c.html b/sphinxman/master/autodir_options_c/scf__dft_alpha_c.html
index 197e54fea61..9fe93fc9740 100644
--- a/sphinxman/master/autodir_options_c/scf__dft_alpha_c.html
+++ b/sphinxman/master/autodir_options_c/scf__dft_alpha_c.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_alpha_c.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_alpha_c.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__dft_basis_tolerance.html b/sphinxman/master/autodir_options_c/scf__dft_basis_tolerance.html
index 71bad09a90e..fbd450c3522 100644
--- a/sphinxman/master/autodir_options_c/scf__dft_basis_tolerance.html
+++ b/sphinxman/master/autodir_options_c/scf__dft_basis_tolerance.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_basis_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_basis_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__dft_block_max_points.html b/sphinxman/master/autodir_options_c/scf__dft_block_max_points.html
index 3ffe7634af5..dacc1fb973c 100644
--- a/sphinxman/master/autodir_options_c/scf__dft_block_max_points.html
+++ b/sphinxman/master/autodir_options_c/scf__dft_block_max_points.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_block_max_points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_block_max_points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__dft_block_max_radius.html b/sphinxman/master/autodir_options_c/scf__dft_block_max_radius.html
index f1148e738e5..54a95fc54b7 100644
--- a/sphinxman/master/autodir_options_c/scf__dft_block_max_radius.html
+++ b/sphinxman/master/autodir_options_c/scf__dft_block_max_radius.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_block_max_radius.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_block_max_radius.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__dft_block_min_points.html b/sphinxman/master/autodir_options_c/scf__dft_block_min_points.html
index c2581a3e03c..c60b1dc81a6 100644
--- a/sphinxman/master/autodir_options_c/scf__dft_block_min_points.html
+++ b/sphinxman/master/autodir_options_c/scf__dft_block_min_points.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_block_min_points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_block_min_points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__dft_block_scheme.html b/sphinxman/master/autodir_options_c/scf__dft_block_scheme.html
index 825e1251453..5ef6845f35d 100644
--- a/sphinxman/master/autodir_options_c/scf__dft_block_scheme.html
+++ b/sphinxman/master/autodir_options_c/scf__dft_block_scheme.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_block_scheme.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_block_scheme.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__dft_bs_radius_alpha.html b/sphinxman/master/autodir_options_c/scf__dft_bs_radius_alpha.html
index 5a1bf540431..7f2adb96a10 100644
--- a/sphinxman/master/autodir_options_c/scf__dft_bs_radius_alpha.html
+++ b/sphinxman/master/autodir_options_c/scf__dft_bs_radius_alpha.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_bs_radius_alpha.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_bs_radius_alpha.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__dft_density_tolerance.html b/sphinxman/master/autodir_options_c/scf__dft_density_tolerance.html
index 31a63a2398a..b3c8a430d24 100644
--- a/sphinxman/master/autodir_options_c/scf__dft_density_tolerance.html
+++ b/sphinxman/master/autodir_options_c/scf__dft_density_tolerance.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_density_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_density_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__dft_dispersion_parameters.html b/sphinxman/master/autodir_options_c/scf__dft_dispersion_parameters.html
index da7f3795cc2..038167d79b2 100644
--- a/sphinxman/master/autodir_options_c/scf__dft_dispersion_parameters.html
+++ b/sphinxman/master/autodir_options_c/scf__dft_dispersion_parameters.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_dispersion_parameters.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_dispersion_parameters.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__dft_grac_alpha.html b/sphinxman/master/autodir_options_c/scf__dft_grac_alpha.html
index f2c42b8ab52..fe4f756b524 100644
--- a/sphinxman/master/autodir_options_c/scf__dft_grac_alpha.html
+++ b/sphinxman/master/autodir_options_c/scf__dft_grac_alpha.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_grac_alpha.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_grac_alpha.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__dft_grac_beta.html b/sphinxman/master/autodir_options_c/scf__dft_grac_beta.html
index 09f2191cb6b..3bfe12cd0eb 100644
--- a/sphinxman/master/autodir_options_c/scf__dft_grac_beta.html
+++ b/sphinxman/master/autodir_options_c/scf__dft_grac_beta.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_grac_beta.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_grac_beta.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__dft_grac_c_func.html b/sphinxman/master/autodir_options_c/scf__dft_grac_c_func.html
index 454e6500465..88dc850da65 100644
--- a/sphinxman/master/autodir_options_c/scf__dft_grac_c_func.html
+++ b/sphinxman/master/autodir_options_c/scf__dft_grac_c_func.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_grac_c_func.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_grac_c_func.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__dft_grac_shift.html b/sphinxman/master/autodir_options_c/scf__dft_grac_shift.html
index 5f59f244e01..c5cd9a8c4c9 100644
--- a/sphinxman/master/autodir_options_c/scf__dft_grac_shift.html
+++ b/sphinxman/master/autodir_options_c/scf__dft_grac_shift.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_grac_shift.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_grac_shift.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__dft_grac_x_func.html b/sphinxman/master/autodir_options_c/scf__dft_grac_x_func.html
index ca6590d2ae4..e16b0a473ee 100644
--- a/sphinxman/master/autodir_options_c/scf__dft_grac_x_func.html
+++ b/sphinxman/master/autodir_options_c/scf__dft_grac_x_func.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_grac_x_func.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_grac_x_func.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__dft_grid_name.html b/sphinxman/master/autodir_options_c/scf__dft_grid_name.html
index 0e791373a44..6799e8f8260 100644
--- a/sphinxman/master/autodir_options_c/scf__dft_grid_name.html
+++ b/sphinxman/master/autodir_options_c/scf__dft_grid_name.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_grid_name.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_grid_name.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__dft_nuclear_scheme.html b/sphinxman/master/autodir_options_c/scf__dft_nuclear_scheme.html
index cbe2b2189c8..3905ae21414 100644
--- a/sphinxman/master/autodir_options_c/scf__dft_nuclear_scheme.html
+++ b/sphinxman/master/autodir_options_c/scf__dft_nuclear_scheme.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_nuclear_scheme.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_nuclear_scheme.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__dft_omega.html b/sphinxman/master/autodir_options_c/scf__dft_omega.html
index 085985518a9..2f64d530b79 100644
--- a/sphinxman/master/autodir_options_c/scf__dft_omega.html
+++ b/sphinxman/master/autodir_options_c/scf__dft_omega.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_omega.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_omega.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__dft_omega_c.html b/sphinxman/master/autodir_options_c/scf__dft_omega_c.html
index 911b461a213..491f6d26afb 100644
--- a/sphinxman/master/autodir_options_c/scf__dft_omega_c.html
+++ b/sphinxman/master/autodir_options_c/scf__dft_omega_c.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_omega_c.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_omega_c.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__dft_pruning_alpha.html b/sphinxman/master/autodir_options_c/scf__dft_pruning_alpha.html
index 72b6098284a..05151b00f29 100644
--- a/sphinxman/master/autodir_options_c/scf__dft_pruning_alpha.html
+++ b/sphinxman/master/autodir_options_c/scf__dft_pruning_alpha.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_pruning_alpha.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_pruning_alpha.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__dft_pruning_scheme.html b/sphinxman/master/autodir_options_c/scf__dft_pruning_scheme.html
index 323f75ab33c..89abbe9737d 100644
--- a/sphinxman/master/autodir_options_c/scf__dft_pruning_scheme.html
+++ b/sphinxman/master/autodir_options_c/scf__dft_pruning_scheme.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_pruning_scheme.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_pruning_scheme.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__dft_radial_points.html b/sphinxman/master/autodir_options_c/scf__dft_radial_points.html
index ed7cc802421..fcee38c73c0 100644
--- a/sphinxman/master/autodir_options_c/scf__dft_radial_points.html
+++ b/sphinxman/master/autodir_options_c/scf__dft_radial_points.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_radial_points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_radial_points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__dft_radial_scheme.html b/sphinxman/master/autodir_options_c/scf__dft_radial_scheme.html
index 860e3b65832..3b7880836cd 100644
--- a/sphinxman/master/autodir_options_c/scf__dft_radial_scheme.html
+++ b/sphinxman/master/autodir_options_c/scf__dft_radial_scheme.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_radial_scheme.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_radial_scheme.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__dft_remove_distant_points.html b/sphinxman/master/autodir_options_c/scf__dft_remove_distant_points.html
index 45230b948bc..91701d1f1be 100644
--- a/sphinxman/master/autodir_options_c/scf__dft_remove_distant_points.html
+++ b/sphinxman/master/autodir_options_c/scf__dft_remove_distant_points.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_remove_distant_points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_remove_distant_points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__dft_spherical_points.html b/sphinxman/master/autodir_options_c/scf__dft_spherical_points.html
index be1f4e33ee0..2b9fcc1a79a 100644
--- a/sphinxman/master/autodir_options_c/scf__dft_spherical_points.html
+++ b/sphinxman/master/autodir_options_c/scf__dft_spherical_points.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_spherical_points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_spherical_points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__dft_spherical_scheme.html b/sphinxman/master/autodir_options_c/scf__dft_spherical_scheme.html
index 8e8c3210d24..1d70380c4f2 100644
--- a/sphinxman/master/autodir_options_c/scf__dft_spherical_scheme.html
+++ b/sphinxman/master/autodir_options_c/scf__dft_spherical_scheme.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_spherical_scheme.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_spherical_scheme.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__dft_v2_rho_cutoff.html b/sphinxman/master/autodir_options_c/scf__dft_v2_rho_cutoff.html
index 021421f84f2..10a2644b5d6 100644
--- a/sphinxman/master/autodir_options_c/scf__dft_v2_rho_cutoff.html
+++ b/sphinxman/master/autodir_options_c/scf__dft_v2_rho_cutoff.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_v2_rho_cutoff.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_v2_rho_cutoff.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__dft_vv10_b.html b/sphinxman/master/autodir_options_c/scf__dft_vv10_b.html
index c979cee3975..37ba30d9328 100644
--- a/sphinxman/master/autodir_options_c/scf__dft_vv10_b.html
+++ b/sphinxman/master/autodir_options_c/scf__dft_vv10_b.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_vv10_b.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_vv10_b.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__dft_vv10_c.html b/sphinxman/master/autodir_options_c/scf__dft_vv10_c.html
index 115918766cc..db362c536af 100644
--- a/sphinxman/master/autodir_options_c/scf__dft_vv10_c.html
+++ b/sphinxman/master/autodir_options_c/scf__dft_vv10_c.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_vv10_c.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_vv10_c.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__dft_vv10_postscf.html b/sphinxman/master/autodir_options_c/scf__dft_vv10_postscf.html
index a70543c7f96..00d81d94cbd 100644
--- a/sphinxman/master/autodir_options_c/scf__dft_vv10_postscf.html
+++ b/sphinxman/master/autodir_options_c/scf__dft_vv10_postscf.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_vv10_postscf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_vv10_postscf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__dft_vv10_radial_points.html b/sphinxman/master/autodir_options_c/scf__dft_vv10_radial_points.html
index a1746a3fefc..210659e7a89 100644
--- a/sphinxman/master/autodir_options_c/scf__dft_vv10_radial_points.html
+++ b/sphinxman/master/autodir_options_c/scf__dft_vv10_radial_points.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_vv10_radial_points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_vv10_radial_points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__dft_vv10_rho_cutoff.html b/sphinxman/master/autodir_options_c/scf__dft_vv10_rho_cutoff.html
index c6d7f8a163e..4bcc3e2c714 100644
--- a/sphinxman/master/autodir_options_c/scf__dft_vv10_rho_cutoff.html
+++ b/sphinxman/master/autodir_options_c/scf__dft_vv10_rho_cutoff.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_vv10_rho_cutoff.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_vv10_rho_cutoff.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__dft_vv10_spherical_points.html b/sphinxman/master/autodir_options_c/scf__dft_vv10_spherical_points.html
index 84ab71ba900..5b49e28da86 100644
--- a/sphinxman/master/autodir_options_c/scf__dft_vv10_spherical_points.html
+++ b/sphinxman/master/autodir_options_c/scf__dft_vv10_spherical_points.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_vv10_spherical_points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_vv10_spherical_points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__dft_weights_tolerance.html b/sphinxman/master/autodir_options_c/scf__dft_weights_tolerance.html
index 9e7f475097d..c266b53925b 100644
--- a/sphinxman/master/autodir_options_c/scf__dft_weights_tolerance.html
+++ b/sphinxman/master/autodir_options_c/scf__dft_weights_tolerance.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_weights_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__dft_weights_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__diis.html b/sphinxman/master/autodir_options_c/scf__diis.html
index 8d53b3ee3ef..f5e865c5057 100644
--- a/sphinxman/master/autodir_options_c/scf__diis.html
+++ b/sphinxman/master/autodir_options_c/scf__diis.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__diis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__diis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__diis_max_vecs.html b/sphinxman/master/autodir_options_c/scf__diis_max_vecs.html
index f282c9643e7..f1473369a99 100644
--- a/sphinxman/master/autodir_options_c/scf__diis_max_vecs.html
+++ b/sphinxman/master/autodir_options_c/scf__diis_max_vecs.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__diis_max_vecs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__diis_max_vecs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__diis_min_vecs.html b/sphinxman/master/autodir_options_c/scf__diis_min_vecs.html
index 15e43311214..afba9c00ff8 100644
--- a/sphinxman/master/autodir_options_c/scf__diis_min_vecs.html
+++ b/sphinxman/master/autodir_options_c/scf__diis_min_vecs.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__diis_min_vecs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__diis_min_vecs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__diis_rms_error.html b/sphinxman/master/autodir_options_c/scf__diis_rms_error.html
index 1ebb57d331d..d82c42132d0 100644
--- a/sphinxman/master/autodir_options_c/scf__diis_rms_error.html
+++ b/sphinxman/master/autodir_options_c/scf__diis_rms_error.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__diis_rms_error.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__diis_rms_error.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__diis_start.html b/sphinxman/master/autodir_options_c/scf__diis_start.html
index da0f3cf6119..dcf9efdab88 100644
--- a/sphinxman/master/autodir_options_c/scf__diis_start.html
+++ b/sphinxman/master/autodir_options_c/scf__diis_start.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__diis_start.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__diis_start.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__distributed_matrix.html b/sphinxman/master/autodir_options_c/scf__distributed_matrix.html
index 7cda540082b..51e8472f2ec 100644
--- a/sphinxman/master/autodir_options_c/scf__distributed_matrix.html
+++ b/sphinxman/master/autodir_options_c/scf__distributed_matrix.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__distributed_matrix.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__distributed_matrix.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__e_convergence.html b/sphinxman/master/autodir_options_c/scf__e_convergence.html
index 3d7623b12f9..6e6ba8279cf 100644
--- a/sphinxman/master/autodir_options_c/scf__e_convergence.html
+++ b/sphinxman/master/autodir_options_c/scf__e_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__e_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__e_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__extern.html b/sphinxman/master/autodir_options_c/scf__extern.html
index 4169bb35153..31d721432ea 100644
--- a/sphinxman/master/autodir_options_c/scf__extern.html
+++ b/sphinxman/master/autodir_options_c/scf__extern.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__extern.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__extern.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__fail_on_maxiter.html b/sphinxman/master/autodir_options_c/scf__fail_on_maxiter.html
index b43e5803f23..2fdc6c69012 100644
--- a/sphinxman/master/autodir_options_c/scf__fail_on_maxiter.html
+++ b/sphinxman/master/autodir_options_c/scf__fail_on_maxiter.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__fail_on_maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__fail_on_maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__follow_step_increment.html b/sphinxman/master/autodir_options_c/scf__follow_step_increment.html
index dc4cdf7033b..0fb04e88124 100644
--- a/sphinxman/master/autodir_options_c/scf__follow_step_increment.html
+++ b/sphinxman/master/autodir_options_c/scf__follow_step_increment.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__follow_step_increment.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__follow_step_increment.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__follow_step_scale.html b/sphinxman/master/autodir_options_c/scf__follow_step_scale.html
index 0da4c4780a3..a82986ed1d6 100644
--- a/sphinxman/master/autodir_options_c/scf__follow_step_scale.html
+++ b/sphinxman/master/autodir_options_c/scf__follow_step_scale.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__follow_step_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__follow_step_scale.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__frac_diis.html b/sphinxman/master/autodir_options_c/scf__frac_diis.html
index cff9e848327..980413b84aa 100644
--- a/sphinxman/master/autodir_options_c/scf__frac_diis.html
+++ b/sphinxman/master/autodir_options_c/scf__frac_diis.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__frac_diis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__frac_diis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__frac_load.html b/sphinxman/master/autodir_options_c/scf__frac_load.html
index 17993011ede..bed2a4ba093 100644
--- a/sphinxman/master/autodir_options_c/scf__frac_load.html
+++ b/sphinxman/master/autodir_options_c/scf__frac_load.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__frac_load.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__frac_load.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__frac_occ.html b/sphinxman/master/autodir_options_c/scf__frac_occ.html
index 370f0057493..aa67328be6e 100644
--- a/sphinxman/master/autodir_options_c/scf__frac_occ.html
+++ b/sphinxman/master/autodir_options_c/scf__frac_occ.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__frac_occ.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__frac_occ.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__frac_renormalize.html b/sphinxman/master/autodir_options_c/scf__frac_renormalize.html
index 06e9c53a55a..cac53573d77 100644
--- a/sphinxman/master/autodir_options_c/scf__frac_renormalize.html
+++ b/sphinxman/master/autodir_options_c/scf__frac_renormalize.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__frac_renormalize.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__frac_renormalize.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__frac_start.html b/sphinxman/master/autodir_options_c/scf__frac_start.html
index 38b7f68e733..b8ea7b5c22a 100644
--- a/sphinxman/master/autodir_options_c/scf__frac_start.html
+++ b/sphinxman/master/autodir_options_c/scf__frac_start.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__frac_start.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__frac_start.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__frac_val.html b/sphinxman/master/autodir_options_c/scf__frac_val.html
index 1ca2f578e75..c429a22c8f8 100644
--- a/sphinxman/master/autodir_options_c/scf__frac_val.html
+++ b/sphinxman/master/autodir_options_c/scf__frac_val.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__frac_val.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__frac_val.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__guess.html b/sphinxman/master/autodir_options_c/scf__guess.html
index 91752215f38..d8f54996b8a 100644
--- a/sphinxman/master/autodir_options_c/scf__guess.html
+++ b/sphinxman/master/autodir_options_c/scf__guess.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__guess.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__guess.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__guess_mix.html b/sphinxman/master/autodir_options_c/scf__guess_mix.html
index 197f21b3722..67793049c83 100644
--- a/sphinxman/master/autodir_options_c/scf__guess_mix.html
+++ b/sphinxman/master/autodir_options_c/scf__guess_mix.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__guess_mix.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__guess_mix.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__guess_persist.html b/sphinxman/master/autodir_options_c/scf__guess_persist.html
index 69b628d6468..3ca08359892 100644
--- a/sphinxman/master/autodir_options_c/scf__guess_persist.html
+++ b/sphinxman/master/autodir_options_c/scf__guess_persist.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__guess_persist.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__guess_persist.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__incfock.html b/sphinxman/master/autodir_options_c/scf__incfock.html
index bf778265d9b..15f32418fb4 100644
--- a/sphinxman/master/autodir_options_c/scf__incfock.html
+++ b/sphinxman/master/autodir_options_c/scf__incfock.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__incfock.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__incfock.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__incfock_convergence.html b/sphinxman/master/autodir_options_c/scf__incfock_convergence.html
index 3203e99a746..f79d3af4021 100644
--- a/sphinxman/master/autodir_options_c/scf__incfock_convergence.html
+++ b/sphinxman/master/autodir_options_c/scf__incfock_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__incfock_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__incfock_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__incfock_full_fock_every.html b/sphinxman/master/autodir_options_c/scf__incfock_full_fock_every.html
index e19e442a608..4b564badded 100644
--- a/sphinxman/master/autodir_options_c/scf__incfock_full_fock_every.html
+++ b/sphinxman/master/autodir_options_c/scf__incfock_full_fock_every.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__incfock_full_fock_every.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__incfock_full_fock_every.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__ints_tolerance.html b/sphinxman/master/autodir_options_c/scf__ints_tolerance.html
index c2957a758b9..97500722129 100644
--- a/sphinxman/master/autodir_options_c/scf__ints_tolerance.html
+++ b/sphinxman/master/autodir_options_c/scf__ints_tolerance.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__ints_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__ints_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__level_shift.html b/sphinxman/master/autodir_options_c/scf__level_shift.html
index 748288b5918..e7f892c21d0 100644
--- a/sphinxman/master/autodir_options_c/scf__level_shift.html
+++ b/sphinxman/master/autodir_options_c/scf__level_shift.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__level_shift.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__level_shift.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__level_shift_cutoff.html b/sphinxman/master/autodir_options_c/scf__level_shift_cutoff.html
index 15129d3daf8..26579df710d 100644
--- a/sphinxman/master/autodir_options_c/scf__level_shift_cutoff.html
+++ b/sphinxman/master/autodir_options_c/scf__level_shift_cutoff.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__level_shift_cutoff.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__level_shift_cutoff.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__link_ints_tolerance.html b/sphinxman/master/autodir_options_c/scf__link_ints_tolerance.html
index d70978c8e75..ebf314f2d6b 100644
--- a/sphinxman/master/autodir_options_c/scf__link_ints_tolerance.html
+++ b/sphinxman/master/autodir_options_c/scf__link_ints_tolerance.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__link_ints_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__link_ints_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__local_convergence.html b/sphinxman/master/autodir_options_c/scf__local_convergence.html
index 77a6d26b3c1..5454b19bc6b 100644
--- a/sphinxman/master/autodir_options_c/scf__local_convergence.html
+++ b/sphinxman/master/autodir_options_c/scf__local_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__local_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__local_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__local_maxiter.html b/sphinxman/master/autodir_options_c/scf__local_maxiter.html
index fab5974ff79..b9828265f01 100644
--- a/sphinxman/master/autodir_options_c/scf__local_maxiter.html
+++ b/sphinxman/master/autodir_options_c/scf__local_maxiter.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__local_maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__local_maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__max_attempts.html b/sphinxman/master/autodir_options_c/scf__max_attempts.html
index 7d174347c40..c7120bc7f5e 100644
--- a/sphinxman/master/autodir_options_c/scf__max_attempts.html
+++ b/sphinxman/master/autodir_options_c/scf__max_attempts.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__max_attempts.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__max_attempts.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__max_mem_buf.html b/sphinxman/master/autodir_options_c/scf__max_mem_buf.html
index d3e9003971d..97bfbe888b3 100644
--- a/sphinxman/master/autodir_options_c/scf__max_mem_buf.html
+++ b/sphinxman/master/autodir_options_c/scf__max_mem_buf.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__max_mem_buf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__max_mem_buf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__maxiter.html b/sphinxman/master/autodir_options_c/scf__maxiter.html
index 1658ab2766b..ba41c79d566 100644
--- a/sphinxman/master/autodir_options_c/scf__maxiter.html
+++ b/sphinxman/master/autodir_options_c/scf__maxiter.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__molden_write.html b/sphinxman/master/autodir_options_c/scf__molden_write.html
index fd9b16839ba..22ac0e58843 100644
--- a/sphinxman/master/autodir_options_c/scf__molden_write.html
+++ b/sphinxman/master/autodir_options_c/scf__molden_write.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__molden_write.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__molden_write.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__mom_occ.html b/sphinxman/master/autodir_options_c/scf__mom_occ.html
index 0d793ea32ce..a31fb334aec 100644
--- a/sphinxman/master/autodir_options_c/scf__mom_occ.html
+++ b/sphinxman/master/autodir_options_c/scf__mom_occ.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__mom_occ.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__mom_occ.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__mom_start.html b/sphinxman/master/autodir_options_c/scf__mom_start.html
index 0ad4833e665..8f8a70778f7 100644
--- a/sphinxman/master/autodir_options_c/scf__mom_start.html
+++ b/sphinxman/master/autodir_options_c/scf__mom_start.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__mom_start.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__mom_start.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__mom_vir.html b/sphinxman/master/autodir_options_c/scf__mom_vir.html
index 4275fb64612..83173c0b195 100644
--- a/sphinxman/master/autodir_options_c/scf__mom_vir.html
+++ b/sphinxman/master/autodir_options_c/scf__mom_vir.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__mom_vir.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__mom_vir.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__nl_dispersion_parameters.html b/sphinxman/master/autodir_options_c/scf__nl_dispersion_parameters.html
index 62087f28233..f781bc5805e 100644
--- a/sphinxman/master/autodir_options_c/scf__nl_dispersion_parameters.html
+++ b/sphinxman/master/autodir_options_c/scf__nl_dispersion_parameters.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__nl_dispersion_parameters.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__nl_dispersion_parameters.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__onepot_grid_read.html b/sphinxman/master/autodir_options_c/scf__onepot_grid_read.html
index c45a16d29d9..7dba3c17b88 100644
--- a/sphinxman/master/autodir_options_c/scf__onepot_grid_read.html
+++ b/sphinxman/master/autodir_options_c/scf__onepot_grid_read.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__onepot_grid_read.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__onepot_grid_read.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__orbitals_write.html b/sphinxman/master/autodir_options_c/scf__orbitals_write.html
index 0af37dd185c..6079d196cd9 100644
--- a/sphinxman/master/autodir_options_c/scf__orbitals_write.html
+++ b/sphinxman/master/autodir_options_c/scf__orbitals_write.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__orbitals_write.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__orbitals_write.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__parallel.html b/sphinxman/master/autodir_options_c/scf__parallel.html
index 5356283c608..9615e6b51e5 100644
--- a/sphinxman/master/autodir_options_c/scf__parallel.html
+++ b/sphinxman/master/autodir_options_c/scf__parallel.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__parallel.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__parallel.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__perturb_dipole.html b/sphinxman/master/autodir_options_c/scf__perturb_dipole.html
index b3b8a99bd28..d9c8f80fdd3 100644
--- a/sphinxman/master/autodir_options_c/scf__perturb_dipole.html
+++ b/sphinxman/master/autodir_options_c/scf__perturb_dipole.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__perturb_dipole.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__perturb_dipole.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__perturb_h.html b/sphinxman/master/autodir_options_c/scf__perturb_h.html
index c202c989e82..5296393c698 100644
--- a/sphinxman/master/autodir_options_c/scf__perturb_h.html
+++ b/sphinxman/master/autodir_options_c/scf__perturb_h.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__perturb_h.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__perturb_h.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__perturb_magnitude.html b/sphinxman/master/autodir_options_c/scf__perturb_magnitude.html
index 717cbddc0a1..97d6cc12073 100644
--- a/sphinxman/master/autodir_options_c/scf__perturb_magnitude.html
+++ b/sphinxman/master/autodir_options_c/scf__perturb_magnitude.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__perturb_magnitude.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__perturb_magnitude.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__perturb_with.html b/sphinxman/master/autodir_options_c/scf__perturb_with.html
index 436d6271d32..0d7a7e66aba 100644
--- a/sphinxman/master/autodir_options_c/scf__perturb_with.html
+++ b/sphinxman/master/autodir_options_c/scf__perturb_with.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__perturb_with.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__perturb_with.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__phi_points.html b/sphinxman/master/autodir_options_c/scf__phi_points.html
index a1717148503..2d79b03ed71 100644
--- a/sphinxman/master/autodir_options_c/scf__phi_points.html
+++ b/sphinxman/master/autodir_options_c/scf__phi_points.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__phi_points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__phi_points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__pk_all_nonsym.html b/sphinxman/master/autodir_options_c/scf__pk_all_nonsym.html
index 2dac953de6b..10b732fc4b4 100644
--- a/sphinxman/master/autodir_options_c/scf__pk_all_nonsym.html
+++ b/sphinxman/master/autodir_options_c/scf__pk_all_nonsym.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__pk_all_nonsym.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__pk_all_nonsym.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__pk_max_buckets.html b/sphinxman/master/autodir_options_c/scf__pk_max_buckets.html
index 5e9f5900c6f..d3a57b2df2b 100644
--- a/sphinxman/master/autodir_options_c/scf__pk_max_buckets.html
+++ b/sphinxman/master/autodir_options_c/scf__pk_max_buckets.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__pk_max_buckets.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__pk_max_buckets.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__print_basis.html b/sphinxman/master/autodir_options_c/scf__print_basis.html
index c71368d7420..10979f4611f 100644
--- a/sphinxman/master/autodir_options_c/scf__print_basis.html
+++ b/sphinxman/master/autodir_options_c/scf__print_basis.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__print_basis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__print_basis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__print_mos.html b/sphinxman/master/autodir_options_c/scf__print_mos.html
index f6e06fa904c..cf4b74251d7 100644
--- a/sphinxman/master/autodir_options_c/scf__print_mos.html
+++ b/sphinxman/master/autodir_options_c/scf__print_mos.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__print_mos.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__print_mos.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__process_grid.html b/sphinxman/master/autodir_options_c/scf__process_grid.html
index 7a93a969210..569be9760e7 100644
--- a/sphinxman/master/autodir_options_c/scf__process_grid.html
+++ b/sphinxman/master/autodir_options_c/scf__process_grid.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__process_grid.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__process_grid.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__qchf.html b/sphinxman/master/autodir_options_c/scf__qchf.html
index 775364e449a..f5ddf79e58e 100644
--- a/sphinxman/master/autodir_options_c/scf__qchf.html
+++ b/sphinxman/master/autodir_options_c/scf__qchf.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__qchf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__qchf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__r_points.html b/sphinxman/master/autodir_options_c/scf__r_points.html
index ee07e527999..ef2c54ef726 100644
--- a/sphinxman/master/autodir_options_c/scf__r_points.html
+++ b/sphinxman/master/autodir_options_c/scf__r_points.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__r_points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__r_points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__radius.html b/sphinxman/master/autodir_options_c/scf__radius.html
index 99e0be153ec..3f4ac1be63f 100644
--- a/sphinxman/master/autodir_options_c/scf__radius.html
+++ b/sphinxman/master/autodir_options_c/scf__radius.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__radius.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__radius.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__reference.html b/sphinxman/master/autodir_options_c/scf__reference.html
index beab66fe149..947e1a9609b 100644
--- a/sphinxman/master/autodir_options_c/scf__reference.html
+++ b/sphinxman/master/autodir_options_c/scf__reference.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__reference.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__reference.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__s_cholesky_tolerance.html b/sphinxman/master/autodir_options_c/scf__s_cholesky_tolerance.html
index b2116aade2b..fc1f95b374b 100644
--- a/sphinxman/master/autodir_options_c/scf__s_cholesky_tolerance.html
+++ b/sphinxman/master/autodir_options_c/scf__s_cholesky_tolerance.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__s_cholesky_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__s_cholesky_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__s_orthogonalization.html b/sphinxman/master/autodir_options_c/scf__s_orthogonalization.html
index 72def8eb077..345d145a100 100644
--- a/sphinxman/master/autodir_options_c/scf__s_orthogonalization.html
+++ b/sphinxman/master/autodir_options_c/scf__s_orthogonalization.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__s_orthogonalization.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__s_orthogonalization.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__s_tolerance.html b/sphinxman/master/autodir_options_c/scf__s_tolerance.html
index afd91a212a7..32f4b0fc075 100644
--- a/sphinxman/master/autodir_options_c/scf__s_tolerance.html
+++ b/sphinxman/master/autodir_options_c/scf__s_tolerance.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__s_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__s_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__sad_chol_tolerance.html b/sphinxman/master/autodir_options_c/scf__sad_chol_tolerance.html
index 254a438e3ca..4519eecda1a 100644
--- a/sphinxman/master/autodir_options_c/scf__sad_chol_tolerance.html
+++ b/sphinxman/master/autodir_options_c/scf__sad_chol_tolerance.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__sad_chol_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__sad_chol_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__sad_d_convergence.html b/sphinxman/master/autodir_options_c/scf__sad_d_convergence.html
index 3cc3f28fa42..c2c42cb84c0 100644
--- a/sphinxman/master/autodir_options_c/scf__sad_d_convergence.html
+++ b/sphinxman/master/autodir_options_c/scf__sad_d_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__sad_d_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__sad_d_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__sad_e_convergence.html b/sphinxman/master/autodir_options_c/scf__sad_e_convergence.html
index edd71c66638..a1f0eaf3b45 100644
--- a/sphinxman/master/autodir_options_c/scf__sad_e_convergence.html
+++ b/sphinxman/master/autodir_options_c/scf__sad_e_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__sad_e_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__sad_e_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__sad_frac_occ.html b/sphinxman/master/autodir_options_c/scf__sad_frac_occ.html
index 5ba32d22ca3..97e7ecb8112 100644
--- a/sphinxman/master/autodir_options_c/scf__sad_frac_occ.html
+++ b/sphinxman/master/autodir_options_c/scf__sad_frac_occ.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__sad_frac_occ.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__sad_frac_occ.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__sad_maxiter.html b/sphinxman/master/autodir_options_c/scf__sad_maxiter.html
index d5804e14d3f..eb267417c87 100644
--- a/sphinxman/master/autodir_options_c/scf__sad_maxiter.html
+++ b/sphinxman/master/autodir_options_c/scf__sad_maxiter.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__sad_maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__sad_maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__sad_print.html b/sphinxman/master/autodir_options_c/scf__sad_print.html
index 6a320599422..d3a89bce87f 100644
--- a/sphinxman/master/autodir_options_c/scf__sad_print.html
+++ b/sphinxman/master/autodir_options_c/scf__sad_print.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__sad_print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__sad_print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__sad_scf_type.html b/sphinxman/master/autodir_options_c/scf__sad_scf_type.html
index 0658d5bfc47..ce57f7c3555 100644
--- a/sphinxman/master/autodir_options_c/scf__sad_scf_type.html
+++ b/sphinxman/master/autodir_options_c/scf__sad_scf_type.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__sad_scf_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__sad_scf_type.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__sad_spin_average.html b/sphinxman/master/autodir_options_c/scf__sad_spin_average.html
index 635e0e2f66b..bc7cb182905 100644
--- a/sphinxman/master/autodir_options_c/scf__sad_spin_average.html
+++ b/sphinxman/master/autodir_options_c/scf__sad_spin_average.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__sad_spin_average.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__sad_spin_average.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__sapgau_basis.html b/sphinxman/master/autodir_options_c/scf__sapgau_basis.html
index 27946c9ffc3..447466c50bc 100644
--- a/sphinxman/master/autodir_options_c/scf__sapgau_basis.html
+++ b/sphinxman/master/autodir_options_c/scf__sapgau_basis.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__sapgau_basis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__sapgau_basis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__sapt.html b/sphinxman/master/autodir_options_c/scf__sapt.html
index 244eba38940..9e4e35df0b0 100644
--- a/sphinxman/master/autodir_options_c/scf__sapt.html
+++ b/sphinxman/master/autodir_options_c/scf__sapt.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__sapt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__sapt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__save_jk.html b/sphinxman/master/autodir_options_c/scf__save_jk.html
index 72eedfc3609..161c3330012 100644
--- a/sphinxman/master/autodir_options_c/scf__save_jk.html
+++ b/sphinxman/master/autodir_options_c/scf__save_jk.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__save_jk.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__save_jk.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__save_uhf_nos.html b/sphinxman/master/autodir_options_c/scf__save_uhf_nos.html
index 26d92885c3d..181bb0d286a 100644
--- a/sphinxman/master/autodir_options_c/scf__save_uhf_nos.html
+++ b/sphinxman/master/autodir_options_c/scf__save_uhf_nos.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__save_uhf_nos.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__save_uhf_nos.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__scf_initial_accelerator.html b/sphinxman/master/autodir_options_c/scf__scf_initial_accelerator.html
index 1033be6187a..160de25cc97 100644
--- a/sphinxman/master/autodir_options_c/scf__scf_initial_accelerator.html
+++ b/sphinxman/master/autodir_options_c/scf__scf_initial_accelerator.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__scf_initial_accelerator.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__scf_initial_accelerator.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__scf_initial_finish_diis_transition.html b/sphinxman/master/autodir_options_c/scf__scf_initial_finish_diis_transition.html
index b07213fa150..00b2166c7a1 100644
--- a/sphinxman/master/autodir_options_c/scf__scf_initial_finish_diis_transition.html
+++ b/sphinxman/master/autodir_options_c/scf__scf_initial_finish_diis_transition.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__scf_initial_finish_diis_transition.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__scf_initial_finish_diis_transition.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__scf_initial_start_diis_transition.html b/sphinxman/master/autodir_options_c/scf__scf_initial_start_diis_transition.html
index 12e0f70963f..4f337a0fe84 100644
--- a/sphinxman/master/autodir_options_c/scf__scf_initial_start_diis_transition.html
+++ b/sphinxman/master/autodir_options_c/scf__scf_initial_start_diis_transition.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__scf_initial_start_diis_transition.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__scf_initial_start_diis_transition.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__scf_mem_safety_factor.html b/sphinxman/master/autodir_options_c/scf__scf_mem_safety_factor.html
index 47ed88fe16c..d639e89949a 100644
--- a/sphinxman/master/autodir_options_c/scf__scf_mem_safety_factor.html
+++ b/sphinxman/master/autodir_options_c/scf__scf_mem_safety_factor.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__scf_mem_safety_factor.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__scf_mem_safety_factor.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__scf_properties.html b/sphinxman/master/autodir_options_c/scf__scf_properties.html
index 987d146151c..b7a42786661 100644
--- a/sphinxman/master/autodir_options_c/scf__scf_properties.html
+++ b/sphinxman/master/autodir_options_c/scf__scf_properties.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__scf_properties.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__scf_properties.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__scf_subtype.html b/sphinxman/master/autodir_options_c/scf__scf_subtype.html
index 385af7a9dce..cf3ba9046b9 100644
--- a/sphinxman/master/autodir_options_c/scf__scf_subtype.html
+++ b/sphinxman/master/autodir_options_c/scf__scf_subtype.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__scf_subtype.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__scf_subtype.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__snlink_basis_tolerance.html b/sphinxman/master/autodir_options_c/scf__snlink_basis_tolerance.html
index 11a1f44421d..eef4c05d2c1 100644
--- a/sphinxman/master/autodir_options_c/scf__snlink_basis_tolerance.html
+++ b/sphinxman/master/autodir_options_c/scf__snlink_basis_tolerance.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__snlink_basis_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__snlink_basis_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__snlink_density_tolerance.html b/sphinxman/master/autodir_options_c/scf__snlink_density_tolerance.html
index db40b7c8f3c..dfc866e15e5 100644
--- a/sphinxman/master/autodir_options_c/scf__snlink_density_tolerance.html
+++ b/sphinxman/master/autodir_options_c/scf__snlink_density_tolerance.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__snlink_density_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__snlink_density_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__snlink_force_cartesian.html b/sphinxman/master/autodir_options_c/scf__snlink_force_cartesian.html
index e14a6bd115a..2002ba1e6f1 100644
--- a/sphinxman/master/autodir_options_c/scf__snlink_force_cartesian.html
+++ b/sphinxman/master/autodir_options_c/scf__snlink_force_cartesian.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__snlink_force_cartesian.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__snlink_force_cartesian.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__snlink_gpu_mem.html b/sphinxman/master/autodir_options_c/scf__snlink_gpu_mem.html
index a87a3c4efe1..61cdc3758a8 100644
--- a/sphinxman/master/autodir_options_c/scf__snlink_gpu_mem.html
+++ b/sphinxman/master/autodir_options_c/scf__snlink_gpu_mem.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__snlink_gpu_mem.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__snlink_gpu_mem.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__snlink_grid_batch_size.html b/sphinxman/master/autodir_options_c/scf__snlink_grid_batch_size.html
index 9c6a19eea69..237fe410ce9 100644
--- a/sphinxman/master/autodir_options_c/scf__snlink_grid_batch_size.html
+++ b/sphinxman/master/autodir_options_c/scf__snlink_grid_batch_size.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__snlink_grid_batch_size.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__snlink_grid_batch_size.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__snlink_integrator_kernel.html b/sphinxman/master/autodir_options_c/scf__snlink_integrator_kernel.html
index 019a9e24f4e..4d3f1ed17ca 100644
--- a/sphinxman/master/autodir_options_c/scf__snlink_integrator_kernel.html
+++ b/sphinxman/master/autodir_options_c/scf__snlink_integrator_kernel.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__snlink_integrator_kernel.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__snlink_integrator_kernel.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__snlink_ints_tolerance.html b/sphinxman/master/autodir_options_c/scf__snlink_ints_tolerance.html
index 66322802a3a..d1b5ef71dcf 100644
--- a/sphinxman/master/autodir_options_c/scf__snlink_ints_tolerance.html
+++ b/sphinxman/master/autodir_options_c/scf__snlink_ints_tolerance.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__snlink_ints_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__snlink_ints_tolerance.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__snlink_load_balancer_kernel.html b/sphinxman/master/autodir_options_c/scf__snlink_load_balancer_kernel.html
index f3d4835bfda..f95228c4b9a 100644
--- a/sphinxman/master/autodir_options_c/scf__snlink_load_balancer_kernel.html
+++ b/sphinxman/master/autodir_options_c/scf__snlink_load_balancer_kernel.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__snlink_load_balancer_kernel.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__snlink_load_balancer_kernel.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__snlink_lwd_kernel.html b/sphinxman/master/autodir_options_c/scf__snlink_lwd_kernel.html
index 8b62151d3ed..4619b1ac496 100644
--- a/sphinxman/master/autodir_options_c/scf__snlink_lwd_kernel.html
+++ b/sphinxman/master/autodir_options_c/scf__snlink_lwd_kernel.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__snlink_lwd_kernel.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__snlink_lwd_kernel.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__snlink_mol_weights_kernel.html b/sphinxman/master/autodir_options_c/scf__snlink_mol_weights_kernel.html
index 1cad74a9ada..ccf39305041 100644
--- a/sphinxman/master/autodir_options_c/scf__snlink_mol_weights_kernel.html
+++ b/sphinxman/master/autodir_options_c/scf__snlink_mol_weights_kernel.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__snlink_mol_weights_kernel.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__snlink_mol_weights_kernel.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__snlink_pruning_scheme.html b/sphinxman/master/autodir_options_c/scf__snlink_pruning_scheme.html
index b44242032b4..ad76e0deb48 100644
--- a/sphinxman/master/autodir_options_c/scf__snlink_pruning_scheme.html
+++ b/sphinxman/master/autodir_options_c/scf__snlink_pruning_scheme.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__snlink_pruning_scheme.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__snlink_pruning_scheme.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__snlink_radial_points.html b/sphinxman/master/autodir_options_c/scf__snlink_radial_points.html
index c342be17bc1..8d63b6049c1 100644
--- a/sphinxman/master/autodir_options_c/scf__snlink_radial_points.html
+++ b/sphinxman/master/autodir_options_c/scf__snlink_radial_points.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__snlink_radial_points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__snlink_radial_points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__snlink_radial_scheme.html b/sphinxman/master/autodir_options_c/scf__snlink_radial_scheme.html
index bf888714aed..c754cec35e8 100644
--- a/sphinxman/master/autodir_options_c/scf__snlink_radial_scheme.html
+++ b/sphinxman/master/autodir_options_c/scf__snlink_radial_scheme.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__snlink_radial_scheme.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__snlink_radial_scheme.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__snlink_reduction_kernel.html b/sphinxman/master/autodir_options_c/scf__snlink_reduction_kernel.html
index 8f2135c03c4..02093c04c15 100644
--- a/sphinxman/master/autodir_options_c/scf__snlink_reduction_kernel.html
+++ b/sphinxman/master/autodir_options_c/scf__snlink_reduction_kernel.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__snlink_reduction_kernel.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__snlink_reduction_kernel.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__snlink_spherical_points.html b/sphinxman/master/autodir_options_c/scf__snlink_spherical_points.html
index 21ab3ddb04e..5e20e9b45c0 100644
--- a/sphinxman/master/autodir_options_c/scf__snlink_spherical_points.html
+++ b/sphinxman/master/autodir_options_c/scf__snlink_spherical_points.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__snlink_spherical_points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__snlink_spherical_points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__snlink_use_debug_grid.html b/sphinxman/master/autodir_options_c/scf__snlink_use_debug_grid.html
index d2830da369a..1e6f65b5abb 100644
--- a/sphinxman/master/autodir_options_c/scf__snlink_use_debug_grid.html
+++ b/sphinxman/master/autodir_options_c/scf__snlink_use_debug_grid.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__snlink_use_debug_grid.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__snlink_use_debug_grid.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__snlink_use_gpu.html b/sphinxman/master/autodir_options_c/scf__snlink_use_gpu.html
index 7b328837d96..a03ee32623d 100644
--- a/sphinxman/master/autodir_options_c/scf__snlink_use_gpu.html
+++ b/sphinxman/master/autodir_options_c/scf__snlink_use_gpu.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__snlink_use_gpu.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__snlink_use_gpu.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__solver_convergence.html b/sphinxman/master/autodir_options_c/scf__solver_convergence.html
index 43ebcc4ffdb..e4e431ae0dc 100644
--- a/sphinxman/master/autodir_options_c/scf__solver_convergence.html
+++ b/sphinxman/master/autodir_options_c/scf__solver_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__solver_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__solver_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__solver_maxiter.html b/sphinxman/master/autodir_options_c/scf__solver_maxiter.html
index 8db26f8be3f..5a3c2e06358 100644
--- a/sphinxman/master/autodir_options_c/scf__solver_maxiter.html
+++ b/sphinxman/master/autodir_options_c/scf__solver_maxiter.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__solver_maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__solver_maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__solver_n_guess.html b/sphinxman/master/autodir_options_c/scf__solver_n_guess.html
index 8292127d6ab..7ef538569ce 100644
--- a/sphinxman/master/autodir_options_c/scf__solver_n_guess.html
+++ b/sphinxman/master/autodir_options_c/scf__solver_n_guess.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__solver_n_guess.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__solver_n_guess.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__solver_n_root.html b/sphinxman/master/autodir_options_c/scf__solver_n_root.html
index d07b46df7e6..d3309c5330b 100644
--- a/sphinxman/master/autodir_options_c/scf__solver_n_root.html
+++ b/sphinxman/master/autodir_options_c/scf__solver_n_root.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__solver_n_root.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__solver_n_root.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__solver_roots_per_irrep.html b/sphinxman/master/autodir_options_c/scf__solver_roots_per_irrep.html
index f9c761c4e1e..0a708559629 100644
--- a/sphinxman/master/autodir_options_c/scf__solver_roots_per_irrep.html
+++ b/sphinxman/master/autodir_options_c/scf__solver_roots_per_irrep.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__solver_roots_per_irrep.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__solver_roots_per_irrep.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__soscf.html b/sphinxman/master/autodir_options_c/scf__soscf.html
index 40d82a070ae..4ad94416001 100644
--- a/sphinxman/master/autodir_options_c/scf__soscf.html
+++ b/sphinxman/master/autodir_options_c/scf__soscf.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__soscf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__soscf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__soscf_conv.html b/sphinxman/master/autodir_options_c/scf__soscf_conv.html
index 68301662018..067153b05b1 100644
--- a/sphinxman/master/autodir_options_c/scf__soscf_conv.html
+++ b/sphinxman/master/autodir_options_c/scf__soscf_conv.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__soscf_conv.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__soscf_conv.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__soscf_max_iter.html b/sphinxman/master/autodir_options_c/scf__soscf_max_iter.html
index 4a434868eb4..d4a027665ac 100644
--- a/sphinxman/master/autodir_options_c/scf__soscf_max_iter.html
+++ b/sphinxman/master/autodir_options_c/scf__soscf_max_iter.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__soscf_max_iter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__soscf_max_iter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__soscf_min_iter.html b/sphinxman/master/autodir_options_c/scf__soscf_min_iter.html
index b653d638223..570c56f8ee4 100644
--- a/sphinxman/master/autodir_options_c/scf__soscf_min_iter.html
+++ b/sphinxman/master/autodir_options_c/scf__soscf_min_iter.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__soscf_min_iter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__soscf_min_iter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__soscf_print.html b/sphinxman/master/autodir_options_c/scf__soscf_print.html
index 9395647768c..8ad9cc896aa 100644
--- a/sphinxman/master/autodir_options_c/scf__soscf_print.html
+++ b/sphinxman/master/autodir_options_c/scf__soscf_print.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__soscf_print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__soscf_print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__soscf_start_convergence.html b/sphinxman/master/autodir_options_c/scf__soscf_start_convergence.html
index e736ec015ee..7987eb5ecf3 100644
--- a/sphinxman/master/autodir_options_c/scf__soscf_start_convergence.html
+++ b/sphinxman/master/autodir_options_c/scf__soscf_start_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__soscf_start_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__soscf_start_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__stability_analysis.html b/sphinxman/master/autodir_options_c/scf__stability_analysis.html
index d2c5a698268..4ac346ddf8a 100644
--- a/sphinxman/master/autodir_options_c/scf__stability_analysis.html
+++ b/sphinxman/master/autodir_options_c/scf__stability_analysis.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__stability_analysis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__stability_analysis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__tdscf_coeff_cutoff.html b/sphinxman/master/autodir_options_c/scf__tdscf_coeff_cutoff.html
index 9c4abdbea44..111554a78cb 100644
--- a/sphinxman/master/autodir_options_c/scf__tdscf_coeff_cutoff.html
+++ b/sphinxman/master/autodir_options_c/scf__tdscf_coeff_cutoff.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__tdscf_coeff_cutoff.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__tdscf_coeff_cutoff.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__tdscf_guess.html b/sphinxman/master/autodir_options_c/scf__tdscf_guess.html
index 4d1ff2da88f..c5269d6d687 100644
--- a/sphinxman/master/autodir_options_c/scf__tdscf_guess.html
+++ b/sphinxman/master/autodir_options_c/scf__tdscf_guess.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__tdscf_guess.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__tdscf_guess.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__tdscf_maxiter.html b/sphinxman/master/autodir_options_c/scf__tdscf_maxiter.html
index dbd7c1ddad7..596168f436f 100644
--- a/sphinxman/master/autodir_options_c/scf__tdscf_maxiter.html
+++ b/sphinxman/master/autodir_options_c/scf__tdscf_maxiter.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__tdscf_maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__tdscf_maxiter.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__tdscf_print.html b/sphinxman/master/autodir_options_c/scf__tdscf_print.html
index 6e36f176038..58031bf79d4 100644
--- a/sphinxman/master/autodir_options_c/scf__tdscf_print.html
+++ b/sphinxman/master/autodir_options_c/scf__tdscf_print.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__tdscf_print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__tdscf_print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__tdscf_r_convergence.html b/sphinxman/master/autodir_options_c/scf__tdscf_r_convergence.html
index 0f30537f831..90e6124b95a 100644
--- a/sphinxman/master/autodir_options_c/scf__tdscf_r_convergence.html
+++ b/sphinxman/master/autodir_options_c/scf__tdscf_r_convergence.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__tdscf_r_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__tdscf_r_convergence.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__tdscf_states.html b/sphinxman/master/autodir_options_c/scf__tdscf_states.html
index edea33146e8..756af784e2a 100644
--- a/sphinxman/master/autodir_options_c/scf__tdscf_states.html
+++ b/sphinxman/master/autodir_options_c/scf__tdscf_states.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__tdscf_states.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__tdscf_states.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__tdscf_tda.html b/sphinxman/master/autodir_options_c/scf__tdscf_tda.html
index b8f4b6510cb..dcca81cfdd8 100644
--- a/sphinxman/master/autodir_options_c/scf__tdscf_tda.html
+++ b/sphinxman/master/autodir_options_c/scf__tdscf_tda.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__tdscf_tda.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__tdscf_tda.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__tdscf_tdm_print.html b/sphinxman/master/autodir_options_c/scf__tdscf_tdm_print.html
index 05254dc8062..1b4e01e481a 100644
--- a/sphinxman/master/autodir_options_c/scf__tdscf_tdm_print.html
+++ b/sphinxman/master/autodir_options_c/scf__tdscf_tdm_print.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__tdscf_tdm_print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__tdscf_tdm_print.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__tdscf_triplets.html b/sphinxman/master/autodir_options_c/scf__tdscf_triplets.html
index 5f4c8522958..3a6623bb8e4 100644
--- a/sphinxman/master/autodir_options_c/scf__tdscf_triplets.html
+++ b/sphinxman/master/autodir_options_c/scf__tdscf_triplets.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__tdscf_triplets.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__tdscf_triplets.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__theta_points.html b/sphinxman/master/autodir_options_c/scf__theta_points.html
index c584bae3afe..0fe77438628 100644
--- a/sphinxman/master/autodir_options_c/scf__theta_points.html
+++ b/sphinxman/master/autodir_options_c/scf__theta_points.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__theta_points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__theta_points.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__thickness.html b/sphinxman/master/autodir_options_c/scf__thickness.html
index 8a53a75334a..a9843f8e443 100644
--- a/sphinxman/master/autodir_options_c/scf__thickness.html
+++ b/sphinxman/master/autodir_options_c/scf__thickness.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__thickness.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__thickness.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__tile_sz.html b/sphinxman/master/autodir_options_c/scf__tile_sz.html
index 1a0122ef23f..a79a865f920 100644
--- a/sphinxman/master/autodir_options_c/scf__tile_sz.html
+++ b/sphinxman/master/autodir_options_c/scf__tile_sz.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__tile_sz.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__tile_sz.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__uhf_noons.html b/sphinxman/master/autodir_options_c/scf__uhf_noons.html
index aa82ba15cac..b6997dd86e8 100644
--- a/sphinxman/master/autodir_options_c/scf__uhf_noons.html
+++ b/sphinxman/master/autodir_options_c/scf__uhf_noons.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__uhf_noons.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__uhf_noons.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__wcombine.html b/sphinxman/master/autodir_options_c/scf__wcombine.html
index 78471313f0a..a4af28d4ebc 100644
--- a/sphinxman/master/autodir_options_c/scf__wcombine.html
+++ b/sphinxman/master/autodir_options_c/scf__wcombine.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__wcombine.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__wcombine.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/scf__wfn.html b/sphinxman/master/autodir_options_c/scf__wfn.html
index 8179e33b139..f40e1fda60f 100644
--- a/sphinxman/master/autodir_options_c/scf__wfn.html
+++ b/sphinxman/master/autodir_options_c/scf__wfn.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__wfn.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/scf__wfn.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/thermo__p.html b/sphinxman/master/autodir_options_c/thermo__p.html
index 9f874d7c763..6504bb0416e 100644
--- a/sphinxman/master/autodir_options_c/thermo__p.html
+++ b/sphinxman/master/autodir_options_c/thermo__p.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/thermo__p.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/thermo__p.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/thermo__rotational_symmetry_number.html b/sphinxman/master/autodir_options_c/thermo__rotational_symmetry_number.html
index db3d6d7cad7..3d28a860139 100644
--- a/sphinxman/master/autodir_options_c/thermo__rotational_symmetry_number.html
+++ b/sphinxman/master/autodir_options_c/thermo__rotational_symmetry_number.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/thermo__rotational_symmetry_number.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/thermo__rotational_symmetry_number.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_options_c/thermo__t.html b/sphinxman/master/autodir_options_c/thermo__t.html
index 449c46bc6b6..1f9ffd01839 100644
--- a/sphinxman/master/autodir_options_c/thermo__t.html
+++ b/sphinxman/master/autodir_options_c/thermo__t.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/thermo__t.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_options_c/thermo__t.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_psivariables/module__adc.html b/sphinxman/master/autodir_psivariables/module__adc.html
index 55c64ae121b..65f85cc94a7 100644
--- a/sphinxman/master/autodir_psivariables/module__adc.html
+++ b/sphinxman/master/autodir_psivariables/module__adc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_psivariables/module__adc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -213,7 +213,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_psivariables/module__adc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -228,7 +228,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_psivariables/module__ccenergy.html b/sphinxman/master/autodir_psivariables/module__ccenergy.html
index f0d83648530..d53977f15d8 100644
--- a/sphinxman/master/autodir_psivariables/module__ccenergy.html
+++ b/sphinxman/master/autodir_psivariables/module__ccenergy.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_psivariables/module__ccenergy.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -315,7 +315,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_psivariables/module__ccenergy.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -330,7 +330,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_psivariables/module__cfour.html b/sphinxman/master/autodir_psivariables/module__cfour.html
index 52d5ae14fa5..a6f97ba5ce7 100644
--- a/sphinxman/master/autodir_psivariables/module__cfour.html
+++ b/sphinxman/master/autodir_psivariables/module__cfour.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_psivariables/module__cfour.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -221,7 +221,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_psivariables/module__cfour.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -236,7 +236,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_psivariables/module__dct.html b/sphinxman/master/autodir_psivariables/module__dct.html
index b2f970ccc18..385a3522fa1 100644
--- a/sphinxman/master/autodir_psivariables/module__dct.html
+++ b/sphinxman/master/autodir_psivariables/module__dct.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_psivariables/module__dct.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -201,7 +201,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_psivariables/module__dct.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -216,7 +216,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_psivariables/module__ddx.html b/sphinxman/master/autodir_psivariables/module__ddx.html
index 715a257520b..858316fc68e 100644
--- a/sphinxman/master/autodir_psivariables/module__ddx.html
+++ b/sphinxman/master/autodir_psivariables/module__ddx.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_psivariables/module__ddx.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -195,7 +195,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_psivariables/module__ddx.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -210,7 +210,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_psivariables/module__detci.html b/sphinxman/master/autodir_psivariables/module__detci.html
index 56294c65c0f..c66697835fc 100644
--- a/sphinxman/master/autodir_psivariables/module__detci.html
+++ b/sphinxman/master/autodir_psivariables/module__detci.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_psivariables/module__detci.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -223,7 +223,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_psivariables/module__detci.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -238,7 +238,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_psivariables/module__dfmp2.html b/sphinxman/master/autodir_psivariables/module__dfmp2.html
index c3f352bd51f..a9b5468709e 100644
--- a/sphinxman/master/autodir_psivariables/module__dfmp2.html
+++ b/sphinxman/master/autodir_psivariables/module__dfmp2.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_psivariables/module__dfmp2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -206,7 +206,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_psivariables/module__dfmp2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -221,7 +221,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_psivariables/module__dfocc.html b/sphinxman/master/autodir_psivariables/module__dfocc.html
index 013d24847ea..064cd40ea0b 100644
--- a/sphinxman/master/autodir_psivariables/module__dfocc.html
+++ b/sphinxman/master/autodir_psivariables/module__dfocc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_psivariables/module__dfocc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -278,7 +278,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_psivariables/module__dfocc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -293,7 +293,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_psivariables/module__dlpno.html b/sphinxman/master/autodir_psivariables/module__dlpno.html
index 05493a042a3..22f316846cc 100644
--- a/sphinxman/master/autodir_psivariables/module__dlpno.html
+++ b/sphinxman/master/autodir_psivariables/module__dlpno.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_psivariables/module__dlpno.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -207,7 +207,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_psivariables/module__dlpno.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -222,7 +222,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_psivariables/module__dmrg.html b/sphinxman/master/autodir_psivariables/module__dmrg.html
index 686a7e58a2b..f842dc613ee 100644
--- a/sphinxman/master/autodir_psivariables/module__dmrg.html
+++ b/sphinxman/master/autodir_psivariables/module__dmrg.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_psivariables/module__dmrg.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -197,7 +197,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_psivariables/module__dmrg.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -212,7 +212,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_psivariables/module__efp.html b/sphinxman/master/autodir_psivariables/module__efp.html
index 7820a3c1b58..022aacf2742 100644
--- a/sphinxman/master/autodir_psivariables/module__efp.html
+++ b/sphinxman/master/autodir_psivariables/module__efp.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_psivariables/module__efp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -201,7 +201,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_psivariables/module__efp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -216,7 +216,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_psivariables/module__fisapt.html b/sphinxman/master/autodir_psivariables/module__fisapt.html
index e07599b1779..a8bf472c485 100644
--- a/sphinxman/master/autodir_psivariables/module__fisapt.html
+++ b/sphinxman/master/autodir_psivariables/module__fisapt.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_psivariables/module__fisapt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -223,7 +223,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_psivariables/module__fisapt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -238,7 +238,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_psivariables/module__fnocc.html b/sphinxman/master/autodir_psivariables/module__fnocc.html
index 95172cb6716..255a8690c5c 100644
--- a/sphinxman/master/autodir_psivariables/module__fnocc.html
+++ b/sphinxman/master/autodir_psivariables/module__fnocc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_psivariables/module__fnocc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -306,7 +306,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_psivariables/module__fnocc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -321,7 +321,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_psivariables/module__gdma.html b/sphinxman/master/autodir_psivariables/module__gdma.html
index 7873bc9e4f7..6a35348e204 100644
--- a/sphinxman/master/autodir_psivariables/module__gdma.html
+++ b/sphinxman/master/autodir_psivariables/module__gdma.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_psivariables/module__gdma.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -196,7 +196,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_psivariables/module__gdma.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -211,7 +211,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_psivariables/module__mcscf.html b/sphinxman/master/autodir_psivariables/module__mcscf.html
index 7eafe3f8069..e723f5fd4ac 100644
--- a/sphinxman/master/autodir_psivariables/module__mcscf.html
+++ b/sphinxman/master/autodir_psivariables/module__mcscf.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_psivariables/module__mcscf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -199,7 +199,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_psivariables/module__mcscf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_psivariables/module__mrcc.html b/sphinxman/master/autodir_psivariables/module__mrcc.html
index 18194316cd5..00c37ba33ee 100644
--- a/sphinxman/master/autodir_psivariables/module__mrcc.html
+++ b/sphinxman/master/autodir_psivariables/module__mrcc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_psivariables/module__mrcc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -246,7 +246,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_psivariables/module__mrcc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -261,7 +261,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_psivariables/module__occ.html b/sphinxman/master/autodir_psivariables/module__occ.html
index 50309039913..3efbc4c4002 100644
--- a/sphinxman/master/autodir_psivariables/module__occ.html
+++ b/sphinxman/master/autodir_psivariables/module__occ.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_psivariables/module__occ.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -290,7 +290,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_psivariables/module__occ.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -305,7 +305,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_psivariables/module__oeprop.html b/sphinxman/master/autodir_psivariables/module__oeprop.html
index 5e9d10c1621..05b289eabb3 100644
--- a/sphinxman/master/autodir_psivariables/module__oeprop.html
+++ b/sphinxman/master/autodir_psivariables/module__oeprop.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_psivariables/module__oeprop.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -215,7 +215,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_psivariables/module__oeprop.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -230,7 +230,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_psivariables/module__pcm.html b/sphinxman/master/autodir_psivariables/module__pcm.html
index 155a989f406..2f37f8132c0 100644
--- a/sphinxman/master/autodir_psivariables/module__pcm.html
+++ b/sphinxman/master/autodir_psivariables/module__pcm.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_psivariables/module__pcm.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -195,7 +195,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_psivariables/module__pcm.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -210,7 +210,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_psivariables/module__pe.html b/sphinxman/master/autodir_psivariables/module__pe.html
index ad4b70f6e1e..6e38ed53c55 100644
--- a/sphinxman/master/autodir_psivariables/module__pe.html
+++ b/sphinxman/master/autodir_psivariables/module__pe.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_psivariables/module__pe.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -195,7 +195,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_psivariables/module__pe.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -210,7 +210,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_psivariables/module__psimrcc.html b/sphinxman/master/autodir_psivariables/module__psimrcc.html
index c8a44516f32..56659a77bf0 100644
--- a/sphinxman/master/autodir_psivariables/module__psimrcc.html
+++ b/sphinxman/master/autodir_psivariables/module__psimrcc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_psivariables/module__psimrcc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -198,7 +198,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_psivariables/module__psimrcc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -213,7 +213,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_psivariables/module__sapt.html b/sphinxman/master/autodir_psivariables/module__sapt.html
index 7a0e179d863..c3a424bb5f2 100644
--- a/sphinxman/master/autodir_psivariables/module__sapt.html
+++ b/sphinxman/master/autodir_psivariables/module__sapt.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_psivariables/module__sapt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -313,7 +313,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_psivariables/module__sapt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -328,7 +328,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_psivariables/module__scf.html b/sphinxman/master/autodir_psivariables/module__scf.html
index cd04f4df81d..c8b8aaf371e 100644
--- a/sphinxman/master/autodir_psivariables/module__scf.html
+++ b/sphinxman/master/autodir_psivariables/module__scf.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_psivariables/module__scf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -243,7 +243,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_psivariables/module__scf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -258,7 +258,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodir_psivariables/module__thermo.html b/sphinxman/master/autodir_psivariables/module__thermo.html
index 2957465208a..bc1ba3484ae 100644
--- a/sphinxman/master/autodir_psivariables/module__thermo.html
+++ b/sphinxman/master/autodir_psivariables/module__thermo.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="../_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="../_static/documentation_options.js?v=7accc8dd"></script>
     <script src="../_static/doctools.js?v=9a2dae69"></script>
     <script src="../_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_psivariables/module__thermo.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -201,7 +201,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodir_psivariables/module__thermo.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="../index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -216,7 +216,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodoc_available_databases.html b/sphinxman/master/autodoc_available_databases.html
index 648f51432dc..e3acc1f572c 100644
--- a/sphinxman/master/autodoc_available_databases.html
+++ b/sphinxman/master/autodoc_available_databases.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_available_databases.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -871,7 +871,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_available_databases.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -886,7 +886,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodoc_available_efpfrag.html b/sphinxman/master/autodoc_available_efpfrag.html
index 0cf3de2dbe4..86dc098730d 100644
--- a/sphinxman/master/autodoc_available_efpfrag.html
+++ b/sphinxman/master/autodoc_available_efpfrag.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_available_efpfrag.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -187,7 +187,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_available_efpfrag.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -202,7 +202,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodoc_basissets_byfamily.html b/sphinxman/master/autodoc_basissets_byfamily.html
index e6facb67654..2e61f17d503 100644
--- a/sphinxman/master/autodoc_basissets_byfamily.html
+++ b/sphinxman/master/autodoc_basissets_byfamily.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_basissets_byfamily.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -2210,7 +2210,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_basissets_byfamily.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -2225,7 +2225,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodoc_dft_all.html b/sphinxman/master/autodoc_dft_all.html
index 4b966072d01..7b7415ac244 100644
--- a/sphinxman/master/autodoc_dft_all.html
+++ b/sphinxman/master/autodoc_dft_all.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_dft_all.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -6002,7 +6002,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_dft_all.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -6017,7 +6017,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodoc_dft_dhybrid.html b/sphinxman/master/autodoc_dft_dhybrid.html
index 64188e7eed6..a86f1c3bce0 100644
--- a/sphinxman/master/autodoc_dft_dhybrid.html
+++ b/sphinxman/master/autodoc_dft_dhybrid.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_dft_dhybrid.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -854,7 +854,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_dft_dhybrid.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -869,7 +869,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodoc_dft_disp.html b/sphinxman/master/autodoc_dft_disp.html
index f73fbd20775..16dd8829f99 100644
--- a/sphinxman/master/autodoc_dft_disp.html
+++ b/sphinxman/master/autodoc_dft_disp.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_dft_disp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -3590,7 +3590,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_dft_disp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -3605,7 +3605,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodoc_dft_energy.html b/sphinxman/master/autodoc_dft_energy.html
index b89c57b3cda..4186c1ff3b4 100644
--- a/sphinxman/master/autodoc_dft_energy.html
+++ b/sphinxman/master/autodoc_dft_energy.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_dft_energy.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -2146,7 +2146,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_dft_energy.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -2161,7 +2161,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodoc_dft_gga.html b/sphinxman/master/autodoc_dft_gga.html
index cfefbffff2e..25593ebd00b 100644
--- a/sphinxman/master/autodoc_dft_gga.html
+++ b/sphinxman/master/autodoc_dft_gga.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_dft_gga.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1550,7 +1550,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_dft_gga.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1565,7 +1565,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodoc_dft_hybrid.html b/sphinxman/master/autodoc_dft_hybrid.html
index ddcdd74bc13..bb010c69667 100644
--- a/sphinxman/master/autodoc_dft_hybrid.html
+++ b/sphinxman/master/autodoc_dft_hybrid.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_dft_hybrid.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -3806,7 +3806,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_dft_hybrid.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -3821,7 +3821,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodoc_dft_lrc.html b/sphinxman/master/autodoc_dft_lrc.html
index b8ee4f5b173..1eda2a5c67c 100644
--- a/sphinxman/master/autodoc_dft_lrc.html
+++ b/sphinxman/master/autodoc_dft_lrc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_dft_lrc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -938,7 +938,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_dft_lrc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -953,7 +953,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodoc_dft_meta.html b/sphinxman/master/autodoc_dft_meta.html
index e13cd019a3c..925784217ca 100644
--- a/sphinxman/master/autodoc_dft_meta.html
+++ b/sphinxman/master/autodoc_dft_meta.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_dft_meta.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -2114,7 +2114,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_dft_meta.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -2129,7 +2129,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodoc_dft_opt.html b/sphinxman/master/autodoc_dft_opt.html
index 78ca09ffff5..6e419191a04 100644
--- a/sphinxman/master/autodoc_dft_opt.html
+++ b/sphinxman/master/autodoc_dft_opt.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_dft_opt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1300,7 +1300,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_dft_opt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1315,7 +1315,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodoc_glossary_options_c.html b/sphinxman/master/autodoc_glossary_options_c.html
index b10bdd5bc62..0f961906835 100644
--- a/sphinxman/master/autodoc_glossary_options_c.html
+++ b/sphinxman/master/autodoc_glossary_options_c.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_glossary_options_c.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -7797,7 +7797,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_glossary_options_c.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -7811,7 +7811,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodoc_options_c_bymodule.html b/sphinxman/master/autodoc_options_c_bymodule.html
index 158e3014ab9..e019820e8a2 100644
--- a/sphinxman/master/autodoc_options_c_bymodule.html
+++ b/sphinxman/master/autodoc_options_c_bymodule.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_options_c_bymodule.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -229,7 +229,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_options_c_bymodule.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -243,7 +243,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodoc_physconst.html b/sphinxman/master/autodoc_physconst.html
index 008186c8c0f..eea14812f80 100644
--- a/sphinxman/master/autodoc_physconst.html
+++ b/sphinxman/master/autodoc_physconst.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_physconst.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1648,7 +1648,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_physconst.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1662,7 +1662,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodoc_psi4bases.html b/sphinxman/master/autodoc_psi4bases.html
index 11166c9f0ca..63ff63bfb6e 100644
--- a/sphinxman/master/autodoc_psi4bases.html
+++ b/sphinxman/master/autodoc_psi4bases.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_psi4bases.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -41378,7 +41378,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_psi4bases.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -41393,7 +41393,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodoc_psifiles.html b/sphinxman/master/autodoc_psifiles.html
index fe6375e8dcc..7379673d7c8 100644
--- a/sphinxman/master/autodoc_psifiles.html
+++ b/sphinxman/master/autodoc_psifiles.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_psifiles.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -944,7 +944,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_psifiles.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -958,7 +958,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodoc_psivariables_bymodule.html b/sphinxman/master/autodoc_psivariables_bymodule.html
index f5907722515..c5011b19223 100644
--- a/sphinxman/master/autodoc_psivariables_bymodule.html
+++ b/sphinxman/master/autodoc_psivariables_bymodule.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_psivariables_bymodule.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -222,7 +222,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_psivariables_bymodule.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -236,7 +236,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodoc_testsuite_brianqc.html b/sphinxman/master/autodoc_testsuite_brianqc.html
index 8e1550fd9c6..e15544f6962 100644
--- a/sphinxman/master/autodoc_testsuite_brianqc.html
+++ b/sphinxman/master/autodoc_testsuite_brianqc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_testsuite_brianqc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -250,7 +250,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_testsuite_brianqc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -265,7 +265,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodoc_testsuite_cfour.html b/sphinxman/master/autodoc_testsuite_cfour.html
index 63a0dae6514..a5d937adb5d 100644
--- a/sphinxman/master/autodoc_testsuite_cfour.html
+++ b/sphinxman/master/autodoc_testsuite_cfour.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_testsuite_cfour.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -376,7 +376,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_testsuite_cfour.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -391,7 +391,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodoc_testsuite_chemps2.html b/sphinxman/master/autodoc_testsuite_chemps2.html
index 59635d36192..49cba6025f9 100644
--- a/sphinxman/master/autodoc_testsuite_chemps2.html
+++ b/sphinxman/master/autodoc_testsuite_chemps2.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_testsuite_chemps2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_testsuite_chemps2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -229,7 +229,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodoc_testsuite_cookbook.html b/sphinxman/master/autodoc_testsuite_cookbook.html
index 10999e09c78..cce94680e61 100644
--- a/sphinxman/master/autodoc_testsuite_cookbook.html
+++ b/sphinxman/master/autodoc_testsuite_cookbook.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_testsuite_cookbook.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -208,7 +208,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_testsuite_cookbook.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -223,7 +223,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodoc_testsuite_corepsi4.html b/sphinxman/master/autodoc_testsuite_corepsi4.html
index 6091ff7062f..bb7784049f8 100644
--- a/sphinxman/master/autodoc_testsuite_corepsi4.html
+++ b/sphinxman/master/autodoc_testsuite_corepsi4.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_testsuite_corepsi4.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1687,7 +1687,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_testsuite_corepsi4.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1702,7 +1702,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodoc_testsuite_dftd3.html b/sphinxman/master/autodoc_testsuite_dftd3.html
index 870b0f0ff6c..b348056c077 100644
--- a/sphinxman/master/autodoc_testsuite_dftd3.html
+++ b/sphinxman/master/autodoc_testsuite_dftd3.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_testsuite_dftd3.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_testsuite_dftd3.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -229,7 +229,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodoc_testsuite_dftd4.html b/sphinxman/master/autodoc_testsuite_dftd4.html
index f79d6043365..4d1d0b7e9cc 100644
--- a/sphinxman/master/autodoc_testsuite_dftd4.html
+++ b/sphinxman/master/autodoc_testsuite_dftd4.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_testsuite_dftd4.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -205,7 +205,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_testsuite_dftd4.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -220,7 +220,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodoc_testsuite_dkh.html b/sphinxman/master/autodoc_testsuite_dkh.html
index 867d18ccd36..ecb86b8b14c 100644
--- a/sphinxman/master/autodoc_testsuite_dkh.html
+++ b/sphinxman/master/autodoc_testsuite_dkh.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_testsuite_dkh.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -202,7 +202,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_testsuite_dkh.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -217,7 +217,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodoc_testsuite_gcp.html b/sphinxman/master/autodoc_testsuite_gcp.html
index b06267ee5ad..e698659e648 100644
--- a/sphinxman/master/autodoc_testsuite_gcp.html
+++ b/sphinxman/master/autodoc_testsuite_gcp.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_testsuite_gcp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -220,7 +220,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_testsuite_gcp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -235,7 +235,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodoc_testsuite_gdma.html b/sphinxman/master/autodoc_testsuite_gdma.html
index 0aa2d112421..0fe7bcd53e7 100644
--- a/sphinxman/master/autodoc_testsuite_gdma.html
+++ b/sphinxman/master/autodoc_testsuite_gdma.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_testsuite_gdma.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -202,7 +202,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_testsuite_gdma.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -217,7 +217,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodoc_testsuite_gpu_dfcc.html b/sphinxman/master/autodoc_testsuite_gpu_dfcc.html
index 45b38b5d9ee..fecd5585e33 100644
--- a/sphinxman/master/autodoc_testsuite_gpu_dfcc.html
+++ b/sphinxman/master/autodoc_testsuite_gpu_dfcc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_testsuite_gpu_dfcc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -205,7 +205,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_testsuite_gpu_dfcc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -220,7 +220,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodoc_testsuite_json.html b/sphinxman/master/autodoc_testsuite_json.html
index 14b713c85dd..4338627fc1b 100644
--- a/sphinxman/master/autodoc_testsuite_json.html
+++ b/sphinxman/master/autodoc_testsuite_json.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_testsuite_json.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -223,7 +223,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_testsuite_json.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -238,7 +238,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodoc_testsuite_libefp.html b/sphinxman/master/autodoc_testsuite_libefp.html
index b96fab3837d..93069825b00 100644
--- a/sphinxman/master/autodoc_testsuite_libefp.html
+++ b/sphinxman/master/autodoc_testsuite_libefp.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_testsuite_libefp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_testsuite_libefp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -229,7 +229,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodoc_testsuite_mrcc.html b/sphinxman/master/autodoc_testsuite_mrcc.html
index cd4e1a2fe11..4a55b0ce935 100644
--- a/sphinxman/master/autodoc_testsuite_mrcc.html
+++ b/sphinxman/master/autodoc_testsuite_mrcc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_testsuite_mrcc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_testsuite_mrcc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -229,7 +229,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodoc_testsuite_pcmsolver.html b/sphinxman/master/autodoc_testsuite_pcmsolver.html
index 2ecb9402b87..db37674dec5 100644
--- a/sphinxman/master/autodoc_testsuite_pcmsolver.html
+++ b/sphinxman/master/autodoc_testsuite_pcmsolver.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_testsuite_pcmsolver.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -226,7 +226,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_testsuite_pcmsolver.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -241,7 +241,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodoc_testsuite_psi4numpy.html b/sphinxman/master/autodoc_testsuite_psi4numpy.html
index c3c1f4f7290..2d35bc59e82 100644
--- a/sphinxman/master/autodoc_testsuite_psi4numpy.html
+++ b/sphinxman/master/autodoc_testsuite_psi4numpy.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_testsuite_psi4numpy.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -217,7 +217,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_testsuite_psi4numpy.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -232,7 +232,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodoc_testsuite_python.html b/sphinxman/master/autodoc_testsuite_python.html
index 6aa24969536..8b923b0da8f 100644
--- a/sphinxman/master/autodoc_testsuite_python.html
+++ b/sphinxman/master/autodoc_testsuite_python.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_testsuite_python.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -232,7 +232,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_testsuite_python.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -247,7 +247,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodoc_testsuite_simint.html b/sphinxman/master/autodoc_testsuite_simint.html
index 8c33fb68f4c..eaffae70249 100644
--- a/sphinxman/master/autodoc_testsuite_simint.html
+++ b/sphinxman/master/autodoc_testsuite_simint.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_testsuite_simint.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -205,7 +205,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_testsuite_simint.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -220,7 +220,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodoc_testsuite_snsmp2.html b/sphinxman/master/autodoc_testsuite_snsmp2.html
index da77d67180e..6c4fe56aa65 100644
--- a/sphinxman/master/autodoc_testsuite_snsmp2.html
+++ b/sphinxman/master/autodoc_testsuite_snsmp2.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_testsuite_snsmp2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -208,7 +208,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_testsuite_snsmp2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -223,7 +223,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/autodoc_testsuite_v2rdm_casscf.html b/sphinxman/master/autodoc_testsuite_v2rdm_casscf.html
index 9b1faabf14f..b905530d147 100644
--- a/sphinxman/master/autodoc_testsuite_v2rdm_casscf.html
+++ b/sphinxman/master/autodoc_testsuite_v2rdm_casscf.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_testsuite_v2rdm_casscf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -220,7 +220,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/autodoc_testsuite_v2rdm_casscf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -235,7 +235,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/basissets.html b/sphinxman/master/basissets.html
index 16b4e262b7c..3189d866172 100644
--- a/sphinxman/master/basissets.html
+++ b/sphinxman/master/basissets.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/basissets.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -498,7 +498,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/basissets.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -512,7 +512,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/basissets_byelement.html b/sphinxman/master/basissets_byelement.html
index 446f0da1943..89e65309475 100644
--- a/sphinxman/master/basissets_byelement.html
+++ b/sphinxman/master/basissets_byelement.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/basissets_byelement.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -41386,7 +41386,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/basissets_byelement.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -41400,7 +41400,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/basissets_byfamily.html b/sphinxman/master/basissets_byfamily.html
index 4a0fbaa793e..9477bceb117 100644
--- a/sphinxman/master/basissets_byfamily.html
+++ b/sphinxman/master/basissets_byfamily.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/basissets_byfamily.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -2218,7 +2218,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/basissets_byfamily.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -2232,7 +2232,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/basissets_tables.html b/sphinxman/master/basissets_tables.html
index 4c131ffdfed..8d78d2d7c6c 100644
--- a/sphinxman/master/basissets_tables.html
+++ b/sphinxman/master/basissets_tables.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/basissets_tables.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1083,7 +1083,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/basissets_tables.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1097,7 +1097,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/bibliography.html b/sphinxman/master/bibliography.html
index aabca71c879..7b74a2f0605 100644
--- a/sphinxman/master/bibliography.html
+++ b/sphinxman/master/bibliography.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/bibliography.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1066,7 +1066,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/bibliography.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1080,7 +1080,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/brianqc.html b/sphinxman/master/brianqc.html
index 63fff9ee7cc..953ab45d660 100644
--- a/sphinxman/master/brianqc.html
+++ b/sphinxman/master/brianqc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/brianqc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -355,7 +355,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/brianqc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -369,7 +369,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/build_faq.html b/sphinxman/master/build_faq.html
index 46b2f4c8e27..c54961baee8 100644
--- a/sphinxman/master/build_faq.html
+++ b/sphinxman/master/build_faq.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/build_faq.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -344,7 +344,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/build_faq.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -358,7 +358,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/build_obtaining.html b/sphinxman/master/build_obtaining.html
index 8e1bc51897b..ca2f1380e49 100644
--- a/sphinxman/master/build_obtaining.html
+++ b/sphinxman/master/build_obtaining.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/build_obtaining.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -436,7 +436,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/build_obtaining.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -450,7 +450,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/build_planning.html b/sphinxman/master/build_planning.html
index 59a7f26f7d8..5178d78c191 100644
--- a/sphinxman/master/build_planning.html
+++ b/sphinxman/master/build_planning.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/build_planning.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1935,7 +1935,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/build_planning.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1949,7 +1949,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/capabilities.html b/sphinxman/master/capabilities.html
index 6ba62c2b4d3..f47f0a18e3e 100644
--- a/sphinxman/master/capabilities.html
+++ b/sphinxman/master/capabilities.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/capabilities.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -4946,7 +4946,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/capabilities.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -4960,7 +4960,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/cbs.html b/sphinxman/master/cbs.html
index 7b9d1643840..928e4396c95 100644
--- a/sphinxman/master/cbs.html
+++ b/sphinxman/master/cbs.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/cbs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1553,7 +1553,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/cbs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1567,7 +1567,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/cbs_eqn.html b/sphinxman/master/cbs_eqn.html
index 8be4615ed53..664adabad40 100644
--- a/sphinxman/master/cbs_eqn.html
+++ b/sphinxman/master/cbs_eqn.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/cbs_eqn.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -210,7 +210,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/cbs_eqn.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -225,7 +225,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/cc.html b/sphinxman/master/cc.html
index 5c5cc36b706..a1f274150ac 100644
--- a/sphinxman/master/cc.html
+++ b/sphinxman/master/cc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/cc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1014,7 +1014,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/cc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1028,7 +1028,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/cfour.html b/sphinxman/master/cfour.html
index c486d6190fd..fc96d0c28c7 100644
--- a/sphinxman/master/cfour.html
+++ b/sphinxman/master/cfour.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/cfour.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1140,7 +1140,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/cfour.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1154,7 +1154,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/cfour_table_energy.html b/sphinxman/master/cfour_table_energy.html
index 9158891da4d..41968921209 100644
--- a/sphinxman/master/cfour_table_energy.html
+++ b/sphinxman/master/cfour_table_energy.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/cfour_table_energy.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -230,7 +230,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/cfour_table_energy.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -244,7 +244,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/cfour_table_grad.html b/sphinxman/master/cfour_table_grad.html
index dba1bfc592e..b2a7026f2ab 100644
--- a/sphinxman/master/cfour_table_grad.html
+++ b/sphinxman/master/cfour_table_grad.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/cfour_table_grad.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -230,7 +230,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/cfour_table_grad.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -244,7 +244,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/chemps2.html b/sphinxman/master/chemps2.html
index a9443828f86..22d51bd2a77 100644
--- a/sphinxman/master/chemps2.html
+++ b/sphinxman/master/chemps2.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/chemps2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -641,7 +641,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/chemps2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -655,7 +655,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/code_style.html b/sphinxman/master/code_style.html
index 1aefeeb77c5..ed43dffe640 100644
--- a/sphinxman/master/code_style.html
+++ b/sphinxman/master/code_style.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/code_style.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -266,7 +266,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/code_style.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -279,7 +279,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/conda.html b/sphinxman/master/conda.html
index 6e0d58d5ecb..069ae91594b 100644
--- a/sphinxman/master/conda.html
+++ b/sphinxman/master/conda.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/conda.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -651,7 +651,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/conda.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -665,7 +665,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/cppe.html b/sphinxman/master/cppe.html
index 77ed51b42fe..efab0ed7f23 100644
--- a/sphinxman/master/cppe.html
+++ b/sphinxman/master/cppe.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/cppe.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -473,7 +473,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/cppe.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -487,7 +487,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/cubeprop.html b/sphinxman/master/cubeprop.html
index 5fae2bca57e..12ffc455dbb 100644
--- a/sphinxman/master/cubeprop.html
+++ b/sphinxman/master/cubeprop.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/cubeprop.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -531,7 +531,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/cubeprop.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -545,7 +545,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/customizing.html b/sphinxman/master/customizing.html
index 25751c0965e..9cb35f9edba 100644
--- a/sphinxman/master/customizing.html
+++ b/sphinxman/master/customizing.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/customizing.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -203,7 +203,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/customizing.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -216,7 +216,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/db.html b/sphinxman/master/db.html
index 4a83dce9c43..26c86560a8b 100644
--- a/sphinxman/master/db.html
+++ b/sphinxman/master/db.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/db.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1166,7 +1166,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/db.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1180,7 +1180,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/dct.html b/sphinxman/master/dct.html
index 67206fe65ea..0f46755722c 100644
--- a/sphinxman/master/dct.html
+++ b/sphinxman/master/dct.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/dct.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -519,7 +519,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/dct.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -533,7 +533,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/ddx.html b/sphinxman/master/ddx.html
index 7f824fd1fae..08348077677 100644
--- a/sphinxman/master/ddx.html
+++ b/sphinxman/master/ddx.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/ddx.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -674,7 +674,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/ddx.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -688,7 +688,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/detci.html b/sphinxman/master/detci.html
index 987fbad3402..b3aef674081 100644
--- a/sphinxman/master/detci.html
+++ b/sphinxman/master/detci.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/detci.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -608,7 +608,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/detci.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -622,7 +622,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/dfmp2.html b/sphinxman/master/dfmp2.html
index 6c0c9ed5c4b..768cf022a01 100644
--- a/sphinxman/master/dfmp2.html
+++ b/sphinxman/master/dfmp2.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/dfmp2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -529,7 +529,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/dfmp2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -543,7 +543,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/dft.html b/sphinxman/master/dft.html
index 44a8f39210d..6629a48a1f8 100644
--- a/sphinxman/master/dft.html
+++ b/sphinxman/master/dft.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/dft.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1547,7 +1547,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/dft.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1561,7 +1561,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/dft_byfunctional.html b/sphinxman/master/dft_byfunctional.html
index eef09f709f5..78e641df071 100644
--- a/sphinxman/master/dft_byfunctional.html
+++ b/sphinxman/master/dft_byfunctional.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/dft_byfunctional.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -17776,7 +17776,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/dft_byfunctional.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -17790,7 +17790,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/dftd3.html b/sphinxman/master/dftd3.html
index abecfa64696..ecad1a1b5a2 100644
--- a/sphinxman/master/dftd3.html
+++ b/sphinxman/master/dftd3.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/dftd3.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -958,7 +958,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/dftd3.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -972,7 +972,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/dftnl.html b/sphinxman/master/dftnl.html
index 01660bd0a4e..e76dc868349 100644
--- a/sphinxman/master/dftnl.html
+++ b/sphinxman/master/dftnl.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/dftnl.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -229,7 +229,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/dftnl.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -243,7 +243,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/diatomic.html b/sphinxman/master/diatomic.html
index 2a3a04692c8..4973ef6862c 100644
--- a/sphinxman/master/diatomic.html
+++ b/sphinxman/master/diatomic.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/diatomic.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -232,7 +232,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/diatomic.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -246,7 +246,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/dkh.html b/sphinxman/master/dkh.html
index a9d2c2ed53f..cd85695aac3 100644
--- a/sphinxman/master/dkh.html
+++ b/sphinxman/master/dkh.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/dkh.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -349,7 +349,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/dkh.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -363,7 +363,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/dlpnomp2.html b/sphinxman/master/dlpnomp2.html
index 5bde293ac46..ad76f40a9ab 100644
--- a/sphinxman/master/dlpnomp2.html
+++ b/sphinxman/master/dlpnomp2.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/dlpnomp2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -344,7 +344,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/dlpnomp2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -358,7 +358,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/documentation.html b/sphinxman/master/documentation.html
index 963e2b92e4b..362dff9b442 100644
--- a/sphinxman/master/documentation.html
+++ b/sphinxman/master/documentation.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/documentation.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -361,7 +361,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/documentation.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -374,7 +374,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/ecpint.html b/sphinxman/master/ecpint.html
index 1af3c641efb..c727a7df5d1 100644
--- a/sphinxman/master/ecpint.html
+++ b/sphinxman/master/ecpint.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/ecpint.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -290,7 +290,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/ecpint.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -304,7 +304,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/energy.html b/sphinxman/master/energy.html
index 73fc8e2cca5..faa081ed560 100644
--- a/sphinxman/master/energy.html
+++ b/sphinxman/master/energy.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/energy.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -2765,7 +2765,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/energy.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -2779,7 +2779,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/external.html b/sphinxman/master/external.html
index 78ddae21756..720c26117eb 100644
--- a/sphinxman/master/external.html
+++ b/sphinxman/master/external.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/external.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -935,7 +935,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/external.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -948,7 +948,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/external_apis.html b/sphinxman/master/external_apis.html
index 130a74fb8be..6840770fac3 100644
--- a/sphinxman/master/external_apis.html
+++ b/sphinxman/master/external_apis.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -98,7 +98,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/external_apis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -477,7 +477,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/external_apis.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -490,7 +490,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/fchk.html b/sphinxman/master/fchk.html
index dd6848dca27..e5b77b2b045 100644
--- a/sphinxman/master/fchk.html
+++ b/sphinxman/master/fchk.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/fchk.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -273,7 +273,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/fchk.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -287,7 +287,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/fisapt.html b/sphinxman/master/fisapt.html
index 3bec2c0d255..66a5eea7d35 100644
--- a/sphinxman/master/fisapt.html
+++ b/sphinxman/master/fisapt.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/fisapt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -626,7 +626,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/fisapt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -640,7 +640,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/fnocc.html b/sphinxman/master/fnocc.html
index 37f6eb788b7..792fbc7e970 100644
--- a/sphinxman/master/fnocc.html
+++ b/sphinxman/master/fnocc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/fnocc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1302,7 +1302,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/fnocc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1316,7 +1316,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/freq.html b/sphinxman/master/freq.html
index 4690e419d13..f54609b2eeb 100644
--- a/sphinxman/master/freq.html
+++ b/sphinxman/master/freq.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/freq.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -735,7 +735,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/freq.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -749,7 +749,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/gau2grid.html b/sphinxman/master/gau2grid.html
index 5dd4d2ac08e..580a235938d 100644
--- a/sphinxman/master/gau2grid.html
+++ b/sphinxman/master/gau2grid.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/gau2grid.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -282,7 +282,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/gau2grid.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -296,7 +296,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/gcp.html b/sphinxman/master/gcp.html
index ddfd5b580a9..a3fa2dee331 100644
--- a/sphinxman/master/gcp.html
+++ b/sphinxman/master/gcp.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/gcp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -340,7 +340,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/gcp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -354,7 +354,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/gdma.html b/sphinxman/master/gdma.html
index ff1d1620d39..08703659124 100644
--- a/sphinxman/master/gdma.html
+++ b/sphinxman/master/gdma.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/gdma.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -423,7 +423,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/gdma.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -437,7 +437,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/genindex.html b/sphinxman/master/genindex.html
index eec87e20b5b..e7023a91209 100644
--- a/sphinxman/master/genindex.html
+++ b/sphinxman/master/genindex.html
@@ -46,7 +46,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script src="_static/tabs.js?v=3030b3cb"></script>
@@ -92,7 +92,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/genindex.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -10097,7 +10097,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/genindex.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -10110,7 +10110,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/glossary_psivariables.html b/sphinxman/master/glossary_psivariables.html
index b216f163081..a9d763db2d4 100644
--- a/sphinxman/master/glossary_psivariables.html
+++ b/sphinxman/master/glossary_psivariables.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/glossary_psivariables.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -3164,7 +3164,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/glossary_psivariables.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -3178,7 +3178,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/index.html b/sphinxman/master/index.html
index 7aba1f2baf9..075db750cf6 100644
--- a/sphinxman/master/index.html
+++ b/sphinxman/master/index.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -98,7 +98,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/index.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="#">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -449,7 +449,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/index.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="#">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -462,7 +462,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/index_tutorials.html b/sphinxman/master/index_tutorials.html
index b63502b6db8..c065ffb94d9 100644
--- a/sphinxman/master/index_tutorials.html
+++ b/sphinxman/master/index_tutorials.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/index_tutorials.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -209,7 +209,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/index_tutorials.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -222,7 +222,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/intercalls.html b/sphinxman/master/intercalls.html
index cad06344f18..c80f87a89fc 100644
--- a/sphinxman/master/intercalls.html
+++ b/sphinxman/master/intercalls.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/intercalls.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -266,7 +266,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/intercalls.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -280,7 +280,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/interfacing.html b/sphinxman/master/interfacing.html
index 466de769e22..684c2648c20 100644
--- a/sphinxman/master/interfacing.html
+++ b/sphinxman/master/interfacing.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/interfacing.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -348,7 +348,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/interfacing.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -361,7 +361,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/introduction.html b/sphinxman/master/introduction.html
index 205d3ae46d7..fe6416e785c 100644
--- a/sphinxman/master/introduction.html
+++ b/sphinxman/master/introduction.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/introduction.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -2864,7 +2864,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/introduction.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -2877,7 +2877,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/libefp.html b/sphinxman/master/libefp.html
index 685a406bab0..188406f29c2 100644
--- a/sphinxman/master/libefp.html
+++ b/sphinxman/master/libefp.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/libefp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -491,7 +491,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/libefp.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -505,7 +505,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/libint.html b/sphinxman/master/libint.html
index 6fa243443f5..450ac06f978 100644
--- a/sphinxman/master/libint.html
+++ b/sphinxman/master/libint.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/libint.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -314,7 +314,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/libint.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -328,7 +328,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/libxc.html b/sphinxman/master/libxc.html
index 8209c9f394e..baaa98fd598 100644
--- a/sphinxman/master/libxc.html
+++ b/sphinxman/master/libxc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/libxc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -284,7 +284,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/libxc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -298,7 +298,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/manage_addon.html b/sphinxman/master/manage_addon.html
index 02381ec7c6c..b174df402a4 100644
--- a/sphinxman/master/manage_addon.html
+++ b/sphinxman/master/manage_addon.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/manage_addon.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -468,7 +468,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/manage_addon.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -482,7 +482,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/manage_git.html b/sphinxman/master/manage_git.html
index 3b714afdb36..20510a74989 100644
--- a/sphinxman/master/manage_git.html
+++ b/sphinxman/master/manage_git.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/manage_git.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -524,7 +524,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/manage_git.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -538,7 +538,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/manage_index.html b/sphinxman/master/manage_index.html
index 9c3874b5a1a..ab974a7f80e 100644
--- a/sphinxman/master/manage_index.html
+++ b/sphinxman/master/manage_index.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/manage_index.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -241,7 +241,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/manage_index.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -254,7 +254,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/manage_release.html b/sphinxman/master/manage_release.html
index 4121b05a86f..cbc423c4bfc 100644
--- a/sphinxman/master/manage_release.html
+++ b/sphinxman/master/manage_release.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/manage_release.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -852,7 +852,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/manage_release.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -866,7 +866,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/mcscf.html b/sphinxman/master/mcscf.html
index fe7ff0da9a6..4f3ec28796b 100644
--- a/sphinxman/master/mcscf.html
+++ b/sphinxman/master/mcscf.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/mcscf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -362,7 +362,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/mcscf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -376,7 +376,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/methods.html b/sphinxman/master/methods.html
index b998fee2629..c450c321be4 100644
--- a/sphinxman/master/methods.html
+++ b/sphinxman/master/methods.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/methods.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -387,7 +387,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/methods.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -400,7 +400,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/molden.html b/sphinxman/master/molden.html
index 94e492d4bf3..eb2f51d1664 100644
--- a/sphinxman/master/molden.html
+++ b/sphinxman/master/molden.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/molden.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -324,7 +324,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/molden.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -338,7 +338,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/mrcc.html b/sphinxman/master/mrcc.html
index 06688cf0ec4..fdc27b54bfb 100644
--- a/sphinxman/master/mrcc.html
+++ b/sphinxman/master/mrcc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/mrcc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -422,7 +422,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/mrcc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -436,7 +436,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/mrcc_table_energy.html b/sphinxman/master/mrcc_table_energy.html
index b688d3b2b11..5dda2545c8c 100644
--- a/sphinxman/master/mrcc_table_energy.html
+++ b/sphinxman/master/mrcc_table_energy.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/mrcc_table_energy.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -289,7 +289,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/mrcc_table_energy.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -303,7 +303,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/nbody.html b/sphinxman/master/nbody.html
index ede719f0289..67a423f332a 100644
--- a/sphinxman/master/nbody.html
+++ b/sphinxman/master/nbody.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/nbody.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1653,7 +1653,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/nbody.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1667,7 +1667,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/notes_c.html b/sphinxman/master/notes_c.html
index 2e8cbb0c567..bcd8dfe5073 100644
--- a/sphinxman/master/notes_c.html
+++ b/sphinxman/master/notes_c.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/notes_c.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -247,7 +247,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/notes_c.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -261,7 +261,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/notes_py.html b/sphinxman/master/notes_py.html
index 877400422c0..8db04136844 100644
--- a/sphinxman/master/notes_py.html
+++ b/sphinxman/master/notes_py.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/notes_py.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -228,7 +228,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/notes_py.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -242,7 +242,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/numpy.html b/sphinxman/master/numpy.html
index 8fecf2fe7f6..301d89a4763 100644
--- a/sphinxman/master/numpy.html
+++ b/sphinxman/master/numpy.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/numpy.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -366,7 +366,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/numpy.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -380,7 +380,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/objects.inv b/sphinxman/master/objects.inv
index 3a213fab578..044b0235d13 100644
Binary files a/sphinxman/master/objects.inv and b/sphinxman/master/objects.inv differ
diff --git a/sphinxman/master/occ.html b/sphinxman/master/occ.html
index 499992985b3..7ddf48ad493 100644
--- a/sphinxman/master/occ.html
+++ b/sphinxman/master/occ.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/occ.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1668,7 +1668,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/occ.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1682,7 +1682,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/oeprop.html b/sphinxman/master/oeprop.html
index 606066a013c..8047d819188 100644
--- a/sphinxman/master/oeprop.html
+++ b/sphinxman/master/oeprop.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/oeprop.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -398,7 +398,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/oeprop.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -412,7 +412,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/opt.html b/sphinxman/master/opt.html
index 895fd66b3c9..6e210cbf019 100644
--- a/sphinxman/master/opt.html
+++ b/sphinxman/master/opt.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/opt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1563,7 +1563,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/opt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1577,7 +1577,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/optionshandling.html b/sphinxman/master/optionshandling.html
index 79edccb07ed..ac849a91a29 100644
--- a/sphinxman/master/optionshandling.html
+++ b/sphinxman/master/optionshandling.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/optionshandling.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -458,7 +458,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/optionshandling.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -472,7 +472,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/optking.html b/sphinxman/master/optking.html
index 24eeee1d38e..085b51a0512 100644
--- a/sphinxman/master/optking.html
+++ b/sphinxman/master/optking.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/optking.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1132,7 +1132,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/optking.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1146,7 +1146,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/pcmsolver.html b/sphinxman/master/pcmsolver.html
index 1d44a6dd832..398ad6bf609 100644
--- a/sphinxman/master/pcmsolver.html
+++ b/sphinxman/master/pcmsolver.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/pcmsolver.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -411,7 +411,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/pcmsolver.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -425,7 +425,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/pep0001.html b/sphinxman/master/pep0001.html
index dd47a48989c..5a4aa51f185 100644
--- a/sphinxman/master/pep0001.html
+++ b/sphinxman/master/pep0001.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/pep0001.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -278,7 +278,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/pep0001.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -292,7 +292,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/plugin_psi4fockci.html b/sphinxman/master/plugin_psi4fockci.html
index 6aea1e9481b..5d4243ca4fb 100644
--- a/sphinxman/master/plugin_psi4fockci.html
+++ b/sphinxman/master/plugin_psi4fockci.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/plugin_psi4fockci.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -263,7 +263,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/plugin_psi4fockci.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -277,7 +277,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/plugin_snsmp2.html b/sphinxman/master/plugin_snsmp2.html
index f3f503ce7b1..44233a54f7c 100644
--- a/sphinxman/master/plugin_snsmp2.html
+++ b/sphinxman/master/plugin_snsmp2.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/plugin_snsmp2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -268,7 +268,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/plugin_snsmp2.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -282,7 +282,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/plugin_v2rdm_casscf.html b/sphinxman/master/plugin_v2rdm_casscf.html
index 9a4b4cdd2e0..7ba832a1c5d 100644
--- a/sphinxman/master/plugin_v2rdm_casscf.html
+++ b/sphinxman/master/plugin_v2rdm_casscf.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/plugin_v2rdm_casscf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -233,7 +233,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/plugin_v2rdm_casscf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -247,7 +247,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/plugins.html b/sphinxman/master/plugins.html
index dd430786a17..341c0192da7 100644
--- a/sphinxman/master/plugins.html
+++ b/sphinxman/master/plugins.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/plugins.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -390,7 +390,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/plugins.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -404,7 +404,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/proc_py.html b/sphinxman/master/proc_py.html
index 3b5b765d7f7..961ab223017 100644
--- a/sphinxman/master/proc_py.html
+++ b/sphinxman/master/proc_py.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/proc_py.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -420,7 +420,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/proc_py.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -434,7 +434,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/prog_blas.html b/sphinxman/master/prog_blas.html
index 36b4f9b48eb..8787f4fdddb 100644
--- a/sphinxman/master/prog_blas.html
+++ b/sphinxman/master/prog_blas.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/prog_blas.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -596,7 +596,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/prog_blas.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -610,7 +610,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/prog_conduct.html b/sphinxman/master/prog_conduct.html
index 702b9f97af1..04e345555cd 100644
--- a/sphinxman/master/prog_conduct.html
+++ b/sphinxman/master/prog_conduct.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/prog_conduct.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -189,7 +189,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/prog_conduct.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -203,7 +203,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/prog_corelibs.html b/sphinxman/master/prog_corelibs.html
index c83a3715513..475ce9e3de2 100644
--- a/sphinxman/master/prog_corelibs.html
+++ b/sphinxman/master/prog_corelibs.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/prog_corelibs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -216,7 +216,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/prog_corelibs.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -229,7 +229,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/prog_debug_profile.html b/sphinxman/master/prog_debug_profile.html
index 54e1635926d..5b429c2296a 100644
--- a/sphinxman/master/prog_debug_profile.html
+++ b/sphinxman/master/prog_debug_profile.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/prog_debug_profile.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -208,7 +208,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/prog_debug_profile.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -221,7 +221,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/prog_faq.html b/sphinxman/master/prog_faq.html
index 7676ea89107..e8d5e186a9e 100644
--- a/sphinxman/master/prog_faq.html
+++ b/sphinxman/master/prog_faq.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/prog_faq.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -274,7 +274,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/prog_faq.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -288,7 +288,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/prog_full_integration.html b/sphinxman/master/prog_full_integration.html
index 147c3512fca..f3df7c1cca6 100644
--- a/sphinxman/master/prog_full_integration.html
+++ b/sphinxman/master/prog_full_integration.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/prog_full_integration.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -206,7 +206,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/prog_full_integration.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -220,7 +220,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/prog_help.html b/sphinxman/master/prog_help.html
index 06a4f9d8707..96783d59093 100644
--- a/sphinxman/master/prog_help.html
+++ b/sphinxman/master/prog_help.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/prog_help.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -216,7 +216,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/prog_help.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -230,7 +230,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/prog_integrals.html b/sphinxman/master/prog_integrals.html
index c12ac0c8ce6..91432a49dc2 100644
--- a/sphinxman/master/prog_integrals.html
+++ b/sphinxman/master/prog_integrals.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/prog_integrals.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -653,7 +653,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/prog_integrals.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -666,7 +666,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/prog_intro.html b/sphinxman/master/prog_intro.html
index d8ab08cb9a5..ce7aaad60c9 100644
--- a/sphinxman/master/prog_intro.html
+++ b/sphinxman/master/prog_intro.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/prog_intro.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -214,7 +214,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/prog_intro.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -227,7 +227,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/prog_newcode.html b/sphinxman/master/prog_newcode.html
index 56557466b93..789ec71f19d 100644
--- a/sphinxman/master/prog_newcode.html
+++ b/sphinxman/master/prog_newcode.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/prog_newcode.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -237,7 +237,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/prog_newcode.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -250,7 +250,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/prog_setup.html b/sphinxman/master/prog_setup.html
index 35f1d5feb02..071d6de058d 100644
--- a/sphinxman/master/prog_setup.html
+++ b/sphinxman/master/prog_setup.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/prog_setup.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -203,7 +203,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/prog_setup.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -217,7 +217,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/prog_style_c.html b/sphinxman/master/prog_style_c.html
index c7d84071384..704720e7f97 100644
--- a/sphinxman/master/prog_style_c.html
+++ b/sphinxman/master/prog_style_c.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/prog_style_c.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -290,7 +290,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/prog_style_c.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -304,7 +304,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/prog_style_py.html b/sphinxman/master/prog_style_py.html
index 2e2380a8453..016af684b67 100644
--- a/sphinxman/master/prog_style_py.html
+++ b/sphinxman/master/prog_style_py.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/prog_style_py.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -213,7 +213,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/prog_style_py.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -227,7 +227,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/prog_tour.html b/sphinxman/master/prog_tour.html
index 06981fe710a..e5e169c387d 100644
--- a/sphinxman/master/prog_tour.html
+++ b/sphinxman/master/prog_tour.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/prog_tour.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -254,7 +254,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/prog_tour.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -268,7 +268,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/prog_ways_to_add.html b/sphinxman/master/prog_ways_to_add.html
index d1bd1a249a9..2438b715a7b 100644
--- a/sphinxman/master/prog_ways_to_add.html
+++ b/sphinxman/master/prog_ways_to_add.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/prog_ways_to_add.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -295,7 +295,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/prog_ways_to_add.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -309,7 +309,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/prog_welcome.html b/sphinxman/master/prog_welcome.html
index 403d0173907..588b84b8fe0 100644
--- a/sphinxman/master/prog_welcome.html
+++ b/sphinxman/master/prog_welcome.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/prog_welcome.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -204,7 +204,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/prog_welcome.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -218,7 +218,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/prop.html b/sphinxman/master/prop.html
index 2dd61f58336..f8192507ffd 100644
--- a/sphinxman/master/prop.html
+++ b/sphinxman/master/prop.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/prop.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -339,7 +339,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/prop.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -353,7 +353,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/psi4api.html b/sphinxman/master/psi4api.html
index 2236d52a70c..6ae27b1d63d 100644
--- a/sphinxman/master/psi4api.html
+++ b/sphinxman/master/psi4api.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/psi4api.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1592,7 +1592,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/psi4api.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1605,7 +1605,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/psiapi.html b/sphinxman/master/psiapi.html
index d947381b933..41865038e0f 100644
--- a/sphinxman/master/psiapi.html
+++ b/sphinxman/master/psiapi.html
@@ -48,7 +48,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -103,7 +103,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/psiapi.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -571,7 +571,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/psiapi.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -585,7 +585,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/psimrcc.html b/sphinxman/master/psimrcc.html
index 38c14728b79..22224b9d8e2 100644
--- a/sphinxman/master/psimrcc.html
+++ b/sphinxman/master/psimrcc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/psimrcc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -353,7 +353,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/psimrcc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -367,7 +367,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/psipep.html b/sphinxman/master/psipep.html
index af9c1e47896..c9d64ff81c5 100644
--- a/sphinxman/master/psipep.html
+++ b/sphinxman/master/psipep.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/psipep.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -193,7 +193,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/psipep.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -206,7 +206,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/psithonfunc.html b/sphinxman/master/psithonfunc.html
index 1de03fb7f5d..8f653af60a8 100644
--- a/sphinxman/master/psithonfunc.html
+++ b/sphinxman/master/psithonfunc.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/psithonfunc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -246,7 +246,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/psithonfunc.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -259,7 +259,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/psithoninput.html b/sphinxman/master/psithoninput.html
index a63df8dd435..611b1bc34fa 100644
--- a/sphinxman/master/psithoninput.html
+++ b/sphinxman/master/psithoninput.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script src="_static/tabs.js?v=3030b3cb"></script>
@@ -103,7 +103,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/psithoninput.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -833,7 +833,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/psithoninput.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -846,7 +846,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/psithonmol.html b/sphinxman/master/psithonmol.html
index c53d7a7b2d2..ce984c1a0b6 100644
--- a/sphinxman/master/psithonmol.html
+++ b/sphinxman/master/psithonmol.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/psithonmol.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -900,7 +900,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/psithonmol.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -914,7 +914,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/py-modindex.html b/sphinxman/master/py-modindex.html
index c8ce0febfea..fcd1d26c116 100644
--- a/sphinxman/master/py-modindex.html
+++ b/sphinxman/master/py-modindex.html
@@ -46,7 +46,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script src="_static/tabs.js?v=3030b3cb"></script>
@@ -95,7 +95,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/py-modindex.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -210,7 +210,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/py-modindex.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -223,7 +223,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/quickaddalias.html b/sphinxman/master/quickaddalias.html
index bd372342b5d..8ba5d0a0a1d 100644
--- a/sphinxman/master/quickaddalias.html
+++ b/sphinxman/master/quickaddalias.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/quickaddalias.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -278,7 +278,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/quickaddalias.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -292,7 +292,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/quickadddatabase.html b/sphinxman/master/quickadddatabase.html
index 4e1bfd1fdf1..cb4314591ee 100644
--- a/sphinxman/master/quickadddatabase.html
+++ b/sphinxman/master/quickadddatabase.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/quickadddatabase.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -252,7 +252,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/quickadddatabase.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -266,7 +266,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/relativistic.html b/sphinxman/master/relativistic.html
index 6f1bda65467..13687a33058 100644
--- a/sphinxman/master/relativistic.html
+++ b/sphinxman/master/relativistic.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/relativistic.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -348,7 +348,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/relativistic.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -362,7 +362,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/sapt.html b/sphinxman/master/sapt.html
index 47fb7786070..e6caac3a53d 100644
--- a/sphinxman/master/sapt.html
+++ b/sphinxman/master/sapt.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/sapt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1615,7 +1615,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/sapt.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1629,7 +1629,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/scf.html b/sphinxman/master/scf.html
index a5cc9eb761f..0a2629714f9 100644
--- a/sphinxman/master/scf.html
+++ b/sphinxman/master/scf.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/scf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1447,7 +1447,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/scf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1461,7 +1461,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/search.html b/sphinxman/master/search.html
index f2151621598..89106d47df1 100644
--- a/sphinxman/master/search.html
+++ b/sphinxman/master/search.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script src="_static/tabs.js?v=3030b3cb"></script>
@@ -99,7 +99,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/search.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -193,7 +193,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/search.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -206,7 +206,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/searchindex.js b/sphinxman/master/searchindex.js
index b0019c05e7e..30e849b3fa1 100644
--- a/sphinxman/master/searchindex.js
+++ b/sphinxman/master/searchindex.js
@@ -1 +1 @@
-Search.setIndex({"alltitles": {"<span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span> API: Linking C++ and Python": [[1827, null]], "<span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span> Data Objects with Irreps": [[1797, "psifour-data-objects-with-irreps"]], "<span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span> for Cfour Users": [[1743, "psifour-for-cfour-users"]], "<span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>: Open-Source Quantum Chemistry": [[1777, null]], "A <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span> Tutorial": [[1778, null]], "A First Example": [[1836, "a-first-example"], [1837, "a-first-example"]], "A Simple Example": [[1829, "a-simple-example"]], "A24": [[1692, "a24"], [1752, "a24"]], "A24alt": [[1692, "a24alt"], [1752, "a24alt"]], "ABCD": [[428, null], [465, null], [512, null], [535, null], [1199, "abcd"], [1200, "abcd"], [1202, "abcd"], [1203, "abcd"]], "ACENES": [[1692, "acenes"], [1752, "acenes"]], "ACTIVE": [[1102, null], [1221, "active"]], "ACTIVE_NAT_ORBS": [[1065, null], [1219, "active-nat-orbs"]], "ADC": [[1197, null], [1668, null]], "ADC capabilities of Psi4": [[0, "id8"]], "ADC: Ab Initio Polarization Propagator": [[0, null]], "ADD_AUXILIARY_BONDS": [[1226, "add-auxiliary-bonds"], [1298, null]], "AIO_CPHF": [[1230, "aio-cphf"], [1435, null], [1837, "aio-cphf"]], "AIO_DF_INTS": [[1230, "aio-df-ints"], [1436, null], [1837, "aio-df-ints"]], "ALGORITHM": [[726, null], [1208, "algorithm"]], "ANALYZE": [[429, null], [536, null], [1199, "analyze"], [1203, "analyze"]], "AOShellCombinationsIterator": [[3, null]], "AO_BASIS": [[411, null], [430, null], [513, null], [557, null], [727, null], [1198, "ao-basis"], [1199, "ao-basis"], [1202, "ao-basis"], [1204, "ao-basis"], [1208, "ao-basis"]], "API": [[1740, "api"], [1772, "api"], [1794, "api"]], "AUXILIARY_BOND_FACTOR": [[1226, "auxiliary-bond-factor"], [1299, null]], "AVG_STATES": [[783, null], [1210, "avg-states"]], "AVG_WEIGHTS": [[784, null], [1210, "avg-weights"]], "A_RAS3_MAX": [[782, null], [1210, "a-ras3-max"]], "Accessing integrals": [[1817, "accessing-integrals"]], "Adding Add-Ons": [[1785, null]], "Adding Methods to Driver": [[1809, null]], "Adding New Code to <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1819, null]], "Adding PSIthon Test Cases": [[2, "adding-psithon-test-cases"]], "Adding Point Charges to F/I-SAPT Computations": [[1770, "adding-point-charges-to-f-i-sapt-computations"]], "Adding PsiAPI Test Cases": [[2, "adding-psiapi-test-cases"]], "Additional Notes": [[1770, "additional-notes"]], "Advanced DFOCC Keywords": [[1798, "advanced-dfocc-keywords"]], "Advanced FNOCC Keywords": [[1771, "advanced-fnocc-keywords"]], "Advanced Functional Use and Manipulation": [[1757, "advanced-functional-use-and-manipulation"]], "Advanced I-SAPT Keywords for SAOn/SIAOn Partitionings": [[1770, "advanced-i-sapt-keywords-for-saon-siaon-partitionings"]], "Advanced Keywords for Higher-order SAPT": [[1837, "advanced-keywords-for-higher-order-sapt"]], "Advanced Keywords for SAPT(DFT)": [[1837, "advanced-keywords-for-sapt-dft"]], "Advanced OCC Keywords": [[1798, "advanced-occ-keywords"]], "Advanced Python": [[1833, "advanced-python"]], "Advanced SAPT0 Keywords": [[1837, "advanced-sapt0-keywords"]], "Advanced example": [[1837, "advanced-example"]], "Algebraic-Diagrammatic Construction methods (ADC)": [[1781, "algebraic-diagrammatic-construction-methods-adc"]], "Algorithms used for One Electron Integrals": [[1817, "id1"]], "Aliases": [[1740, "aliases"]], "All Available": [[1758, "all-available"]], "Allowed origin specifications": [[1799, "id3"]], "Analysis of Intermolecular Interactions": [[1844, "analysis-of-intermolecular-interactions"]], "Analytic Gradients": [[1753, "analytic-gradients"]], "AngularMomentumInt": [[4, null]], "Annual": [[1788, "annual"]], "Anticipate next release": [[1788, "anticipate-next-release"]], "Appendices": [[400, null]], "Arbitrary Order Coupled-Cluster Theory": [[1755, "arbitrary-order-coupled-cluster-theory"]], "Arbitrary Order Perturbation Theory": [[1755, "arbitrary-order-perturbation-theory"]], "Array to Matrix": [[1797, "array-to-matrix"]], "Assemble postrelease changes": [[1788, "assemble-postrelease-changes"]], "AtomicComputer": [[265, null]], "Auxiliary Basis Sets": [[1732, null]], "Auxiliary basis set defaults in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1694, null], [1732, "id1"]], "Auxiliary files in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1708, "id1"]], "Available ADC methods": [[0, "available-adc-methods"]], "Available Databases": [[1752, "available-databases"]], "Avoiding the need to modify Psi4, using plugins": [[1824, "avoiding-the-need-to-modify-psi4-using-plugins"]], "BAKERJCC93": [[1692, "bakerjcc93"], [1752, "bakerjcc93"]], "BAKERJCC96": [[1692, null], [1752, "bakerjcc96"]], "BASIC": [[1692, "basic"], [1752, "basic"]], "BASIS": [[898, null], [1195, null], [1212, "basis"], [1223, "basis"], [1230, "basis"], [1231, "basis"], [1437, null], [1484, null], [1771, "basis"], [1837, "basis"], [1837, "id22"]], "BASIS_GUESS": [[1231, "basis-guess"], [1485, null]], "BASIS_RELATIVISTIC": [[1103, null], [1221, "basis-relativistic"], [1836, "basis-relativistic"]], "BBI": [[1692, "bbi"], [1752, "bbi"]], "BCCD_MAXITER": [[431, null], [1199, "bccd-maxiter"]], "BENCH": [[1104, null], [1221, "bench"]], "BENCH12": [[1692, "bench12"], [1752, "bench12"]], "BENDAZZOLI": [[786, null], [1210, "bendazzoli"]], "BLAS Wrappers": [[1810, "blas-wrappers"]], "BORDER": [[1228, "border"], [1378, null], [1749, "border"]], "BORDER_N_REDIST": [[1228, "border-n-redist"], [1379, null], [1749, "border-n-redist"]], "BORDER_REDIST_ORDER": [[1228, "border-redist-order"], [1380, null], [1749, "border-redist-order"]], "BORDER_REDIST_POL": [[1228, "border-redist-pol"], [1381, null], [1749, "border-redist-pol"]], "BORDER_RMIN": [[1228, "border-rmin"], [1382, null], [1749, "border-rmin"]], "BORDER_RMIN_UNIT": [[1228, "border-rmin-unit"], [1383, null], [1749, "border-rmin-unit"]], "BORDER_TYPE": [[1228, "border-type"], [1384, null], [1749, "border-type"]], "BRIANQC": [[1710, null]], "BRIANQC_ENABLE": [[1105, null], [1221, "brianqc-enable"], [1735, "brianqc-enable"]], "BRUECKNER_MAXITER": [[1066, null], [1219, "brueckner-maxiter"]], "BRUECKNER_ORBS_R_CONVERGENCE": [[432, null], [1199, "brueckner-orbs-r-convergence"], [1742, "brueckner-orbs-r-convergence"]], "BSVec": [[5, null]], "B_RAS3_MAX": [[785, null], [1210, "b-ras3-max"]], "Basic DETCI Keywords": [[1755, "basic-detci-keywords"]], "Basic DFOCC Keywords": [[1798, "basic-dfocc-keywords"]], "Basic FNOCC Keywords": [[1771, "basic-fnocc-keywords"]], "Basic Input File Structure": [[1844, "basic-input-file-structure"]], "Basic Keywords": [[1742, "basic-keywords"], [1799, "basic-keywords"], [1802, "basic-keywords"]], "Basic Keywords Controlling MP2 NO Approximations": [[1837, "basic-keywords-controlling-mp2-no-approximations"]], "Basic Keywords for Higher-order SAPT": [[1837, "basic-keywords-for-higher-order-sapt"]], "Basic Keywords for SAPT(DFT)": [[1837, "basic-keywords-for-sapt-dft"]], "Basic MCSCF Keywords": [[1789, "basic-mcscf-keywords"]], "Basic OCC Keywords": [[1798, "basic-occ-keywords"]], "Basic SAPT0 Keywords": [[1837, "basic-sapt0-keywords"]], "Basics": [[1797, "basics"]], "Basis Set Superposition Corrections": [[1794, null]], "Basis Sets": [[400, "basis-sets"], [1730, null], [1832, "basis-sets"]], "Basis Sets by Element": [[1731, null]], "Basis Sets by Family": [[1733, null]], "Basis set availability by element in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1707, null], [1731, "id1"]], "Basis sets options": [[1836, "basis-sets-options"]], "BasisExtents": [[6, null]], "BasisFunctions": [[7, null]], "BasisSet": [[8, null]], "Bibliography": [[1734, null]], "Binary Installer": [[1737, "binary-installer"]], "BlockOPoints": [[9, null]], "BoysLocalizer": [[10, null]], "Broken Symmetry": [[1838, "broken-symmetry"]], "Buffer address": [[1817, "buffer-address"]], "Build & Run FAQ": [[1736, null]], "Build Conda ecosystem stack": [[1788, "build-conda-ecosystem-stack"]], "Build Docker images": [[1788, "build-docker-images"]], "Build Psi4conda set": [[1788, "build-psi4conda-set"]], "Build extra Conda packages for Psi4 channel": [[1788, "build-extra-conda-packages-for-psi4-channel"]], "Building <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span> with BrianQC": [[1735, "building-psifour-with-brianqc"]], "Building BrianQC\u2019s user-built components": [[1735, "building-brianqc-s-user-built-components"]], "Built-In Basis Sets": [[1730, "built-in-basis-sets"]], "C++ Style": [[1821, null]], "C++ Style in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1814, "c-style-in-psifour"]], "CACHELEVEL": [[412, null], [433, null], [466, null], [507, null], [514, null], [537, null], [558, null], [728, null], [1198, "cachelevel"], [1199, "cachelevel"], [1200, "cachelevel"], [1201, "cachelevel"], [1202, "cachelevel"], [1203, "cachelevel"], [1204, "cachelevel"], [1208, "cachelevel"], [1225, "cachelevel"], [1242, null], [1742, "cachelevel"]], "CACHETYPE": [[434, null], [467, null], [1199, "cachetype"], [1200, "cachetype"], [1742, "cachetype"]], "CALC_S_SQUARED": [[787, null], [1210, "calc-s-squared"]], "CANONICALIZE_ACTIVE_FAVG": [[1171, null], [1222, "canonicalize-active-favg"]], "CANONICALIZE_INACTIVE_FAVG": [[1172, null], [1222, "canonicalize-inactive-favg"]], "CARTESIAN_SYM_TOLERANCE": [[1226, "cartesian-sym-tolerance"], [1301, null]], "CART_HESS_READ": [[1226, "cart-hess-read"], [1300, null]], "CC": [[788, null], [1210, "cc"]], "CC3_FOLLOW_ROOT": [[468, null], [1200, "cc3-follow-root"]], "CC: Coupled Cluster Theory": [[1742, null]], "CCDENSITY": [[1198, null]], "CCD_E_CONVERGENCE": [[1230, "ccd-e-convergence"], [1438, null]], "CCD_MAXITER": [[1230, "ccd-maxiter"], [1439, null]], "CCD_T_CONVERGENCE": [[1230, "ccd-t-convergence"], [1440, null]], "CCENERGY": [[1199, null], [1669, null]], "CCEOM": [[1200, null]], "CCHBAR": [[1201, null]], "CCLAMBDA": [[1202, null]], "CCL_ENERGY": [[1225, "ccl-energy"], [1244, null]], "CCRESPONSE": [[1203, null]], "CCTRANSORT": [[1204, null]], "CCTRIPLES": [[1205, null]], "CCWavefunction": [[11, null]], "CC_A_RAS3_MAX": [[789, null], [1210, "cc-a-ras3-max"]], "CC_B_RAS3_MAX": [[790, null], [1210, "cc-b-ras3-max"]], "CC_DIIS_MAX_VECS": [[911, null], [1213, "cc-diis-max-vecs"]], "CC_DIIS_MIN_VECS": [[912, null], [1213, "cc-diis-min-vecs"]], "CC_EX_LEVEL": [[791, null], [1210, "cc-ex-level"]], "CC_FIX_EXTERNAL": [[792, null], [1210, "cc-fix-external"]], "CC_FIX_EXTERNAL_MIN": [[793, null], [1210, "cc-fix-external-min"]], "CC_LAMBDA": [[913, null], [1213, "cc-lambda"]], "CC_MACRO": [[794, null], [1210, "cc-macro"]], "CC_MAXITER": [[914, null], [1213, "cc-maxiter"], [1225, "cc-maxiter"], [1243, null]], "CC_MIXED": [[795, null], [1210, "cc-mixed"]], "CC_NUM_THREADS": [[435, null], [469, null], [564, null], [1199, "cc-num-threads"], [1200, "cc-num-threads"], [1205, "cc-num-threads"], [1229, "cc-num-threads"], [1397, null]], "CC_OS_SCALE": [[436, null], [1199, "cc-os-scale"]], "CC_RAS34_MAX": [[796, null], [1210, "cc-ras34-max"]], "CC_RAS3_MAX": [[797, null], [1210, "cc-ras3-max"]], "CC_RAS4_MAX": [[798, null], [1210, "cc-ras4-max"]], "CC_SCALE_OS": [[1067, null], [1219, "cc-scale-os"], [1771, "cc-scale-os"]], "CC_SCALE_SS": [[1068, null], [1219, "cc-scale-ss"], [1771, "cc-scale-ss"]], "CC_SS_SCALE": [[437, null], [1199, "cc-ss-scale"]], "CC_TIMINGS": [[1069, null], [1219, "cc-timings"], [1771, "cc-timings"]], "CC_TYPE": [[1106, null], [1221, "cc-type"]], "CC_UPDATE_EPS": [[799, null], [1210, "cc-update-eps"]], "CC_VAL_EX_LEVEL": [[800, null], [1210, "cc-val-ex-level"]], "CC_VARIATIONAL": [[801, null], [1210, "cc-variational"]], "CC_VECS_READ": [[802, null], [1210, "cc-vecs-read"]], "CC_VECS_WRITE": [[803, null], [1210, "cc-vecs-write"]], "CEPA_LEVEL": [[1070, null], [1219, "cepa-level"], [1771, "cepa-level"]], "CEPA_NO_SINGLES": [[1071, null], [1219, "cepa-no-singles"], [1771, "cepa-no-singles"]], "CEPA_OS_SCALE": [[1225, "cepa-os-scale"], [1245, null]], "CEPA_SOS_SCALE": [[1225, "cepa-sos-scale"], [1246, null]], "CEPA_SS_SCALE": [[1225, "cepa-ss-scale"], [1247, null]], "CEPA_TYPE": [[1225, "cepa-type"], [1248, null]], "CFOUR": [[1206, null], [1670, null], [1711, null]], "CFOUR Internal": [[1206, "cfour-internal"]], "CFOUR_ABCDTYPE": [[568, null], [1206, "cfour-abcdtype"]], "CFOUR_ACTIVE_ORBI": [[569, null], [1206, "cfour-active-orbi"]], "CFOUR_ANHARMONIC": [[574, null], [1206, "cfour-anharmonic"]], "CFOUR_ANH_ALGORITHM": [[570, null], [1206, "cfour-anh-algorithm"]], "CFOUR_ANH_DERIVATIVES": [[571, null], [1206, "cfour-anh-derivatives"]], "CFOUR_ANH_STEPSIZE": [[572, null], [1206, "cfour-anh-stepsize"]], "CFOUR_ANH_SYMMETRY": [[573, null], [1206, "cfour-anh-symmetry"]], "CFOUR_AO_LADDERS": [[575, null], [1206, "cfour-ao-ladders"]], "CFOUR_AV_SCF": [[576, null], [1206, "cfour-av-scf"]], "CFOUR_BASIS": [[577, null], [1206, "cfour-basis"]], "CFOUR_BRUCK_CONV": [[578, null], [1206, "cfour-bruck-conv"]], "CFOUR_BRUECKNER": [[579, null], [1206, "cfour-brueckner"]], "CFOUR_CACHE_RECS": [[580, null], [1206, "cfour-cache-recs"]], "CFOUR_CALC_LEVEL": [[581, null], [1206, "cfour-calc-level"]], "CFOUR_CC_CONV": [[582, null], [1206, "cfour-cc-conv"]], "CFOUR_CC_EXPORDER": [[583, null], [1206, "cfour-cc-exporder"]], "CFOUR_CC_EXTRAPOLATION": [[584, null], [1206, "cfour-cc-extrapolation"]], "CFOUR_CC_MAXCYC": [[585, null], [1206, "cfour-cc-maxcyc"]], "CFOUR_CC_PROGRAM": [[586, null], [1206, "cfour-cc-program"]], "CFOUR_CHARGE": [[587, null], [1206, "cfour-charge"]], "CFOUR_CIS_CONV": [[588, null], [1206, "cfour-cis-conv"]], "CFOUR_CONTINUUM": [[589, null], [1206, "cfour-continuum"]], "CFOUR_CONTRACTION": [[590, null], [1206, "cfour-contraction"]], "CFOUR_CONVERGENCE": [[591, null], [1206, "cfour-convergence"]], "CFOUR_COORDINATES": [[592, null], [1206, "cfour-coordinates"]], "CFOUR_CORE_ORBITALS": [[593, null], [1206, "cfour-core-orbitals"]], "CFOUR_CPHF_CONVER": [[594, null], [1206, "cfour-cphf-conver"]], "CFOUR_CPHF_MAXCYC": [[595, null], [1206, "cfour-cphf-maxcyc"]], "CFOUR_CURVILINEAR": [[596, null], [1206, "cfour-curvilinear"]], "CFOUR_DBOC": [[597, null], [1206, "cfour-dboc"]], "CFOUR_DCT": [[598, null], [1206, "cfour-dct"]], "CFOUR_DERIV_LEVEL": [[599, null], [1206, "cfour-deriv-level"]], "CFOUR_DIFF_TYPE": [[600, null], [1206, "cfour-diff-type"]], "CFOUR_DROPMO": [[601, null], [1206, "cfour-dropmo"]], "CFOUR_ECP": [[602, null], [1206, "cfour-ecp"]], "CFOUR_EIGENVECTOR": [[603, null], [1206, "cfour-eigenvector"]], "CFOUR_EL_ANHARM": [[604, null], [1206, "cfour-el-anharm"]], "CFOUR_EOM_NONIT": [[605, null], [1206, "cfour-eom-nonit"]], "CFOUR_ESTATE_CONV": [[606, null], [1206, "cfour-estate-conv"]], "CFOUR_ESTATE_MAXCYC": [[607, null], [1206, "cfour-estate-maxcyc"]], "CFOUR_ESTATE_PROP": [[608, null], [1206, "cfour-estate-prop"]], "CFOUR_ESTATE_SYM": [[609, null], [1206, "cfour-estate-sym"]], "CFOUR_ESTATE_TRANS": [[610, null], [1206, "cfour-estate-trans"]], "CFOUR_EVAL_HESS": [[611, null], [1206, "cfour-eval-hess"]], "CFOUR_EXCITATION": [[612, null], [1206, "cfour-excitation"]], "CFOUR_EXCITE": [[613, null], [1206, "cfour-excite"]], "CFOUR_FC_FIELD": [[614, null], [1206, "cfour-fc-field"]], "CFOUR_FD_CALCTYPE": [[615, null], [1206, "cfour-fd-calctype"]], "CFOUR_FD_IRREPS": [[616, null], [1206, "cfour-fd-irreps"]], "CFOUR_FD_PROJECT": [[617, null], [1206, "cfour-fd-project"]], "CFOUR_FD_STEPSIZE": [[618, null], [1206, "cfour-fd-stepsize"]], "CFOUR_FD_USEGROUP": [[619, null], [1206, "cfour-fd-usegroup"]], "CFOUR_FILE_RECSIZ": [[620, null], [1206, "cfour-file-recsiz"]], "CFOUR_FILE_STRIPE": [[621, null], [1206, "cfour-file-stripe"]], "CFOUR_FINITE_PERTURBATION": [[622, null], [1206, "cfour-finite-perturbation"]], "CFOUR_FOCK": [[623, null], [1206, "cfour-fock"]], "CFOUR_FREQ_ALGORITHM": [[624, null], [1206, "cfour-freq-algorithm"]], "CFOUR_FROZEN_CORE": [[625, null], [1206, "cfour-frozen-core"]], "CFOUR_FROZEN_VIRT": [[626, null], [1206, "cfour-frozen-virt"]], "CFOUR_GAMMA_ABCD": [[627, null], [1206, "cfour-gamma-abcd"]], "CFOUR_GENBAS_1": [[628, null], [1206, "cfour-genbas-1"]], "CFOUR_GENBAS_2": [[629, null], [1206, "cfour-genbas-2"]], "CFOUR_GENBAS_3": [[630, null], [1206, "cfour-genbas-3"]], "CFOUR_GENBAS_4": [[631, null], [1206, "cfour-genbas-4"]], "CFOUR_GEO_CONV": [[632, null], [1206, "cfour-geo-conv"]], "CFOUR_GEO_MAXCYC": [[633, null], [1206, "cfour-geo-maxcyc"]], "CFOUR_GEO_MAXSTEP": [[634, null], [1206, "cfour-geo-maxstep"]], "CFOUR_GEO_METHOD": [[635, null], [1206, "cfour-geo-method"]], "CFOUR_GIAO": [[636, null], [1206, "cfour-giao"]], "CFOUR_GRID": [[637, null], [1206, "cfour-grid"]], "CFOUR_GUESS": [[638, null], [1206, "cfour-guess"]], "CFOUR_HBAR": [[639, null], [1206, "cfour-hbar"]], "CFOUR_HFSTABILITY": [[640, null], [1206, "cfour-hfstability"]], "CFOUR_INCORE": [[641, null], [1206, "cfour-incore"]], "CFOUR_INPUT_MRCC": [[642, null], [1206, "cfour-input-mrcc"]], "CFOUR_INTEGRALS": [[643, null], [1206, "cfour-integrals"]], "CFOUR_JODA_PRINT": [[644, null], [1206, "cfour-joda-print"]], "CFOUR_LINEQ_CONV": [[645, null], [1206, "cfour-lineq-conv"]], "CFOUR_LINEQ_MAXCY": [[646, null], [1206, "cfour-lineq-maxcy"]], "CFOUR_LINEQ_TYPE": [[647, null], [1206, "cfour-lineq-type"]], "CFOUR_LOCK_ORBOCC": [[648, null], [1206, "cfour-lock-orbocc"]], "CFOUR_MAXSTEP": [[649, null], [1206, "cfour-maxstep"]], "CFOUR_MEMORY_SIZE": [[651, null], [1206, "cfour-memory-size"]], "CFOUR_MEM_UNIT": [[650, null], [1206, "cfour-mem-unit"]], "CFOUR_METHOD": [[652, null], [1206, "cfour-method"]], "CFOUR_MRCC": [[653, null], [1206, "cfour-mrcc"]], "CFOUR_MULTIPLICITY": [[654, null], [1206, "cfour-multiplicity"]], "CFOUR_NACOUPLING": [[655, null], [1206, "cfour-nacoupling"]], "CFOUR_NEGEVAL": [[656, null], [1206, "cfour-negeval"]], "CFOUR_NEWNORM": [[657, null], [1206, "cfour-newnorm"]], "CFOUR_NONHF": [[658, null], [1206, "cfour-nonhf"]], "CFOUR_NTOP_TAMP": [[659, null], [1206, "cfour-ntop-tamp"]], "CFOUR_OCCUPATION": [[660, null], [1206, "cfour-occupation"]], "CFOUR_OMP_NUM_THREADS": [[661, null], [1206, "cfour-omp-num-threads"]], "CFOUR_OPEN-SHELL": [[662, null], [1206, "cfour-open-shell"]], "CFOUR_OPT_MAXCYC": [[663, null], [1206, "cfour-opt-maxcyc"]], "CFOUR_ORBITALS": [[664, null], [1206, "cfour-orbitals"]], "CFOUR_PERT_ORB": [[665, null], [1206, "cfour-pert-orb"]], "CFOUR_POINTS": [[666, null], [1206, "cfour-points"]], "CFOUR_PRINT": [[667, null], [1206, "cfour-print"]], "CFOUR_PROPS": [[669, null], [1206, "cfour-props"]], "CFOUR_PROP_INTEGRAL": [[668, null], [1206, "cfour-prop-integral"]], "CFOUR_QRHFGUES": [[672, null], [1206, "cfour-qrhfgues"]], "CFOUR_QRHF_GENERAL": [[670, null], [1206, "cfour-qrhf-general"]], "CFOUR_QRHF_ORBITAL": [[671, null], [1206, "cfour-qrhf-orbital"]], "CFOUR_RAMAN_INT": [[673, null], [1206, "cfour-raman-int"]], "CFOUR_RAMAN_ORB": [[674, null], [1206, "cfour-raman-orb"]], "CFOUR_RDO": [[675, null], [1206, "cfour-rdo"]], "CFOUR_REFERENCE": [[676, null], [1206, "cfour-reference"]], "CFOUR_RELATIVISTIC": [[677, null], [1206, "cfour-relativistic"]], "CFOUR_RELAX_DENS": [[678, null], [1206, "cfour-relax-dens"]], "CFOUR_RESTART_CC": [[680, null], [1206, "cfour-restart-cc"]], "CFOUR_RES_RAMAN": [[679, null], [1206, "cfour-res-raman"]], "CFOUR_ROT_EVEC": [[681, null], [1206, "cfour-rot-evec"]], "CFOUR_SAVE_INTS": [[682, null], [1206, "cfour-save-ints"]], "CFOUR_SCALE_ON": [[683, null], [1206, "cfour-scale-on"]], "CFOUR_SCF_CONV": [[684, null], [1206, "cfour-scf-conv"]], "CFOUR_SCF_DAMPING": [[685, null], [1206, "cfour-scf-damping"]], "CFOUR_SCF_EXPORDER": [[686, null], [1206, "cfour-scf-exporder"]], "CFOUR_SCF_EXPSTART": [[687, null], [1206, "cfour-scf-expstart"]], "CFOUR_SCF_EXTRAPOLATION": [[688, null], [1206, "cfour-scf-extrapolation"]], "CFOUR_SCF_MAXCYC": [[689, null], [1206, "cfour-scf-maxcyc"]], "CFOUR_SD_FIELD": [[690, null], [1206, "cfour-sd-field"]], "CFOUR_SPHERICAL": [[691, null], [1206, "cfour-spherical"]], "CFOUR_SPINROTATION": [[695, null], [1206, "cfour-spinrotation"]], "CFOUR_SPIN_FLIP": [[692, null], [1206, "cfour-spin-flip"]], "CFOUR_SPIN_ORBIT": [[693, null], [1206, "cfour-spin-orbit"]], "CFOUR_SPIN_SCAL": [[694, null], [1206, "cfour-spin-scal"]], "CFOUR_SUBGROUP": [[696, null], [1206, "cfour-subgroup"]], "CFOUR_SYMMETRY": [[698, null], [1206, "cfour-symmetry"]], "CFOUR_SYM_CHECK": [[697, null], [1206, "cfour-sym-check"]], "CFOUR_T3_EXTRAPOL": [[699, null], [1206, "cfour-t3-extrapol"]], "CFOUR_TAMP_SUM": [[700, null], [1206, "cfour-tamp-sum"]], "CFOUR_THERMOCHEMISTRY": [[701, null], [1206, "cfour-thermochemistry"]], "CFOUR_TRANS_INV": [[702, null], [1206, "cfour-trans-inv"]], "CFOUR_TREAT_PERT": [[703, null], [1206, "cfour-treat-pert"]], "CFOUR_UIJ_THRESHOLD": [[704, null], [1206, "cfour-uij-threshold"]], "CFOUR_UNITS": [[705, null], [1206, "cfour-units"]], "CFOUR_UPDATE_HESSIAN": [[706, null], [1206, "cfour-update-hessian"]], "CFOUR_VIBRATION": [[707, null], [1206, "cfour-vibration"]], "CFOUR_VTRAN": [[708, null], [1206, "cfour-vtran"]], "CFOUR_XFIELD": [[709, null], [1206, "cfour-xfield"]], "CFOUR_XFORM_TOL": [[710, null], [1206, "cfour-xform-tol"]], "CFOUR_YFIELD": [[711, null], [1206, "cfour-yfield"]], "CFOUR_ZFIELD": [[712, null], [1206, "cfour-zfield"]], "CHEMPS2": [[1712, null]], "CHOLESKY": [[915, null], [1213, "cholesky"]], "CHOLESKY_TOLERANCE": [[916, null], [1072, null], [1213, "cholesky-tolerance"], [1219, "cholesky-tolerance"], [1231, "cholesky-tolerance"], [1486, null], [1771, "cholesky-tolerance"]], "CI: Configuration Interaction": [[1755, null]], "CIBLKS_PRINT": [[807, null], [1210, "ciblks-print"]], "CIVector": [[12, null]], "CIWavefunction": [[13, null]], "CI_DIIS": [[1173, null], [1222, "ci-diis"]], "CI_FILE_START": [[804, null], [1210, "ci-file-start"]], "CI_MAXITER": [[805, null], [1210, "ci-maxiter"], [1755, "ci-maxiter"]], "CI_NUM_THREADS": [[806, null], [1210, "ci-num-threads"]], "CI_TYPE": [[1107, null], [1221, "ci-type"]], "CMakeLists.txt": [[2, "cmakelists-txt"]], "COLLAPSE_SIZE": [[808, null], [1210, "collapse-size"]], "COLLAPSE_WITH_LAST": [[470, null], [1200, "collapse-with-last"]], "COLLAPSE_WITH_LAST_CC3": [[471, null], [1200, "collapse-with-last-cc3"]], "COMPLEX_TOLERANCE": [[472, null], [1200, "complex-tolerance"]], "COMPUTE_MP4_TRIPLES": [[1073, null], [1219, "compute-mp4-triples"], [1771, "compute-mp4-triples"]], "COMPUTE_TRIPLES": [[1074, null], [1219, "compute-triples"], [1771, "compute-triples"]], "COMPUT_S2": [[917, null], [1213, "comput-s2"]], "CONSECUTIVE_BACKSTEPS": [[1226, "consecutive-backsteps"], [1302, null]], "COOKBOOK": [[1713, null]], "CORE": [[1692, "core"], [1752, "core"]], "CORR_ANSATZ": [[1229, "corr-ansatz"], [1398, null]], "CORR_CCSD_T": [[1229, "corr-ccsd-t"], [1399, null]], "CORR_CHARGE": [[1229, "corr-charge"], [1400, null]], "CORR_MULTP": [[1229, "corr-multp"], [1401, null]], "CORR_WFN": [[1229, "corr-wfn"], [1402, null]], "COSX Algorithm": [[1231, "cosx-algorithm"]], "COSX Exchange": [[1838, "cosx-exchange"]], "COSX_BASIS_TOLERANCE": [[1231, "cosx-basis-tolerance"], [1487, null]], "COSX_DENSITY_TOLERANCE": [[1231, "cosx-density-tolerance"], [1488, null]], "COSX_INTS_TOLERANCE": [[1231, "cosx-ints-tolerance"], [1489, null]], "COSX_MAXITER_FINAL": [[1231, "cosx-maxiter-final"], [1490, null]], "COSX_OVERLAP_FITTING": [[1231, "cosx-overlap-fitting"], [1491, null]], "COSX_PRUNING_SCHEME": [[1231, "cosx-pruning-scheme"], [1492, null]], "COSX_RADIAL_POINTS_FINAL": [[1231, "cosx-radial-points-final"], [1493, null]], "COSX_RADIAL_POINTS_INITIAL": [[1231, "cosx-radial-points-initial"], [1494, null]], "COSX_SPHERICAL_POINTS_FINAL": [[1231, "cosx-spherical-points-final"], [1495, null]], "COSX_SPHERICAL_POINTS_INITIAL": [[1231, "cosx-spherical-points-initial"], [1496, null]], "COUPLED_INDUCTION": [[1230, "coupled-induction"], [1441, null], [1837, "coupled-induction"], [1837, "id13"]], "COUPLING": [[1229, "coupling"], [1403, null]], "COUPLING_TERMS": [[1229, "coupling-terms"], [1404, null]], "COVALENT_CONNECT": [[1226, "covalent-connect"], [1303, null]], "CPHF": [[1207, null]], "CPHF_MEM_SAFETY_FACTOR": [[714, null], [1207, "cphf-mem-safety-factor"]], "CPHF_R_CONVERGENCE": [[1029, null], [1218, "cphf-r-convergence"], [1230, "cphf-r-convergence"], [1442, null], [1837, "cphf-r-convergence"]], "CPHF_TASKS": [[715, null], [1207, "cphf-tasks"]], "CTest and pytest, PSIthon and PsiAPI": [[2, "ctest-and-pytest-psithon-and-psiapi"]], "CUBEPROP_BASIS_FUNCTIONS": [[1108, null], [1221, "cubeprop-basis-functions"], [1750, "cubeprop-basis-functions"]], "CUBEPROP_FILEPATH": [[1109, null], [1221, "cubeprop-filepath"], [1750, "cubeprop-filepath"]], "CUBEPROP_ISOCONTOUR_THRESHOLD": [[1110, null], [1221, "cubeprop-isocontour-threshold"]], "CUBEPROP_ORBITALS": [[1111, null], [1221, "cubeprop-orbitals"], [1750, "cubeprop-orbitals"]], "CUBEPROP_TASKS": [[1112, null], [1221, "cubeprop-tasks"], [1750, "id3"]], "CUBIC_BASIS_TOLERANCE": [[1030, null], [1113, null], [1218, "cubic-basis-tolerance"], [1221, "cubic-basis-tolerance"]], "CUBIC_BLOCK_MAX_POINTS": [[1031, null], [1114, null], [1218, "cubic-block-max-points"], [1221, "cubic-block-max-points"]], "CUBIC_GRID_OVERAGE": [[1032, null], [1115, null], [1218, "cubic-grid-overage"], [1221, "cubic-grid-overage"], [1750, "cubic-grid-overage"]], "CUBIC_GRID_SPACING": [[1033, null], [1116, null], [1218, "cubic-grid-spacing"], [1221, "cubic-grid-spacing"], [1750, "cubic-grid-spacing"]], "CUHF": [[14, null]], "CUSTOM_COORDS": [[1226, "custom-coords"], [1304, null]], "CUTOFF": [[918, null], [1213, "cutoff"], [1225, "cutoff"], [1249, null]], "CUTOFF_AMPS_PRINT": [[0, "cutoff-amps-print"], [1, "cutoff-amps-print"], [401, null], [1197, "cutoff-amps-print"]], "Calling compute_shell(int P, int Q)": [[1817, "calling-compute-shell-int-p-int-q"]], "Capabilities": [[1781, "capabilities"]], "Capabilities and Alternate Implementations": [[1739, null]], "Capabilities of <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>, including details of overlapping modules. \u201c\u2713\u201d runs analytically. \u201c\u2237\u201d runs derivative with internal finite difference. Single underline \u201c\u2713\u0332\u201d or \u201c\u2237\u0332\u201d is default module when QC_MODULE unspecified. Double underline \u201c\u2713\u0333\u201d or \u201c\u2237\u0333\u201d is default algorithm type when type selector (e.g., CC_TYPE) unspecified.": [[1739, "id18"]], "CdSalc": [[15, null]], "CdSalcList": [[16, null]], "Cfour for <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span> Users": [[1743, "cfour-for-psifour-users"]], "Changes to External Potential Engines": [[1817, "changes-to-external-potential-engines"]], "CharacterTable": [[17, null]], "Charge-Transfer in SAPT": [[1837, "charge-transfer-in-sapt"]], "Citing <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1781, "citing-psifour"]], "Class Inheritance Diagram": [[1827, "class-inheritance-diagram"], [1827, "id3"], [1827, "id6"]], "Classes": [[1827, "classes"], [1827, "id2"], [1827, "id5"]], "Clone from GitHub Repository": [[1737, "clone-from-github-repository"]], "Code style conventions": [[1747, null]], "Collect documentation snapshot": [[1788, "collect-documentation-snapshot"]], "Collect new authors": [[1788, "collect-new-authors"]], "Command Line Options": [[1767, "command-line-options"]], "Comments": [[1804, "comments"]], "Community Code of Conduct": [[1811, null]], "Comparison Functions": [[2, "comparison-functions"]], "Compiling and Installing from Source": [[1738, null]], "Complete Basis Set": [[1740, null]], "Completely new methods": [[1823, "completely-new-methods"]], "CompositeJK": [[18, null]], "Computations with Mid-bonds": [[1837, "computations-with-mid-bonds"]], "Conda Binary Distribution": [[1748, null]], "Conda Binary Package": [[1737, "conda-binary-package"]], "Configuration Interaction (CI)": [[1781, "configuration-interaction-ci"]], "Configuring and Installing <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span> via Binary": [[1736, "configuring-and-installing-psifour-via-binary"]], "Configuring, Building, and Installing <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span> via Source": [[1736, "configuring-building-and-installing-psifour-via-source"]], "Constrained Optimizations": [[1802, "constrained-optimizations"]], "Contents:": [[1777, null]], "Conventional (Non-OO) Coupled-Cluster and M\u00f8ller\u2013Plesset Perturbation Theories": [[1798, "conventional-non-oo-coupled-cluster-and-mollerplesset-perturbation-theories"]], "Convergence Control": [[1226, "convergence-control"]], "Convergence Control/Stabilization": [[1231, "convergence-control-stabilization"]], "Convergence Criteria": [[1802, "convergence-criteria"]], "Convergence Problems": [[1798, "convergence-problems"]], "Convergence Stabilization": [[1838, "convergence-stabilization"]], "Convergence and Algorithm Defaults": [[1838, "convergence-and-algorithm-defaults"]], "ConvergenceError": [[266, null]], "Coordinates": [[1833, "coordinates"]], "CorrelationFactor": [[19, null]], "CorrelationTable": [[20, null]], "Coupled Cluster (CC)": [[1781, "coupled-cluster-cc"]], "Coupled electron pair approximation": [[1771, "coupled-electron-pair-approximation"]], "Creating New Plugins": [[1808, null]], "Creating a Database": [[1835, null]], "Creating a New Plugin": [[1808, "creating-a-new-plugin"]], "Creating a New Plugin Using a Conda Pre-compiled Binary": [[1808, "creating-a-new-plugin-using-a-conda-pre-compiled-binary"]], "Cube File Visualization with PyMol": [[1770, "cube-file-visualization-with-pymol"]], "CubeProperties": [[21, null]], "Cubeprop Tasks": [[1750, "cubeprop-tasks"]], "Current coupled cluster capabilities of <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1742, "id14"]], "Current one-electron property capabilities of <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1799, "id2"]], "Customization: Adding Simple Extensions": [[1751, null]], "DAMPING_CONVERGENCE": [[1231, "damping-convergence"], [1498, null]], "DAMPING_FACTOR_INDUCED": [[1228, "damping-factor-induced"], [1387, null]], "DAMPING_FACTOR_MULTIPOLE": [[1228, "damping-factor-multipole"], [1388, null]], "DAMPING_PERCENTAGE": [[729, null], [1208, "damping-percentage"], [1229, "damping-percentage"], [1231, "damping-percentage"], [1405, null], [1499, null]], "DAMP_INDUCED": [[1228, "damp-induced"], [1385, null]], "DAMP_MULTIPOLE": [[1228, "damp-multipole"], [1386, null]], "DASUM": [[22, null]], "DAXPY": [[23, null]], "DCOPY": [[24, null]], "DCT": [[1208, null], [1671, null]], "DCT: Density Cumulant Theory": [[1753, null]], "DCT_FUNCTIONAL": [[730, null], [1208, "dct-functional"]], "DCT_GUESS": [[731, null], [1208, "dct-guess"]], "DCT_TYPE": [[732, null], [1208, "dct-type"]], "DDOT": [[25, null]], "DDX": [[1117, null], [1209, null], [1221, "ddx"], [1672, null], [1754, "ddx"]], "DDX_DIIS_MAX_VECS": [[760, null], [1209, "ddx-diis-max-vecs"], [1754, "ddx-diis-max-vecs"]], "DDX_ETA": [[761, null], [1209, "ddx-eta"], [1754, "ddx-eta"]], "DDX_FMM": [[762, null], [1209, "ddx-fmm"], [1754, "ddx-fmm"]], "DDX_FMM_LOCAL_LMAX": [[763, null], [1209, "ddx-fmm-local-lmax"], [1754, "ddx-fmm-local-lmax"]], "DDX_FMM_MULTIPOLE_LMAX": [[764, null], [1209, "ddx-fmm-multipole-lmax"], [1754, "ddx-fmm-multipole-lmax"]], "DDX_INCORE": [[765, null], [1209, "ddx-incore"], [1754, "ddx-incore"]], "DDX_LMAX": [[766, null], [1209, "ddx-lmax"], [1754, "ddx-lmax"]], "DDX_LOGFILE": [[767, null], [1209, "ddx-logfile"], [1754, "ddx-logfile"]], "DDX_MAXITER": [[768, null], [1209, "ddx-maxiter"], [1754, "ddx-maxiter"]], "DDX_MODEL": [[769, null], [1209, "ddx-model"], [1754, "ddx-model"]], "DDX_N_LEBEDEV": [[770, null], [1209, "ddx-n-lebedev"], [1754, "ddx-n-lebedev"]], "DDX_RADII": [[771, null], [1209, "ddx-radii"], [1754, "ddx-radii"]], "DDX_RADII_SCALING": [[772, null], [1209, "ddx-radii-scaling"], [1754, "ddx-radii-scaling"]], "DDX_RADII_SET": [[773, null], [1209, "ddx-radii-set"], [1754, "ddx-radii-set"]], "DDX_SHIFT": [[774, null], [1209, "ddx-shift"], [1754, "ddx-shift"]], "DDX_SOLUTE_RADIAL_POINTS": [[775, null], [1209, "ddx-solute-radial-points"], [1754, "ddx-solute-radial-points"]], "DDX_SOLUTE_SPHERICAL_POINTS": [[776, null], [1209, "ddx-solute-spherical-points"], [1754, "ddx-solute-spherical-points"]], "DDX_SOLVATION_CONVERGENCE": [[777, null], [1209, "ddx-solvation-convergence"], [1754, "ddx-solvation-convergence"]], "DDX_SOLVENT": [[778, null], [1209, "ddx-solvent"], [1754, "ddx-solvent"]], "DDX_SOLVENT_EPSILON": [[779, null], [1209, "ddx-solvent-epsilon"], [1754, "ddx-solvent-epsilon"]], "DDX_SOLVENT_EPSILON_OPTICAL": [[780, null], [1209, "ddx-solvent-epsilon-optical"]], "DDX_SOLVENT_KAPPA": [[781, null], [1209, "ddx-solvent-kappa"], [1754, "ddx-solvent-kappa"]], "DEBUG": [[413, null], [716, null], [1118, null], [1198, "debug"], [1207, "debug"], [1221, "debug"], [1837, "debug"], [1837, "id27"]], "DELETE_TEI": [[559, null], [1204, "delete-tei"]], "DENOMINATOR_ALGORITHM": [[1230, "denominator-algorithm"], [1443, null], [1837, "denominator-algorithm"]], "DENOMINATOR_DELTA": [[1230, "denominator-delta"], [1444, null], [1837, "denominator-delta"]], "DERTYPE": [[1011, null], [1119, null], [1216, "dertype"], [1221, "dertype"]], "DETCI": [[1210, null], [1673, null]], "DETCI_FREEZE_CORE": [[809, null], [1210, "detci-freeze-core"]], "DF-MP2: Density-Fitted 2nd-Order M\u00f8ller\u2013Plesset Perturbation Theory": [[1756, null]], "DFCC": [[1076, null], [1219, "dfcc"], [1771, "dfcc"]], "DFEP2": [[1211, null]], "DFEP2Wavefunction": [[26, null]], "DFHelper": [[27, null]], "DFMP2": [[1212, null], [1674, null]], "DFMP2_MEM_FACTOR": [[902, null], [1212, "dfmp2-mem-factor"]], "DFMP2_P2_TOLERANCE": [[903, null], [1212, "dfmp2-p2-tolerance"]], "DFMP2_P_TOLERANCE": [[904, null], [1212, "dfmp2-p-tolerance"]], "DFOCC": [[1213, null], [1675, null]], "DFSCF Algorithm": [[1231, "dfscf-algorithm"]], "DFSOMCSCF": [[28, null]], "DFT": [[1231, "dft"]], "DFT Functionals": [[1758, null]], "DFT functionals available in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1695, null], [1758, "id1"]], "DFT-NL": [[1760, null]], "DFT: Density Functional Theory": [[1757, null]], "DFTD3": [[1715, null]], "DFTD4": [[1716, null]], "DFTGrid": [[29, null]], "DFT_ALPHA": [[1231, "dft-alpha"], [1512, null]], "DFT_ALPHA_C": [[1231, "dft-alpha-c"], [1513, null]], "DFT_BASIS_TOLERANCE": [[1231, "dft-basis-tolerance"], [1514, null]], "DFT_BLOCK_MAX_POINTS": [[1231, "dft-block-max-points"], [1515, null]], "DFT_BLOCK_MAX_RADIUS": [[1231, "dft-block-max-radius"], [1516, null]], "DFT_BLOCK_MIN_POINTS": [[1231, "dft-block-min-points"], [1517, null]], "DFT_BLOCK_SCHEME": [[1231, "dft-block-scheme"], [1518, null]], "DFT_BS_RADIUS_ALPHA": [[1231, "dft-bs-radius-alpha"], [1519, null]], "DFT_DENSITY_TOLERANCE": [[1231, "dft-density-tolerance"], [1520, null]], "DFT_DISPERSION_PARAMETERS": [[1231, "dft-dispersion-parameters"], [1521, null]], "DFT_GRAC_ALPHA": [[1231, "dft-grac-alpha"], [1522, null]], "DFT_GRAC_BETA": [[1231, "dft-grac-beta"], [1523, null]], "DFT_GRAC_C_FUNC": [[1231, "dft-grac-c-func"], [1524, null]], "DFT_GRAC_SHIFT": [[1231, "dft-grac-shift"], [1525, null]], "DFT_GRAC_X_FUNC": [[1231, "dft-grac-x-func"], [1526, null]], "DFT_GRID_NAME": [[1231, "dft-grid-name"], [1527, null]], "DFT_NUCLEAR_SCHEME": [[1231, "dft-nuclear-scheme"], [1528, null]], "DFT_OMEGA": [[1231, "dft-omega"], [1529, null]], "DFT_OMEGA_C": [[1231, "dft-omega-c"], [1530, null]], "DFT_PRUNING_ALPHA": [[1231, "dft-pruning-alpha"], [1531, null]], "DFT_PRUNING_SCHEME": [[1231, "dft-pruning-scheme"], [1532, null]], "DFT_RADIAL_POINTS": [[1231, "dft-radial-points"], [1533, null]], "DFT_RADIAL_SCHEME": [[1231, "dft-radial-scheme"], [1534, null]], "DFT_REMOVE_DISTANT_POINTS": [[1231, "dft-remove-distant-points"], [1535, null]], "DFT_SPHERICAL_POINTS": [[1231, "dft-spherical-points"], [1536, null]], "DFT_SPHERICAL_SCHEME": [[1231, "dft-spherical-scheme"], [1537, null]], "DFT_V2_RHO_CUTOFF": [[1231, "dft-v2-rho-cutoff"], [1538, null]], "DFT_VV10_B": [[1231, "dft-vv10-b"], [1539, null]], "DFT_VV10_C": [[1231, "dft-vv10-c"], [1540, null]], "DFT_VV10_POSTSCF": [[1231, "dft-vv10-postscf"], [1541, null]], "DFT_VV10_RADIAL_POINTS": [[1231, "dft-vv10-radial-points"], [1542, null]], "DFT_VV10_RHO_CUTOFF": [[1231, "dft-vv10-rho-cutoff"], [1543, null]], "DFT_VV10_SPHERICAL_POINTS": [[1231, "dft-vv10-spherical-points"], [1544, null]], "DFT_WEIGHTS_TOLERANCE": [[1231, "dft-weights-tolerance"], [1545, null]], "DFTensor": [[30, null]], "DF_BASIS_CC": [[1075, null], [1120, null], [1219, "df-basis-cc"], [1221, "df-basis-cc"], [1771, "df-basis-cc"]], "DF_BASIS_DCT": [[733, null], [1208, "df-basis-dct"]], "DF_BASIS_ELST": [[1230, "df-basis-elst"], [1445, null], [1837, "df-basis-elst"]], "DF_BASIS_EP2": [[892, null], [1211, "df-basis-ep2"]], "DF_BASIS_GUESS": [[1231, "df-basis-guess"], [1500, null]], "DF_BASIS_MCSCF": [[810, null], [1210, "df-basis-mcscf"]], "DF_BASIS_MP2": [[899, null], [963, null], [1212, "df-basis-mp2"], [1214, "df-basis-mp2"]], "DF_BASIS_SAD": [[1231, "df-basis-sad"], [1501, null]], "DF_BASIS_SAPT": [[1230, "df-basis-sapt"], [1446, null], [1837, "df-basis-sapt"], [1837, "id23"]], "DF_BASIS_SCF": [[717, null], [1207, "df-basis-scf"], [1231, "df-basis-scf"], [1502, null]], "DF_BUMP_R0": [[1231, "df-bump-r0"], [1503, null]], "DF_BUMP_R1": [[1231, "df-bump-r1"], [1504, null]], "DF_DOMAINS": [[1231, "df-domains"], [1505, null]], "DF_FITTING_CONDITION": [[1231, "df-fitting-condition"], [1506, null]], "DF_INTS_IO": [[900, null], [1212, "df-ints-io"], [1231, "df-ints-io"], [1507, null]], "DF_INTS_NUM_THREADS": [[901, null], [1212, "df-ints-num-threads"], [1231, "df-ints-num-threads"], [1508, null]], "DF_METRIC": [[1231, "df-metric"], [1509, null]], "DF_SCF_GUESS": [[1231, "df-scf-guess"], [1510, null]], "DF_THETA": [[1231, "df-theta"], [1511, null]], "DGBMV": [[31, null]], "DGEEV": [[32, null]], "DGEMM": [[33, null]], "DGEMV": [[34, null]], "DGER": [[35, null]], "DGETRF": [[36, null]], "DGETRI": [[37, null]], "DGETRS": [[38, null]], "DIAGONALIZE_HEFF": [[1229, "diagonalize-heff"], [1407, null]], "DIAGONAL_CCSD_T": [[1229, "diagonal-ccsd-t"], [1406, null]], "DIAG_METHOD": [[811, null], [1210, "diag-method"], [1755, "diag-method"]], "DIE_IF_NOT_CONVERGED": [[1121, null], [1221, "die-if-not-converged"]], "DIIS": [[321, null], [438, null], [515, null], [538, null], [812, null], [1175, null], [1199, "diis"], [1202, "diis"], [1203, "diis"], [1210, "diis"], [1222, "diis"], [1231, "diis"], [1546, null]], "DIIS_FREQ": [[813, null], [1210, "diis-freq"]], "DIIS_MAX_VECS": [[734, null], [814, null], [1077, null], [1176, null], [1208, "diis-max-vecs"], [1210, "diis-max-vecs"], [1219, "diis-max-vecs"], [1222, "diis-max-vecs"], [1225, "diis-max-vecs"], [1229, "diis-max-vecs"], [1231, "diis-max-vecs"], [1250, null], [1408, null], [1547, null], [1771, "diis-max-vecs"]], "DIIS_MIN_VECS": [[735, null], [815, null], [1208, "diis-min-vecs"], [1210, "diis-min-vecs"], [1225, "diis-min-vecs"], [1231, "diis-min-vecs"], [1251, null], [1548, null]], "DIIS_RMS_ERROR": [[1231, "diis-rms-error"], [1549, null]], "DIIS_START": [[1229, "diis-start"], [1231, "diis-start"], [1409, null], [1550, null]], "DIIS_START_CONVERGENCE": [[736, null], [1208, "diis-start-convergence"]], "DIIS_START_ITER": [[816, null], [1210, "diis-start-iter"]], "DIPMOM": [[817, null], [1078, null], [1210, "dipmom"], [1219, "dipmom"], [1755, "dipmom"], [1771, "dipmom"]], "DISP_SIZE": [[1023, null], [1217, "disp-size"]], "DISTRIBUTED_MATRIX": [[1231, "distributed-matrix"], [1551, null]], "DKH": [[1717, null]], "DKH_ORDER": [[1122, null], [1221, "dkh-order"], [1762, "dkh-order"]], "DLPNO": [[1214, null], [1676, null]], "DLPNO-MP2: Domain-Based Local Pair Natural Orbital MP2": [[1763, null]], "DLPNO_ALGORITHM": [[964, null], [1214, "dlpno-algorithm"]], "DLPNO_LOCAL_ORBITALS": [[965, null], [1214, "dlpno-local-orbitals"]], "DLPNO_MAXITER": [[966, null], [1214, "dlpno-maxiter"]], "DMRG": [[1215, null], [1677, null]], "DMRG Keywords": [[1746, "dmrg-keywords"]], "DMRG_CASPT2_CALC": [[986, null], [1215, "dmrg-caspt2-calc"], [1746, "dmrg-caspt2-calc"]], "DMRG_CASPT2_IMAG": [[987, null], [1215, "dmrg-caspt2-imag"], [1746, "dmrg-caspt2-imag"]], "DMRG_CASPT2_IPEA": [[988, null], [1215, "dmrg-caspt2-ipea"], [1746, "dmrg-caspt2-ipea"]], "DMRG_CASPT2_ORBS": [[989, null], [1215, "dmrg-caspt2-orbs"], [1746, "dmrg-caspt2-orbs"]], "DMRG_DIIS": [[990, null], [1215, "dmrg-diis"], [1746, "dmrg-diis"]], "DMRG_DIIS_WRITE": [[991, null], [1215, "dmrg-diis-write"], [1746, "dmrg-diis-write"]], "DMRG_EXCITATION": [[992, null], [1215, "dmrg-excitation"], [1746, "dmrg-excitation"]], "DMRG_IRREP": [[993, null], [1215, "dmrg-irrep"], [1746, "dmrg-irrep"]], "DMRG_LOCAL_INIT": [[994, null], [1215, "dmrg-local-init"], [1746, "dmrg-local-init"]], "DMRG_MOLDEN_WRITE": [[995, null], [1215, "dmrg-molden-write"], [1746, "dmrg-molden-write"]], "DMRG_MPS_WRITE": [[996, null], [1215, "dmrg-mps-write"], [1746, "dmrg-mps-write"]], "DMRG_MULTIPLICITY": [[997, null], [1215, "dmrg-multiplicity"], [1746, "dmrg-multiplicity"]], "DMRG_OPDM_AO_PRINT": [[998, null], [1215, "dmrg-opdm-ao-print"], [1746, "dmrg-opdm-ao-print"]], "DMRG_PRINT_CORR": [[999, null], [1215, "dmrg-print-corr"], [1746, "dmrg-print-corr"]], "DMRG_SCF_ACTIVE_SPACE": [[1000, null], [1215, "dmrg-scf-active-space"], [1746, "dmrg-scf-active-space"]], "DMRG_SCF_DIIS_THR": [[1001, null], [1215, "dmrg-scf-diis-thr"], [1746, "dmrg-scf-diis-thr"]], "DMRG_SCF_GRAD_THR": [[1002, null], [1215, "dmrg-scf-grad-thr"], [1746, "dmrg-scf-grad-thr"]], "DMRG_SCF_MAX_ITER": [[1003, null], [1215, "dmrg-scf-max-iter"], [1746, "dmrg-scf-max-iter"]], "DMRG_SCF_STATE_AVG": [[1004, null], [1215, "dmrg-scf-state-avg"], [1746, "dmrg-scf-state-avg"]], "DMRG_SWEEP_DVDSON_RTOL": [[1005, null], [1215, "dmrg-sweep-dvdson-rtol"], [1746, "dmrg-sweep-dvdson-rtol"]], "DMRG_SWEEP_ENERGY_CONV": [[1006, null], [1215, "dmrg-sweep-energy-conv"], [1746, "dmrg-sweep-energy-conv"]], "DMRG_SWEEP_MAX_SWEEPS": [[1007, null], [1215, "dmrg-sweep-max-sweeps"], [1746, "dmrg-sweep-max-sweeps"]], "DMRG_SWEEP_NOISE_PREFAC": [[1008, null], [1215, "dmrg-sweep-noise-prefac"], [1746, "dmrg-sweep-noise-prefac"]], "DMRG_SWEEP_STATES": [[1009, null], [1215, "dmrg-sweep-states"], [1746, "dmrg-sweep-states"]], "DMRG_UNITARY_WRITE": [[1010, null], [1215, "dmrg-unitary-write"], [1746, "dmrg-unitary-write"]], "DNRM2": [[39, null]], "DOCC": [[1123, null], [1177, null], [1221, "docc"], [1222, "docc"]], "DOI_BASIS_TOLERANCE": [[967, null], [1214, "doi-basis-tolerance"]], "DOI_PRUNING_SCHEME": [[968, null], [1214, "doi-pruning-scheme"]], "DOI_RADIAL_POINTS": [[969, null], [1214, "doi-radial-points"]], "DOI_SPHERICAL_POINTS": [[970, null], [1214, "doi-spherical-points"]], "DO_CCD_DISP": [[1230, "do-ccd-disp"], [1447, null], [1837, "do-ccd-disp"]], "DO_DIIS": [[919, null], [1213, "do-diis"], [1225, "do-diis"], [1252, null], [1798, "do-diis"], [1798, "id42"]], "DO_DISP_EXCH_SINF": [[1230, "do-disp-exch-sinf"], [1448, null], [1837, "do-disp-exch-sinf"]], "DO_IND30_EXCH_SINF": [[1230, "do-ind30-exch-sinf"], [1449, null], [1837, "do-ind30-exch-sinf"]], "DO_IND_EXCH_SINF": [[1230, "do-ind-exch-sinf"], [1450, null], [1837, "do-ind-exch-sinf"]], "DO_LEVEL_SHIFT": [[920, null], [1213, "do-level-shift"], [1225, "do-level-shift"], [1253, null], [1798, "do-level-shift"], [1798, "id43"]], "DO_MBPT_DISP": [[1230, "do-mbpt-disp"], [1451, null], [1837, "do-mbpt-disp"]], "DO_SCS": [[921, null], [1213, "do-scs"], [1225, "do-scs"], [1254, null]], "DO_SOS": [[922, null], [1213, "do-sos"], [1225, "do-sos"], [1255, null]], "DO_THIRD_ORDER": [[1230, "do-third-order"], [1452, null], [1837, "do-third-order"]], "DPOTRF": [[40, null]], "DPOTRI": [[41, null]], "DPOTRS": [[42, null]], "DROT": [[43, null]], "DSBMV": [[44, null]], "DSCAL": [[45, null]], "DSWAP": [[46, null]], "DSYEV": [[47, null]], "DSYMM": [[48, null]], "DSYMV": [[49, null]], "DSYR": [[50, null]], "DSYR2": [[51, null]], "DSYR2K": [[52, null]], "DSYRK": [[53, null]], "DSYSV": [[54, null]], "DTBMV": [[55, null]], "DTBSV": [[56, null]], "DTRMM": [[57, null]], "DTRMV": [[58, null]], "DTRSM": [[59, null]], "DTRSV": [[60, null]], "DYNAMIC_LEVEL": [[1226, "dynamic-level"], [1305, null]], "D_CONVERGENCE": [[1174, null], [1222, "d-convergence"], [1231, "d-convergence"], [1497, null]], "Database \u2014 database()": [[1752, null]], "Dealing with problematic optimizations": [[1802, "dealing-with-problematic-optimizations"]], "Debugging": [[1813, "debugging"]], "Debugging and Profiling": [[1813, null]], "Declaring Options": [[1801, "declaring-options"]], "Decontracted Basis Sets": [[1730, "decontracted-basis-sets"]], "Defining a Method Alias": [[1834, null]], "Density Cumulant Theory (DCT)": [[1781, "density-cumulant-theory-dct"]], "Density Matrices": [[1210, "density-matrices"]], "Density Matrix Renormalization Group (DMRG)": [[1781, "density-matrix-renormalization-group-dmrg"]], "Density Screening": [[1817, "density-screening"]], "Density matrix renormalization group capabilities of <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span> through CheMPS2": [[1746, "id1"]], "Density-fitted coupled cluster": [[1771, "density-fitted-coupled-cluster"]], "Deriv": [[61, null]], "DerivCalcType": [[62, null]], "Derivative Integrals": [[1817, "derivative-integrals"]], "Detailed Installation of <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1748, "detailed-installation-of-psifour"]], "Detailed Installation of Miniconda": [[1748, "detailed-installation-of-miniconda"]], "Detailed capabilities of CCENERGY and related modules. \u201c\u2713\u201d runs analytically. Single underline \u201c\u2713\u0332\u201d is default module when QC_MODULE unspecified. Double underline \u201c\u2713\u0333\u201d is default algorithm type when type selector (e.g., CC_TYPE) unspecified.": [[1742, "id15"]], "Detailed capabilities of the DFMP2 module. \u201c\u2713\u201d runs analytically. Single underline \u201c\u2713\u0332\u201d is default module when QC_MODULE unspecified. Double underline \u201c\u2713\u0333\u201d is default algorithm type when type selector (e.g., CC_TYPE) unspecified.": [[1756, "id7"]], "Detailed capabilities of the FNOCC module. \u201c\u2713\u201d runs analytically. Single underline \u201c\u2713\u0332\u201d is default module when QC_MODULE unspecified. Double underline \u201c\u2713\u0333\u201d is default algorithm type when type selector (e.g., CC_TYPE) unspecified.": [[1771, "id13"]], "Detailed capabilities of the SCF module. \u201c\u2713\u201d runs analytically. Single underline \u201c\u2713\u0332\u201d is default module when QC_MODULE unspecified. Double underline \u201c\u2713\u0333\u201d is default algorithm type when type selector (e.g., CC_TYPE) unspecified.": [[1757, "id15"]], "Detailed non-orbital-optimized capabilities of the OCC module. \u201c\u2713\u201d runs analytically. Single underline \u201c\u2713\u0332\u201d is default module when QC_MODULE unspecified. Double underline \u201c\u2713\u0333\u201d is default algorithm type when type selector (e.g., CC_TYPE) unspecified.": [[1798, "id73"]], "Detailed orbital-optimized capabilities of the OCC module. \u201c\u2713\u201d runs analytically. Single underline \u201c\u2713\u0332\u201d is default module when QC_MODULE unspecified. Double underline \u201c\u2713\u0333\u201d is default algorithm type when type selector (e.g., CC_TYPE) unspecified.": [[1798, "id70"]], "Diagonalization Methods": [[1210, "diagonalization-methods"]], "DiagonalizeOrder": [[63, null]], "Difference F-SAPT Analysis": [[1770, "difference-f-sapt-analysis"]], "Dimension": [[64, null]], "Dimer coordinates": [[1802, "id25"]], "DipoleInt": [[65, null]], "DirectJK": [[66, null]], "DiskSOMCSCF": [[67, null]], "Dispersion": [[68, null]], "Dispersion Corrections": [[1757, "dispersion-corrections"]], "Dispersion-Corrected": [[1758, "dispersion-corrected"]], "Dispersion-Corrected functionals available in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1697, null], [1758, "id7"]], "Do final pass before release tag": [[1788, "do-final-pass-before-release-tag"]], "Documentation Structure": [[1764, "documentation-structure"]], "Double-Hybrid": [[1758, "double-hybrid"]], "Double-Hybrid functionals available in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1696, null], [1758, "id6"]], "E3_SCALE": [[923, null], [1213, "e3-scale"], [1225, "e3-scale"], [1256, null]], "EA_POLES": [[1225, "ea-poles"], [1258, null]], "EFP": [[1216, null], [1678, null]], "EFP Fragments": [[1782, "efp-fragments"]], "EFP_DISP": [[1012, null], [1216, "efp-disp"]], "EFP_DISP_DAMPING": [[1013, null], [1216, "efp-disp-damping"]], "EFP_ELST": [[1014, null], [1216, "efp-elst"]], "EFP_ELST_DAMPING": [[1015, null], [1216, "efp-elst-damping"]], "EFP_EXCH": [[1016, null], [1216, "efp-exch"]], "EFP_IND": [[1017, null], [1216, "efp-ind"]], "EFP_IND_DAMPING": [[1018, null], [1216, "efp-ind-damping"]], "EFP_QM_ELST": [[1019, null], [1216, "efp-qm-elst"]], "EFP_QM_IND": [[1020, null], [1216, "efp-qm-ind"]], "EKT_EA": [[1225, "ekt-ea"], [1259, null]], "EKT_IP": [[925, null], [1213, "ekt-ip"], [1225, "ekt-ip"], [1260, null]], "ENERGY_LEVEL_SHIFT": [[738, null], [1208, "energy-level-shift"]], "ENSURE_BT_CONVERGENCE": [[1226, "ensure-bt-convergence"], [1306, null]], "EOM_GUESS": [[474, null], [1200, "eom-guess"], [1742, "eom-guess"]], "EOM_REFERENCE": [[475, null], [508, null], [1200, "eom-reference"], [1201, "eom-reference"]], "EP2_CONVERGENCE": [[893, null], [1211, "ep2-convergence"]], "EP2_MAXITER": [[894, null], [1211, "ep2-maxiter"]], "EP2_NUM_EA": [[895, null], [1211, "ep2-num-ea"]], "EP2_NUM_IP": [[896, null], [1211, "ep2-num-ip"]], "EP2_ORBITALS": [[897, null], [1211, "ep2-orbitals"]], "EP_EA_POLES": [[1225, "ep-ea-poles"], [1261, null]], "EP_IP_POLES": [[1225, "ep-ip-poles"], [1262, null]], "EP_MAXITER": [[1225, "ep-maxiter"], [1263, null]], "ERI": [[69, null]], "ERI Algorithms": [[1757, "eri-algorithms"], [1838, "eri-algorithms"]], "ESPPropCalc": [[70, null]], "EXCH_SCALE_ALPHA": [[1230, "exch-scale-alpha"], [1453, null], [1837, "exch-scale-alpha"]], "EXCITATION_RANGE": [[476, null], [1200, "excitation-range"]], "EXPLICIT_HAMILTONIAN": [[718, null], [1207, "explicit-hamiltonian"]], "EXTERN": [[1231, "extern"], [1553, null]], "EXTERNAL_POTENTIAL_SYMMETRY": [[1124, null], [1221, "external-potential-symmetry"]], "EXT_FORCE_BEND": [[1226, "ext-force-bend"], [1307, null]], "EXT_FORCE_CARTESIAN": [[1226, "ext-force-cartesian"], [1308, null]], "EXT_FORCE_DIHEDRAL": [[1226, "ext-force-dihedral"], [1309, null]], "EXT_FORCE_DISTANCE": [[1226, "ext-force-distance"], [1310, null]], "EXT_FORCE_OOFP": [[1226, "ext-force-oofp"], [1311, null]], "EX_ALLOW": [[819, null], [1210, "ex-allow"]], "EX_LEVEL": [[820, null], [1210, "ex-level"], [1755, "ex-level"]], "E_CONVERGENCE": [[439, null], [473, null], [737, null], [818, null], [924, null], [971, null], [1079, null], [1178, null], [1199, "e-convergence"], [1200, "e-convergence"], [1208, "e-convergence"], [1210, "e-convergence"], [1213, "e-convergence"], [1214, "e-convergence"], [1219, "e-convergence"], [1222, "e-convergence"], [1224, "e-convergence"], [1225, "e-convergence"], [1229, "e-convergence"], [1231, "e-convergence"], [1233, null], [1257, null], [1410, null], [1552, null], [1742, "e-convergence"], [1771, "e-convergence"], [1798, "e-convergence"], [1798, "id34"]], "Easier and more rapid development": [[1824, "easier-and-more-rapid-development"]], "Effective core potentials (ECPs)": [[1838, "effective-core-potentials-ecps"]], "ElectricFieldInt": [[71, null]], "ElectrostaticInt": [[72, null]], "Elementary Restart": [[1767, "elementary-restart"]], "Embarrassing Parallelism": [[1840, null]], "Empirical Dispersion Implementations": [[1759, "empirical-dispersion-implementations"]], "Empirical dispersion correction packages": [[1759, "id35"]], "EmpiricalDispersion": [[267, null]], "Environment Variables": [[1735, "environment-variables"], [1767, "environment-variables"]], "Environmental Effects": [[1231, "environmental-effects"]], "Evaluation of One-Electron Properties \u2014 oeprop()": [[1799, null]], "Examples": [[1843, "examples"]], "Excited State Coupled Cluster Calculations": [[1742, "excited-state-coupled-cluster-calculations"]], "Expert": [[1198, "expert"], [1199, "expert"], [1200, "expert"], [1201, "expert"], [1202, "expert"], [1203, "expert"], [1204, "expert"], [1205, "expert"], [1208, "expert"], [1209, "expert"], [1212, "expert"], [1216, "expert"], [1218, "expert"], [1219, "expert"], [1221, "expert"], [1222, "expert"], [1224, "expert"], [1225, "expert"], [1227, "expert"], [1229, "expert"]], "Expert Alternative Algorithms": [[1210, "expert-alternative-algorithms"]], "Expert COSX Algorithm": [[1231, "expert-cosx-algorithm"]], "Expert Convergence Control/Stabilization": [[1231, "expert-convergence-control-stabilization"]], "Expert DFSCF Algorithm": [[1231, "expert-dfscf-algorithm"]], "Expert DFT": [[1231, "expert-dft"]], "Expert DOI Grid Options": [[1214, "expert-doi-grid-options"]], "Expert Density Matrices": [[1210, "expert-density-matrices"]], "Expert Diagonalization Methods": [[1210, "expert-diagonalization-methods"]], "Expert Expert Options": [[1214, "expert-expert-options"]], "Expert File Handling": [[1210, "expert-file-handling"]], "Expert General Options": [[1210, "expert-general-options"]], "Expert General Wavefunction Info": [[1231, "expert-general-wavefunction-info"]], "Expert General-Order Coupled-Cluster": [[1210, "expert-general-order-coupled-cluster"]], "Expert General-Order Perturbation Theory": [[1210, "expert-general-order-perturbation-theory"]], "Expert Guess Vectors": [[1210, "expert-guess-vectors"]], "Expert Misc.": [[1231, "expert-misc"]], "Expert Parallel Runtime": [[1231, "expert-parallel-runtime"]], "Expert Psi4 Control of CFOUR": [[1206, "expert-psi4-control-of-cfour"]], "Expert Root Following": [[1210, "expert-root-following"]], "Expert SAD Guess Algorithm": [[1231, "expert-sad-guess-algorithm"]], "Expert SAPT(DFT)": [[1230, "expert-sapt-dft"]], "Expert SAPT(HF)": [[1230, "expert-sapt-hf"]], "Expert snLinK Algorithm": [[1231, "expert-snlink-algorithm"]], "Exposing C++ code to Python": [[1823, "exposing-c-code-to-python"]], "External API Objects": [[1768, null]], "External potentials and QM/MM": [[1838, "external-potentials-and-qm-mm"]], "ExternalPotential": [[73, null]], "Extra QCA Functions": [[2, "extra-qca-functions"]], "Extrapolation Schemes": [[1740, "extrapolation-schemes"]], "F-SAPT: A Representative Example": [[1770, "f-sapt-a-representative-example"]], "F/I-SAPT: Functional Group and/or Intramolecular SAPT": [[1770, null]], "FAIL_ON_MAXITER": [[1231, "fail-on-maxiter"], [1554, null]], "FAVG": [[1179, null], [1222, "favg"]], "FAVG_CCSD_T": [[1229, "favg-ccsd-t"], [1411, null]], "FAVG_START": [[1180, null], [1222, "favg-start"]], "FCHKWriter": [[74, null]], "FCI": [[821, null], [1210, "fci"], [1755, "fci"]], "FCI_STRINGS": [[822, null], [1210, "fci-strings"]], "FDDS_Dispersion": [[75, null]], "FD_PROJECT": [[1024, null], [1217, "fd-project"]], "FILTER_GUESS": [[823, null], [1210, "filter-guess"]], "FILTER_GUESS_DET1": [[824, null], [1210, "filter-guess-det1"]], "FILTER_GUESS_DET2": [[825, null], [1210, "filter-guess-det2"]], "FILTER_GUESS_SIGN": [[826, null], [1210, "filter-guess-sign"]], "FILTER_ZERO_DET": [[827, null], [1210, "filter-zero-det"]], "FINDIF": [[1217, null]], "FISAPT": [[76, null], [1218, null], [1679, null]], "FISAPT_CHARGE_COMPLETENESS": [[1034, null], [1218, "fisapt-charge-completeness"]], "FISAPT_CUBE_DENSMAT": [[1035, null], [1218, "fisapt-cube-densmat"], [1770, "fisapt-cube-densmat"]], "FISAPT_CUBE_LINKIBOS": [[1036, null], [1218, "fisapt-cube-linkibos"], [1770, "fisapt-cube-linkibos"]], "FISAPT_CUBE_LINKIHOS": [[1037, null], [1218, "fisapt-cube-linkihos"], [1770, "fisapt-cube-linkihos"]], "FISAPT_DO_FSAPT": [[1038, null], [1218, "fisapt-do-fsapt"]], "FISAPT_DO_FSAPT_DISP": [[1039, null], [1218, "fisapt-do-fsapt-disp"]], "FISAPT_DO_PLOT": [[1040, null], [1218, "fisapt-do-plot"]], "FISAPT_EXCH_PARPERP": [[1041, null], [1218, "fisapt-exch-parperp"], [1770, "fisapt-exch-parperp"]], "FISAPT_FSAPT_EXCH_SCALE": [[1042, null], [1218, "fisapt-fsapt-exch-scale"]], "FISAPT_FSAPT_FILEPATH": [[1043, null], [1218, "fisapt-fsapt-filepath"]], "FISAPT_FSAPT_IND_RESPONSE": [[1044, null], [1218, "fisapt-fsapt-ind-response"]], "FISAPT_FSAPT_IND_SCALE": [[1045, null], [1218, "fisapt-fsapt-ind-scale"]], "FISAPT_FSSAPT_FILEPATH": [[1046, null], [1218, "fisapt-fssapt-filepath"]], "FISAPT_LINK_ASSIGNMENT": [[1047, null], [1218, "fisapt-link-assignment"]], "FISAPT_LINK_ORTHO": [[1048, null], [1218, "fisapt-link-ortho"], [1770, "fisapt-link-ortho"]], "FISAPT_LINK_SELECTION": [[1049, null], [1218, "fisapt-link-selection"]], "FISAPT_MANUAL_LINKS": [[1050, null], [1218, "fisapt-manual-links"]], "FISAPT_MEM_SAFETY_FACTOR": [[1051, null], [1218, "fisapt-mem-safety-factor"]], "FISAPT_PLOT_FILEPATH": [[1052, null], [1218, "fisapt-plot-filepath"]], "FLEXIBLE_G_CONVERGENCE": [[1226, "flexible-g-convergence"], [1312, null]], "FNOCC": [[1219, null], [1680, null]], "FNOCC: Frozen natural orbitals for CCSD(T), QCISD(T), CEPA, and MP4": [[1771, null]], "FOLLOW_ROOT": [[828, null], [1181, null], [1210, "follow-root"], [1222, "follow-root"], [1229, "follow-root"], [1412, null]], "FOLLOW_STEP_INCREMENT": [[1231, "follow-step-increment"], [1555, null]], "FOLLOW_STEP_SCALE": [[1231, "follow-step-scale"], [1556, null]], "FOLLOW_VECTOR": [[829, null], [1210, "follow-vector"]], "FORCE_RESTART": [[440, null], [1199, "force-restart"]], "FORCE_TWOCON": [[1182, null], [1222, "force-twocon"]], "FRAC_DIIS": [[1231, "frac-diis"], [1557, null]], "FRAC_LOAD": [[1231, "frac-load"], [1558, null]], "FRAC_OCC": [[1231, "frac-occ"], [1559, null]], "FRAC_RENORMALIZE": [[1231, "frac-renormalize"], [1560, null]], "FRAC_START": [[1231, "frac-start"], [1561, null]], "FRAC_VAL": [[1231, "frac-val"], [1562, null]], "FRAG_MODE": [[1226, "frag-mode"], [1313, null]], "FRAG_REF_ATOMS": [[1226, "frag-ref-atoms"], [1314, null]], "FREEZE_ALL_DIHEDRALS": [[1226, "freeze-all-dihedrals"], [1315, null]], "FREEZE_CORE": [[1125, null], [1221, "freeze-core"], [1230, "freeze-core"], [1454, null], [1771, "freeze-core"], [1837, "freeze-core"], [1837, "id24"]], "FREEZE_CORE_POLICY": [[1126, null], [1221, "freeze-core-policy"]], "FREEZE_INTERFRAG": [[1226, "freeze-interfrag"], [1316, null]], "FREEZE_INTRAFRAG": [[1226, "freeze-intrafrag"], [1317, null]], "FROZEN_BEND": [[1226, "frozen-bend"], [1318, null]], "FROZEN_CARTESIAN": [[1226, "frozen-cartesian"], [1319, null]], "FROZEN_DIHEDRAL": [[1226, "frozen-dihedral"], [1320, null]], "FROZEN_DISTANCE": [[1226, "frozen-distance"], [1321, null]], "FROZEN_DOCC": [[1127, null], [1221, "frozen-docc"], [1755, "frozen-docc"]], "FROZEN_OOFP": [[1226, "frozen-oofp"], [1322, null]], "FROZEN_UOCC": [[1128, null], [1221, "frozen-uocc"], [1755, "frozen-uocc"]], "FULL_HESS_EVERY": [[1226, "full-hess-every"], [1323, null], [1802, "full-hess-every"]], "FULL_MATRIX": [[477, null], [1200, "full-matrix"]], "F_CUT": [[972, null], [1214, "f-cut"]], "File Formats": [[2, "file-formats"]], "File Handling": [[1210, "file-handling"]], "Files in a Plugin Directory": [[1808, "files-in-a-plugin-directory"]], "Finalize release": [[1788, "finalize-release"]], "Find-the-code Quiz": [[1737, "find-the-code-quiz"]], "FittedSlaterCorrelationFactor": [[77, null]], "FittingMetric": [[78, null]], "Fork from GitHub Repository": [[1737, "fork-from-github-repository"]], "Fractional Occupation UHF/UKS": [[1231, "fractional-occupation-uhf-uks"]], "Fractional Particle Curves": [[1757, "fractional-particle-curves"]], "Fragment Library": [[1782, "fragment-library"]], "Fragment/Internal Coordinate Control": [[1226, "fragment-internal-coordinate-control"]], "FragmentType": [[79, null]], "Frozen natural orbitals (FNO)": [[1771, "frozen-natural-orbitals-fno"]], "Function Intercalls": [[1779, null]], "Functional": [[80, null]], "Functional Selection": [[1757, "functional-selection"]], "Functionality": [[1743, "functionality"]], "Functions": [[1772, "functions"], [1827, "functions"], [1827, "id1"], [1827, "id4"]], "Further keywords for ddx": [[1754, "further-keywords-for-ddx"]], "GAUGE": [[402, null], [414, null], [539, null], [1197, "gauge"], [1198, "gauge"], [1203, "gauge"], [1742, "gauge"]], "GCP": [[1718, null]], "GDMA": [[1220, null], [1681, null], [1719, null]], "GDMA_LIMIT": [[1097, null], [1220, "gdma-limit"], [1775, "gdma-limit"]], "GDMA_MULTIPOLE_UNITS": [[1098, null], [1220, "gdma-multipole-units"], [1775, "gdma-multipole-units"]], "GDMA_ORIGIN": [[1099, null], [1220, "gdma-origin"], [1775, "gdma-origin"]], "GDMA_RADIUS": [[1100, null], [1220, "gdma-radius"], [1775, "gdma-radius"]], "GDMA_SWITCH": [[1101, null], [1220, "gdma-switch"], [1775, "gdma-switch"]], "GEOM_MAXITER": [[1226, "geom-maxiter"], [1325, null], [1802, "geom-maxiter"]], "GGA": [[1758, "gga"]], "GGA functionals available in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1699, null], [1758, "id2"]], "GLOBALS": [[1221, null]], "GPU_DFCC": [[1720, null]], "GRADIENT_WRITE": [[1025, null], [1217, "gradient-write"]], "GUESS": [[1231, "guess"], [1563, null]], "GUESS_MIX": [[1231, "guess-mix"], [1564, null]], "GUESS_PERSIST": [[1231, "guess-persist"], [1565, null]], "GUESS_R_CONVERGENCE": [[739, null], [1208, "guess-r-convergence"]], "GUESS_VECTOR": [[830, null], [1210, "guess-vector"]], "G_CONVERGENCE": [[1226, "g-convergence"], [1324, null], [1802, "g-convergence"]], "Gaussian": [[322, null]], "GaussianShell": [[81, null]], "GaussianType": [[82, null]], "General": [[1197, "general"], [1198, "general"], [1199, "general"], [1200, "general"], [1201, "general"], [1202, "general"], [1203, "general"], [1204, "general"], [1205, "general"], [1207, "general"], [1208, "general"], [1209, "general"], [1211, "general"], [1212, "general"], [1213, "general"], [1215, "general"], [1216, "general"], [1217, "general"], [1218, "general"], [1219, "general"], [1220, "general"], [1221, "general"], [1222, "general"], [1223, "general"], [1224, "general"], [1225, "general"], [1227, "general"], [1228, "general"], [1229, "general"], [1232, "general"]], "General Options": [[1210, "general-options"], [1214, "general-options"]], "General Wavefunction Info": [[1231, "general-wavefunction-info"]], "General layout of the core: where new C++ code should live": [[1823, null]], "General-Order Coupled-Cluster": [[1210, "general-order-coupled-cluster"]], "General-Order Perturbation Theory": [[1210, "general-order-perturbation-theory"]], "Generate download page for psicode.org": [[1788, "generate-download-page-for-psicode-org"]], "Generation of Cube Files \u2014 cubeprop()": [[1750, null]], "Geometry Optimization": [[1802, null]], "Geometry Optimization and Vibrational Frequency Analysis": [[1844, "geometry-optimization-and-vibrational-frequency-analysis"]], "Geometry Optimization \u2014 optimize() and gradient()": [[1800, null]], "GeometryUnits": [[83, null]], "Ghost Atoms": [[1833, "ghost-atoms"]], "Git, Versioning": [[1786, null]], "Gn theory": [[1771, "gn-theory"]], "Grid Selection": [[1757, "grid-selection"]], "Guess Vectors": [[1210, "guess-vectors"]], "H0_BLOCKSIZE": [[833, null], [1210, "h0-blocksize"]], "H0_BLOCK_COUPLING": [[831, null], [1210, "h0-block-coupling"]], "H0_BLOCK_COUPLING_SIZE": [[832, null], [1210, "h0-block-coupling-size"]], "H0_GUESS_SIZE": [[834, null], [1210, "h0-guess-size"]], "HBC6": [[1692, "hbc6"], [1752, "hbc6"]], "HD_AVG": [[835, null], [1210, "hd-avg"]], "HD_OTF": [[836, null], [1210, "hd-otf"]], "HEFF4": [[1229, "heff4"], [1413, null]], "HEFF_PRINT": [[1229, "heff-print"], [1414, null]], "HESSIAN_WRITE": [[1026, null], [1217, "hessian-write"]], "HESS_TYPE": [[926, null], [1213, "hess-type"], [1798, "hess-type"]], "HESS_UPDATE": [[1226, "hess-update"], [1329, null]], "HESS_UPDATE_LIMIT": [[1226, "hess-update-limit"], [1330, null]], "HESS_UPDATE_LIMIT_MAX": [[1226, "hess-update-limit-max"], [1331, null]], "HESS_UPDATE_LIMIT_SCALE": [[1226, "hess-update-limit-scale"], [1332, null]], "HESS_UPDATE_USE_LAST": [[1226, "hess-update-use-last"], [1333, null]], "HF": [[84, null]], "HF: Hartree\u2013Fock Theory": [[1838, null]], "HSG": [[1692, "hsg"], [1752, "hsg"]], "HTBH": [[1692, "htbh"], [1752, "htbh"]], "HTR40": [[1692, "htr40"], [1752, "htr40"]], "H_BOND_CONNECT": [[1226, "h-bond-connect"], [1326, null]], "H_GUESS_EVERY": [[1226, "h-guess-every"], [1327, null]], "H_UPDATE_DEN_TOL": [[1226, "h-update-den-tol"], [1328, null]], "Handling Options in Driver": [[1801, "handling-options-in-driver"]], "Harmonic Vibrational Analysis and Visualization of Normal Modes \u2014 frequency() and hessian()": [[1772, null]], "Header": [[1820, "header"]], "Hessian": [[1802, "hessian"]], "Hessian Update": [[1226, "hessian-update"]], "Higher-Order Exchange Terms without Single-Exchange Approximation": [[1837, "higher-order-exchange-terms-without-single-exchange-approximation"]], "Higher-Order SAPT": [[1837, "higher-order-sapt"]], "How and when to not apply code styling to your contributions": [[1747, "how-and-when-to-not-apply-code-styling-to-your-contributions"]], "How do I retain specific Psi4 scratch files": [[1738, "how-do-i-retain-specific-psi4-scratch-files"]], "How to Ignore the Bots": [[1822, "how-to-ignore-the-bots"]], "How to build and install Psi4, the compact version": [[1738, "how-to-build-and-install-psi4-the-compact-version"]], "How to build, test, and install Psi4, in detail": [[1738, "how-to-build-test-and-install-psi4-in-detail"]], "How to bump a version": [[1786, "how-to-bump-a-version"]], "How to call BLAS & LAPACK in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1810, "how-to-call-blas-lapack-in-psifour"]], "How to choose the compilation directory, {objdir}": [[1738, "how-to-choose-the-compilation-directory-objdir"]], "How to compile for debugging": [[1738, "how-to-compile-for-debugging"]], "How to configure BLAS/LAPACK for building Psi4": [[1738, "how-to-configure-blas-lapack-for-building-psi4"]], "How to configure C++ and C compilers for building Psi4": [[1738, "how-to-configure-c-and-c-compilers-for-building-psi4"]], "How to configure CPPE for building Psi4": [[1749, "how-to-configure-cppe-for-building-psi4"]], "How to configure CheMPS2 for building Psi4": [[1746, "how-to-configure-chemps2-for-building-psi4"]], "How to configure Fortran compilers for building Psi4": [[1738, "how-to-configure-fortran-compilers-for-building-psi4"]], "How to configure LibECPInt for building Psi4": [[1765, "how-to-configure-libecpint-for-building-psi4"]], "How to configure Libint for building Psi4": [[1783, "how-to-configure-libint-for-building-psi4"]], "How to configure Libxc for building Psi4": [[1784, "how-to-configure-libxc-for-building-psi4"]], "How to configure PCMSolver for building Psi4": [[1803, "how-to-configure-pcmsolver-for-building-psi4"]], "How to configure Python for building Psi4": [[1738, "how-to-configure-python-for-building-psi4"]], "How to configure a Psi4 build on Cray": [[1738, "how-to-configure-a-psi4-build-on-cray"]], "How to configure adcc for building Psi4": [[1, "how-to-configure-adcc-for-building-psi4"]], "How to configure code to use high angular momentum basis sets": [[1738, "how-to-configure-code-to-use-high-angular-momentum-basis-sets"]], "How to configure ddx for building Psi4": [[1754, "how-to-configure-ddx-for-building-psi4"]], "How to configure dkh for building Psi4": [[1762, "how-to-configure-dkh-for-building-psi4"]], "How to configure gau2gridfor building Psi4": [[1773, "how-to-configure-gau2gridfor-building-psi4"]], "How to configure gdma for building Psi4": [[1775, "how-to-configure-gdma-for-building-psi4"]], "How to configure libefp for building Psi4": [[1782, "how-to-configure-libefp-for-building-psi4"]], "How to configure paths for PsiAPI": [[1738, "how-to-configure-paths-for-psiapi"]], "How to configure simint for building Psi4": [[1839, "how-to-configure-simint-for-building-psi4"]], "How to create and remove an annotated Git tag on a remote": [[1786, "how-to-create-and-remove-an-annotated-git-tag-on-a-remote"]], "How to do GitHub issue management and code review": [[1786, "how-to-do-github-issue-management-and-code-review"]], "How to find tests without output.ref": [[1786, "how-to-find-tests-without-output-ref"]], "How to find the Psi4 module from the executable and vice versa": [[1738, "how-to-find-the-psi4-module-from-the-executable-and-vice-versa"]], "How to fix \u201cPsi4 undefined\u201d version": [[1786, "how-to-fix-psi4-undefined-version"]], "How to fix \u201ccannot import name \u2018core\u2019 from {top-level-psi4-dir}": [[1786, "how-to-fix-cannot-import-name-core-from-top-level-psi4-dir"]], "How to fix \u201cplugin needed to handle lto object\u201d when building CheMPS2": [[1746, "how-to-fix-plugin-needed-to-handle-lto-object-when-building-chemps2"]], "How to fix \u201cundefined symbol: _Py_FalseStruct\u201d": [[1738, "how-to-fix-undefined-symbol-py-falsestruct"]], "How to get a Psi4 logo file": [[1738, "how-to-get-a-psi4-logo-file"]], "How to get high angular momentum integrals from conda": [[1738, "how-to-get-high-angular-momentum-integrals-from-conda"]], "How to handle \u201cruntime library may be hidden\u201d when building with Anaconda Python": [[1738, "how-to-handle-runtime-library-may-be-hidden-when-building-with-anaconda-python"]], "How to highlight git merge conflicts in vi": [[1738, "how-to-highlight-git-merge-conflicts-in-vi"]], "How to impose code style through Git hooks": [[1747, "how-to-impose-code-style-through-git-hooks"]], "How to impose code style through your editor": [[1747, "how-to-impose-code-style-through-your-editor"]], "How to install a Psi4 binary into an Ana/Miniconda distribution": [[1748, "how-to-install-a-psi4-binary-into-an-ana-miniconda-distribution"]], "How to install a Psi4 binary with the Psi4conda installer, command-line": [[1748, "how-to-install-a-psi4-binary-with-the-psi4conda-installer-command-line"]], "How to install a Psi4 binary with the Psi4conda installer, download site": [[1748, "how-to-install-a-psi4-binary-with-the-psi4conda-installer-download-site"]], "How to install elsewhere than /usr/local/psi4": [[1738, "how-to-install-elsewhere-than-usr-local-psi4"]], "How to integrate an Add-On into build, testing, and docs": [[1785, "how-to-integrate-an-add-on-into-build-testing-and-docs"]], "How to locate non-ascii characters in the codebase": [[1786, "how-to-locate-non-ascii-characters-in-the-codebase"]], "How to name keywords in psi4/src/read_options.cc": [[1785, "how-to-name-keywords-in-psi4-src-read-options-cc"]], "How to name orbital bases (e.g., AO & SO)": [[1810, "how-to-name-orbital-bases-e-g-ao-so"]], "How to name orbital dimensions": [[1810, "how-to-name-orbital-dimensions"]], "How to name orbital spaces (e.g., docc)": [[1810, "how-to-name-orbital-spaces-e-g-docc"]], "How to obtain C and C++ compilers for Mac without Fink, MacPorts, or Homebrew": [[1738, "how-to-obtain-c-and-c-compilers-for-mac-without-fink-macports-or-homebrew"]], "How to obtain Psi4: start with find-the-code quiz, end in {top-level-psi4-dir}": [[1737, "how-to-obtain-psi4-start-with-find-the-code-quiz-end-in-top-level-psi4-dir"]], "How to obtain a Fortran compiler for Mac without Fink, MacPorts, or Homebrew": [[1738, "how-to-obtain-a-fortran-compiler-for-mac-without-fink-macports-or-homebrew"]], "How to refer to Psi4": [[1738, "how-to-refer-to-psi4"]], "How to run Psi4 as Python module after compilation": [[1738, "how-to-run-psi4-as-python-module-after-compilation"]], "How to run Psi4 as executable after compilation": [[1738, "how-to-run-psi4-as-executable-after-compilation"]], "How to run Psi4 as executable after compilation using driver from source": [[1738, "how-to-run-psi4-as-executable-after-compilation-using-driver-from-source"]], "How to run Psi4 as executable or Python module from conda installation": [[1738, "how-to-run-psi4-as-executable-or-python-module-from-conda-installation"]], "How to run a minute\u2019s worth of tests": [[1738, "how-to-run-a-minute-s-worth-of-tests"]], "How to run a subset of tests": [[1738, "how-to-run-a-subset-of-tests"]], "How to run code-style tools clang-format and yapf manually": [[1747, "how-to-run-code-style-tools-clang-format-and-yapf-manually"]], "How to satisfy the GCC >= 4.9 requirement on Linux without updating the OS": [[1738, "how-to-satisfy-the-gcc-4-9-requirement-on-linux-without-updating-the-os"]], "How to save configuration settings for a future compilation": [[1738, "how-to-save-configuration-settings-for-a-future-compilation"]], "How to see CTest testing errors": [[1738, "how-to-see-ctest-testing-errors"]], "How to see the actual compiling commands (or errors) with cmake": [[1738, "how-to-see-the-actual-compiling-commands-or-errors-with-cmake"]], "How to see what build configuration options are available": [[1738, "how-to-see-what-build-configuration-options-are-available"]], "How to set up the scratch directory": [[1738, "how-to-set-up-the-scratch-directory"]], "How to solve ModuleNotFoundError: No module named 'psi4'": [[1738, "how-to-solve-modulenotfounderror-no-module-named-psi4"]], "How to test a Psi4 installation": [[1738, "how-to-test-a-psi4-installation"]], "How to update a Psi4 binary": [[1748, "how-to-update-a-psi4-binary"]], "How to update and rebuild Psi4": [[1738, "how-to-update-and-rebuild-psi4"]], "How to use Psi4 within a PBS queue": [[1738, "how-to-use-psi4-within-a-pbs-queue"]], "How to use a local Add-On repository in the Psi4 build": [[1738, "how-to-use-a-local-add-on-repository-in-the-psi4-build"]], "How to use an Add-On\u2019s name in directory structure, build, and distribution": [[1785, "how-to-use-an-add-on-s-name-in-directory-structure-build-and-distribution"]], "How to use conda to compile Psi4 faster and easier": [[1748, "how-to-use-conda-to-compile-psi4-faster-and-easier"]], "How to use conda to get a Psi4 development environment": [[1738, "how-to-use-conda-to-get-a-psi4-development-environment"]], "How to use gdb and lldb with Psi4": [[1738, "how-to-use-gdb-and-lldb-with-psi4"]], "How to use logging in Psi4": [[1738, "how-to-use-logging-in-psi4"]], "How to use low-level BLAS/LAPACK with psi4.core.Matrix": [[1810, "how-to-use-low-level-blas-lapack-with-psi4-core-matrix"]], "Hybrid": [[1758, "hybrid"]], "Hybrid functionals available in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1700, null], [1758, "id5"]], "I-SAPT: A Representative Example": [[1770, "i-sapt-a-representative-example"]], "I. Basic Input Structure": [[1828, "I.-Basic-Input-Structure"]], "ICORE": [[837, null], [1210, "icore"], [1755, "icore"]], "IDAMAX": [[85, null]], "II. Running a Basic Hartree-Fock Calculation": [[1828, "II.-Running-a-Basic-Hartree-Fock-Calculation"]], "III. Geometry Optimization and Vibrational Frequency Analysis": [[1828, "III.-Geometry-Optimization-and-Vibrational-Frequency-Analysis"]], "INCFOCK": [[1231, "incfock"], [1566, null]], "INCFOCK_CONVERGENCE": [[1231, "incfock-convergence"], [1567, null]], "INCFOCK_FULL_FOCK_EVERY": [[1231, "incfock-full-fock-every"], [1568, null]], "INDUCED_CONVERGENCE": [[1228, "induced-convergence"], [1389, null], [1749, "induced-convergence"]], "INTCOS_GENERATE_EXIT": [[1226, "intcos-generate-exit"], [1334, null]], "INTEGRAL_CUTOFF": [[927, null], [1213, "integral-cutoff"]], "INTEGRAL_PACKAGE": [[1129, null], [1221, "integral-package"]], "INTERFRAGMENT_CONNECT": [[1226, "interfragment-connect"], [1341, null]], "INTERFRAG_COLLINEAR_TOL": [[1226, "interfrag-collinear-tol"], [1335, null]], "INTERFRAG_COORDS": [[1226, "interfrag-coords"], [1336, null]], "INTERFRAG_DIST_INV": [[1226, "interfrag-dist-inv"], [1337, null]], "INTERFRAG_HESS": [[1226, "interfrag-hess"], [1338, null]], "INTERFRAG_MODE": [[1226, "interfrag-mode"], [1339, null]], "INTERFRAG_STEP_LIMIT": [[1226, "interfrag-step-limit"], [1340, null]], "INTERNAL_ROTATIONS": [[1183, null], [1222, "internal-rotations"]], "INTRAFRAG_HESS": [[1226, "intrafrag-hess"], [1342, null]], "INTRAFRAG_STEP_LIMIT": [[1226, "intrafrag-step-limit"], [1343, null]], "INTRAFRAG_STEP_LIMIT_MAX": [[1226, "intrafrag-step-limit-max"], [1344, null]], "INTRAFRAG_STEP_LIMIT_MIN": [[1226, "intrafrag-step-limit-min"], [1345, null]], "INTS_TOLERANCE": [[415, null], [740, null], [905, null], [1053, null], [1198, "ints-tolerance"], [1208, "ints-tolerance"], [1212, "ints-tolerance"], [1218, "ints-tolerance"], [1224, "ints-tolerance"], [1230, "ints-tolerance"], [1231, "ints-tolerance"], [1234, null], [1455, null], [1569, null], [1837, "ints-tolerance"], [1837, "id26"]], "IO": [[86, null]], "IOManager": [[87, null]], "IP Fitting": [[1757, "ip-fitting"]], "IP_POLES": [[1225, "ip-poles"], [1264, null]], "IRC_DIRECTION": [[1226, "irc-direction"], [1346, null]], "IRC_POINTS": [[1226, "irc-points"], [1347, null]], "IRC_STEP_SIZE": [[1226, "irc-step-size"], [1348, null]], "ISOTROPIC_POL": [[1228, "isotropic-pol"], [1390, null], [1749, "isotropic-pol"]], "ISTOP": [[838, null], [1210, "istop"]], "IV. Analysis of Intermolecular Interactions": [[1828, "IV.-Analysis-of-Intermolecular-Interactions"]], "Important BLAS Routines": [[1810, "important-blas-routines"]], "Important Lapack Routines": [[1810, "important-lapack-routines"]], "Important User Changes from cpp-optking": [[1802, "important-user-changes-from-cpp-optking"]], "InPsight": [[323, null]], "Incorporating code into <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1824, "incorporating-code-into-psifour"]], "Initial Guess": [[1838, "initial-guess"]], "Initialize release branch": [[1788, "initialize-release-branch"]], "Input": [[1762, "input"], [1775, "input"]], "Inputting effective core potentials (ECPs)": [[1730, "inputting-effective-core-potentials-ecps"]], "Installation": [[1, "installation"], [1743, "installation"], [1746, "installation"], [1749, "installation"], [1754, "installation"], [1759, "installation"], [1762, "installation"], [1765, "installation"], [1773, "installation"], [1774, "installation"], [1775, "installation"], [1782, "installation"], [1783, "installation"], [1784, "installation"], [1792, "installation"], [1803, "installation"], [1805, "installation"], [1806, "installation"], [1807, "installation"], [1839, "installation"]], "Installation and Runtime Configuration": [[1767, null]], "Installing BrianQC": [[1735, "installing-brianqc"]], "Installing Sphinx": [[1764, "installing-sphinx"]], "Instantiating integral objects": [[1817, "instantiating-integral-objects"]], "IntVector": [[88, null]], "Integral consuming technologies": [[1823, "integral-consuming-technologies"]], "Integral-Direct Density-Fitted Coulomb Construction": [[1838, "integral-direct-density-fitted-coulomb-construction"]], "IntegralFactory": [[89, null]], "IntegralTransform": [[90, null]], "Integrals in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1817, null]], "Integrating New Features into <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1815, null]], "Interface Details": [[1792, "interface-details"]], "Interface to CFOUR by J. Stanton & J. Gauss": [[1743, null]], "Interface to CPPE by M. Scheurer": [[1749, null]], "Interface to CheMPS2 by S. Wouters": [[1746, null]], "Interface to DFTD3 by S. Grimme": [[1759, null]], "Interface to DKH by A. Wolf, M. Reiher, and B. A. Hess": [[1762, null]], "Interface to GDMA Distributed Multipole Analysis by A. J. Stone \u2014 gdma()": [[1775, null]], "Interface to GeomeTRIC": [[1802, "interface-to-geometric"]], "Interface to LIBEFP by I. Kaliman": [[1782, null]], "Interface to LibECPInt by R. Shaw": [[1765, null]], "Interface to Libint by E. Valeev": [[1783, null]], "Interface to Libxc by M. A. L. Marques": [[1784, null]], "Interface to MRCC by M. K\u00e1llay": [[1792, null]], "Interface to Molden \u2014 molden()": [[1791, null]], "Interface to NumPy": [[1797, null]], "Interface to PCMSolver by R. Di Remigio": [[1803, null]], "Interface to SIMINT by B. Pritchard": [[1839, null]], "Interface to adcc": [[0, "interface-to-adcc"]], "Interface to adcc by M. F. Herbst and M. Scheurer": [[1, null]], "Interface to ddx by A. Mikhalev, A. Jha, M. Nottoli and M. F. Herbst": [[1754, null]], "Interface to gCP by S. Grimme": [[1774, null]], "Interface to gau2grid by D. G. A. Smith": [[1773, null]], "Interface to programs through FCHK files \u2014 fchk()": [[1769, null]], "Interface to the BrianQC GPU module by the BrianQC team": [[1735, null]], "Interfaces: Enhancing <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span> Capabilities": [[1780, null]], "Interfacing with <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1814, "interfacing-with-psifour"]], "Interpreting SAPT Results": [[1837, "interpreting-sapt-results"]], "Introduction": [[1750, "introduction"], [1756, "introduction"], [1763, "introduction"], [1781, null], [1798, "introduction"], [1817, "introduction"], [1838, "introduction"], [1841, "introduction"]], "Introduction to Programming in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1818, null]], "IrreducibleRepresentation": [[91, null]], "Isotopic Substitution": [[1833, "isotopic-substitution"]], "Iterative Algorithms": [[1753, "iterative-algorithms"]], "Iterative solver parameters": [[1754, "iterative-solver-parameters"]], "JK": [[92, null]], "JOBTYPE": [[516, null], [1202, "jobtype"]], "JSCH": [[1692, "jsch"], [1752, "jsch"]], "JSON": [[1721, null]], "Job Control Keywords": [[1832, "job-control-keywords"]], "KIND": [[1, "kind"], [403, null], [1197, "kind"]], "Keywords": [[400, "keywords"], [1735, "keywords"], [1750, "keywords"], [1762, "keywords"], [1836, "keywords"], [1843, "keywords"]], "Keywords by Alpha": [[1704, null]], "Keywords by Module": [[1705, null]], "Keywords for CPPE": [[1749, "keywords-for-cppe"]], "Keywords for PCMSolver": [[1803, "keywords-for-pcmsolver"]], "Keywords for adcc": [[1, "keywords-for-adcc"]], "KineticInt": [[93, null]], "Known limitations": [[1841, "known-limitations"]], "LAPACK Wrappers": [[1810, "lapack-wrappers"]], "LEVEL_SHIFT": [[928, null], [1184, null], [1213, "level-shift"], [1222, "level-shift"], [1225, "level-shift"], [1231, "level-shift"], [1265, null], [1570, null]], "LEVEL_SHIFT_CUTOFF": [[1231, "level-shift-cutoff"], [1571, null]], "LIBEFP": [[1722, null]], "LINEAR": [[540, null], [1203, "linear"]], "LINEQ_SOLVER": [[929, null], [1213, "lineq-solver"]], "LINK_INTS_TOLERANCE": [[1231, "link-ints-tolerance"], [1572, null]], "LITERAL_CFOUR": [[1130, null], [1221, "literal-cfour"]], "LOCAL": [[441, null], [478, null], [517, null], [541, null], [1199, "local"], [1200, "local"], [1202, "local"], [1203, "local"]], "LOCAL_CONVERGENCE": [[973, null], [1054, null], [1214, "local-convergence"], [1218, "local-convergence"], [1231, "local-convergence"], [1573, null]], "LOCAL_CPHF_CUTOFF": [[442, null], [518, null], [542, null], [1199, "local-cphf-cutoff"], [1202, "local-cphf-cutoff"], [1203, "local-cphf-cutoff"]], "LOCAL_CUTOFF": [[443, null], [479, null], [519, null], [543, null], [1199, "local-cutoff"], [1200, "local-cutoff"], [1202, "local-cutoff"], [1203, "local-cutoff"]], "LOCAL_DO_SINGLES": [[480, null], [1200, "local-do-singles"]], "LOCAL_FILTER_SINGLES": [[481, null], [520, null], [544, null], [1200, "local-filter-singles"], [1202, "local-filter-singles"], [1203, "local-filter-singles"]], "LOCAL_IBO_CONDITION": [[1055, null], [1218, "local-ibo-condition"]], "LOCAL_IBO_POWER": [[1056, null], [1218, "local-ibo-power"]], "LOCAL_IBO_STARS": [[1057, null], [1218, "local-ibo-stars"]], "LOCAL_IBO_STARS_COMPLETENESS": [[1058, null], [1218, "local-ibo-stars-completeness"]], "LOCAL_IBO_USE_STARS": [[1059, null], [1218, "local-ibo-use-stars"]], "LOCAL_MAXITER": [[974, null], [1060, null], [1214, "local-maxiter"], [1218, "local-maxiter"], [1231, "local-maxiter"], [1574, null]], "LOCAL_METHOD": [[444, null], [482, null], [521, null], [545, null], [1199, "local-method"], [1200, "local-method"], [1202, "local-method"], [1203, "local-method"]], "LOCAL_PAIRDEF": [[445, null], [522, null], [546, null], [1199, "local-pairdef"], [1202, "local-pairdef"], [1203, "local-pairdef"]], "LOCAL_PRECONDITIONER": [[483, null], [1200, "local-preconditioner"]], "LOCAL_USE_GHOSTS": [[1061, null], [1218, "local-use-ghosts"]], "LOCAL_WEAKP": [[446, null], [484, null], [523, null], [547, null], [1199, "local-weakp"], [1200, "local-weakp"], [1202, "local-weakp"], [1203, "local-weakp"]], "LOCK_SINGLET": [[1229, "lock-singlet"], [1415, null]], "LSE": [[839, null], [1210, "lse"]], "LSE_COLLAPSE": [[840, null], [1210, "lse-collapse"]], "LSE_TOLERANCE": [[841, null], [1210, "lse-tolerance"]], "LS_THC_BASIS_TOLERANCE": [[1131, null], [1221, "ls-thc-basis-tolerance"]], "LS_THC_Computer": [[94, null]], "LS_THC_DF": [[1132, null], [1221, "ls-thc-df"]], "LS_THC_PRUNING_SCHEME": [[1133, null], [1221, "ls-thc-pruning-scheme"]], "LS_THC_RADIAL_POINTS": [[1134, null], [1221, "ls-thc-radial-points"]], "LS_THC_SPHERICAL_POINTS": [[1136, null], [1221, "ls-thc-spherical-points"]], "LS_THC_S_EPSILON": [[1135, null], [1221, "ls-thc-s-epsilon"]], "LS_THC_WEIGHTS_TOLERANCE": [[1137, null], [1221, "ls-thc-weights-tolerance"]], "LaplaceDenominator": [[95, null]], "Larger Calculations": [[1742, "larger-calculations"]], "Levels of truncation for diffuse functions in standard basis sets": [[1733, "id16"]], "LibOptions: globals, locals, has_changed and all that": [[1801, null]], "LibXCFunctional": [[96, null]], "License": [[1781, "license"]], "Linear Algebra in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1810, null]], "Linear Exchange": [[1838, "linear-exchange"]], "Linear Response (CCLR) Calculations": [[1742, "linear-response-cclr-calculations"]], "Lineshape": [[324, null]], "Link Orbital Partitioning in I-SAPT": [[1770, "link-orbital-partitioning-in-i-sapt"]], "Localizer": [[97, null]], "Long-Range Corrected": [[1758, "long-range-corrected"]], "Long-Range-Corrected functionals available in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1701, null], [1758, "id4"]], "Loops": [[1832, "loops"]], "Lorentzian": [[325, null]], "MADMP2_SLEEP": [[906, null], [1212, "madmp2-sleep"]], "MAT_NUM_COLUMN_PRINT": [[1138, null], [1221, "mat-num-column-print"]], "MAXITER": [[1, "maxiter"], [405, null], [447, null], [485, null], [524, null], [548, null], [741, null], [1062, null], [1080, null], [1185, null], [1197, "maxiter"], [1199, "maxiter"], [1200, "maxiter"], [1202, "maxiter"], [1203, "maxiter"], [1208, "maxiter"], [1218, "maxiter"], [1219, "maxiter"], [1222, "maxiter"], [1228, "maxiter"], [1229, "maxiter"], [1230, "maxiter"], [1231, "maxiter"], [1391, null], [1416, null], [1457, null], [1577, null], [1742, "maxiter"], [1749, "maxiter"], [1771, "maxiter"], [1837, "maxiter"]], "MAX_ATTEMPTS": [[1231, "max-attempts"], [1575, null]], "MAX_CCD_DIISVECS": [[1230, "max-ccd-diisvecs"], [1456, null]], "MAX_DISP_G_CONVERGENCE": [[1226, "max-disp-g-convergence"], [1349, null]], "MAX_ENERGY_G_CONVERGENCE": [[1226, "max-energy-g-convergence"], [1350, null]], "MAX_FORCE_G_CONVERGENCE": [[1226, "max-force-g-convergence"], [1351, null]], "MAX_MEM_BUF": [[1231, "max-mem-buf"], [1576, null]], "MAX_MOGRAD_CONVERGENCE": [[930, null], [1213, "max-mograd-convergence"], [1225, "max-mograd-convergence"], [1266, null], [1798, "max-mograd-convergence"], [1798, "id37"]], "MAX_NUM_VECS": [[1, "max-num-vecs"], [404, null], [842, null], [1197, "max-num-vecs"], [1210, "max-num-vecs"]], "MAX_RADIAL_MOMENT": [[1139, null], [1221, "max-radial-moment"]], "MBIS_D_CONVERGENCE": [[1140, null], [1221, "mbis-d-convergence"]], "MBIS_MAXITER": [[1141, null], [1221, "mbis-maxiter"]], "MBIS_PRUNING_SCHEME": [[1142, null], [1221, "mbis-pruning-scheme"]], "MBIS_RADIAL_POINTS": [[1143, null], [1221, "mbis-radial-points"]], "MBIS_SPHERICAL_POINTS": [[1144, null], [1221, "mbis-spherical-points"]], "MCSCF": [[1210, "mcscf"], [1222, null], [1682, null]], "MCSCF: Multi-Configurational Self-Consistent-Field": [[1789, null]], "MCSCF_ALGORITHM": [[843, null], [1210, "mcscf-algorithm"], [1789, "mcscf-algorithm"]], "MCSCF_CI_CLEANUP": [[844, null], [1210, "mcscf-ci-cleanup"]], "MCSCF_DIIS_ERROR_TYPE": [[845, null], [1210, "mcscf-diis-error-type"]], "MCSCF_DIIS_FREQ": [[846, null], [1210, "mcscf-diis-freq"]], "MCSCF_DIIS_MAX_VECS": [[847, null], [1210, "mcscf-diis-max-vecs"]], "MCSCF_DIIS_START": [[848, null], [1210, "mcscf-diis-start"], [1789, "mcscf-diis-start"]], "MCSCF_DPD_CLEANUP": [[849, null], [1210, "mcscf-dpd-cleanup"]], "MCSCF_E_CONVERGENCE": [[850, null], [1210, "mcscf-e-convergence"], [1789, "mcscf-e-convergence"]], "MCSCF_GUESS": [[851, null], [1210, "mcscf-guess"]], "MCSCF_MAXITER": [[853, null], [1210, "mcscf-maxiter"], [1789, "mcscf-maxiter"]], "MCSCF_MAX_ROT": [[852, null], [1210, "mcscf-max-rot"]], "MCSCF_ROTATE": [[855, null], [1210, "mcscf-rotate"], [1789, "mcscf-rotate"]], "MCSCF_R_CONVERGENCE": [[854, null], [1210, "mcscf-r-convergence"], [1789, "mcscf-r-convergence"]], "MCSCF_SO_START_E": [[856, null], [1210, "mcscf-so-start-e"]], "MCSCF_SO_START_GRAD": [[857, null], [1210, "mcscf-so-start-grad"]], "MCSCF_TYPE": [[858, null], [1210, "mcscf-type"], [1789, "mcscf-type"]], "MINAO_BASIS": [[1063, null], [1218, "minao-basis"]], "MINTS": [[1223, null]], "MIN_CCD_DIISVECS": [[1230, "min-ccd-diisvecs"], [1458, null]], "MIXED": [[859, null], [1210, "mixed"]], "MIXED4": [[860, null], [1210, "mixed4"]], "MODULE": [[719, null], [1207, "module"]], "MOGRAD_DAMPING": [[1225, "mograd-damping"], [1271, null]], "MOLDEN_WITH_VIRTUAL": [[1145, null], [1221, "molden-with-virtual"], [1791, "molden-with-virtual"]], "MOLDEN_WRITE": [[934, null], [1213, "molden-write"], [1231, "molden-write"], [1578, null], [1791, "molden-write"]], "MOM_OCC": [[1231, "mom-occ"], [1579, null]], "MOM_START": [[1231, "mom-start"], [1580, null]], "MOM_VIR": [[1231, "mom-vir"], [1581, null]], "MOSpace": [[98, null]], "MOWriter": [[99, null]], "MO_DIIS_NUM_VECS": [[931, null], [1213, "mo-diis-num-vecs"], [1798, "mo-diis-num-vecs"]], "MO_MAXITER": [[932, null], [1213, "mo-maxiter"], [1225, "mo-maxiter"], [1267, null], [1798, "mo-maxiter"], [1798, "id38"]], "MO_READ": [[1186, null], [1222, "mo-read"], [1225, "mo-read"], [1268, null]], "MO_STEP_MAX": [[933, null], [1213, "mo-step-max"], [1225, "mo-step-max"], [1269, null]], "MO_WRITE": [[1225, "mo-write"], [1270, null]], "MP2 Natural Orbitals": [[1837, "mp2-natural-orbitals"]], "MP2_AMPS_PRINT": [[448, null], [1199, "mp2-amps-print"], [1742, "mp2-amps-print"]], "MP2_AMP_TYPE": [[935, null], [1213, "mp2-amp-type"]], "MP2_CCSD_METHOD": [[1229, "mp2-ccsd-method"], [1417, null]], "MP2_GUESS": [[1229, "mp2-guess"], [1418, null]], "MP2_OS_SCALE": [[449, null], [907, null], [936, null], [1199, "mp2-os-scale"], [1212, "mp2-os-scale"], [1213, "mp2-os-scale"], [1225, "mp2-os-scale"], [1272, null], [1798, "mp2-os-scale"]], "MP2_SCALE_OS": [[1081, null], [1219, "mp2-scale-os"], [1771, "mp2-scale-os"]], "MP2_SCALE_SS": [[1082, null], [1219, "mp2-scale-ss"], [1771, "mp2-scale-ss"]], "MP2_SOS_SCALE": [[937, null], [1213, "mp2-sos-scale"], [1225, "mp2-sos-scale"], [1273, null], [1798, "mp2-sos-scale"]], "MP2_SOS_SCALE2": [[938, null], [1213, "mp2-sos-scale2"], [1225, "mp2-sos-scale2"], [1274, null], [1798, "mp2-sos-scale2"]], "MP2_SS_SCALE": [[450, null], [908, null], [939, null], [1199, "mp2-ss-scale"], [1212, "mp2-ss-scale"], [1213, "mp2-ss-scale"], [1225, "mp2-ss-scale"], [1275, null], [1798, "mp2-ss-scale"]], "MP2_TYPE": [[1146, null], [1221, "mp2-type"]], "MPN": [[861, null], [1210, "mpn"], [1755, "mpn"]], "MPN_ORDER_SAVE": [[862, null], [1210, "mpn-order-save"]], "MPN_SCHMIDT": [[863, null], [1210, "mpn-schmidt"]], "MPN_WIGNER": [[864, null], [1210, "mpn-wigner"]], "MP_TYPE": [[1147, null], [1221, "mp-type"]], "MRCC": [[1224, null], [1683, null], [1723, null]], "MRCC methods": [[1792, "id3"]], "MRCC_LEVEL": [[1224, "mrcc-level"], [1235, null]], "MRCC_METHOD": [[1224, "mrcc-method"], [1236, null]], "MRCC_NUM_DOUBLET_ROOTS": [[1224, "mrcc-num-doublet-roots"], [1237, null]], "MRCC_NUM_SINGLET_ROOTS": [[1224, "mrcc-num-singlet-roots"], [1238, null]], "MRCC_NUM_TRIPLET_ROOTS": [[1224, "mrcc-num-triplet-roots"], [1239, null]], "MRCC_OMP_NUM_THREADS": [[1224, "mrcc-omp-num-threads"], [1240, null]], "MRCC_RESTART": [[1224, "mrcc-restart"], [1241, null]], "MS0": [[865, null], [1210, "ms0"]], "Managed Methods": [[1809, "managed-methods"]], "ManagedMethodError": [[268, null]], "Managing Code": [[1736, "managing-code"]], "Managing: Git, Conda, CMake and all that": [[1787, null]], "Many-body perturbation theory": [[1771, "many-body-perturbation-theory"]], "Mark virtual functions in derived classes with override": [[1821, "mark-virtual-functions-in-derived-classes-with-override"]], "Math in the Codebase": [[1764, "math-in-the-codebase"]], "Matrix": [[100, null]], "Matrix to Array": [[1797, "matrix-to-array"]], "MatrixFactory": [[101, null]], "MemDFJK": [[102, null]], "Memory Specification": [[1832, "memory-specification"]], "Meta": [[1758, "meta"]], "Meta functionals available in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1702, null], [1758, "id3"]], "Methods": [[1746, "methods"], [1753, "methods"], [1798, "methods"]], "Methods Summary": [[1753, "methods-summary"]], "Minimal Basis Iterative Stockholder": [[1799, "minimal-basis-iterative-stockholder"]], "Minimal Input": [[1753, "minimal-input"], [1757, "minimal-input"], [1838, "minimal-input"]], "MintsHelper": [[103, null]], "Misc.": [[1226, "misc"], [1788, "misc"]], "Misc. Running": [[1743, "misc-running"]], "Miscellaneous": [[400, "miscellaneous"], [1736, "miscellaneous"], [1814, "miscellaneous"]], "MissingMethodError": [[269, null]], "Mixing Basis Sets": [[1730, "mixing-basis-sets"]], "Modular Approach to Development": [[1808, "modular-approach-to-development"]], "Modules in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1814, "modules-in-psifour"]], "Molden Interface Keywords": [[1772, "molden-interface-keywords"]], "MoldenWriter": [[104, null]], "MolecularGrid": [[105, null]], "Molecule": [[106, null]], "Molecule Keywords": [[1833, "molecule-keywords"]], "Molecule Specification": [[1782, "molecule-specification"]], "Molecule and Geometry Specification": [[1832, "molecule-and-geometry-specification"], [1833, null]], "Monomer-Centered Basis Computations": [[1837, "monomer-centered-basis-computations"]], "Mukherjee State-Specific Multi-Reference Coupled Cluster (Mk-MRCC)": [[1781, "mukherjee-state-specific-multi-reference-coupled-cluster-mk-mrcc"]], "Multi-Fragment Optimizations": [[1802, "multi-fragment-optimizations"]], "Multiple Molecules": [[1833, "multiple-molecules"]], "MultipoleInt": [[107, null]], "MultipoleSymmetry": [[108, null]], "Multireference Dimensions": [[1810, "multireference-dimensions"]], "NAT_ORBS": [[866, null], [940, null], [1083, null], [1210, "nat-orbs"], [1213, "nat-orbs"], [1219, "nat-orbs"], [1225, "nat-orbs"], [1276, null], [1771, "nat-orbs"], [1798, "nat-orbs"]], "NAT_ORBS_T2": [[1230, "nat-orbs-t2"], [1459, null], [1837, "nat-orbs-t2"]], "NAT_ORBS_T3": [[1230, "nat-orbs-t3"], [1460, null], [1837, "nat-orbs-t3"]], "NAT_ORBS_V4": [[1230, "nat-orbs-v4"], [1461, null], [1837, "nat-orbs-v4"]], "NBC10": [[1692, "nbc10"], [1752, "nbc10"]], "NCB31": [[1692, "ncb31"], [1752, "ncb31"]], "NEW_TRIPLES": [[451, null], [486, null], [1199, "new-triples"], [1200, "new-triples"]], "NHTBH": [[1692, "nhtbh"], [1752, "nhtbh"]], "NL_DISPERSION_PARAMETERS": [[1231, "nl-dispersion-parameters"], [1582, null]], "NORMAL_MODES_WRITE": [[1027, null], [1217, "normal-modes-write"], [1772, "normal-modes-write"]], "NO_DFILE": [[867, null], [1210, "no-dfile"]], "NO_SINGLES": [[1229, "no-singles"], [1419, null]], "NUM_AMPS_PRINT": [[452, null], [487, null], [525, null], [549, null], [868, null], [1199, "num-amps-print"], [1200, "num-amps-print"], [1202, "num-amps-print"], [1203, "num-amps-print"], [1210, "num-amps-print"], [1742, "num-amps-print"]], "NUM_CORE_ORBITALS": [[1, "num-core-orbitals"], [406, null], [1197, "num-core-orbitals"]], "NUM_DETS_PRINT": [[869, null], [1210, "num-dets-print"]], "NUM_FROZEN_DOCC": [[1148, null], [1221, "num-frozen-docc"]], "NUM_FROZEN_UOCC": [[1149, null], [1221, "num-frozen-uocc"]], "NUM_GUESSES": [[0, "num-guesses"], [1, "num-guesses"], [407, null], [1197, "num-guesses"]], "NUM_INIT_VECS": [[870, null], [1210, "num-init-vecs"]], "NUM_ROOTS": [[871, null], [1210, "num-roots"], [1755, "num-roots"]], "NablaInt": [[109, null]], "Necessary and recommended option values": [[1735, "necessary-and-recommended-option-values"]], "New Operators Available": [[1817, "new-operators-available"]], "New integral operators": [[1823, "new-integral-operators"]], "Non-Covalently Bonded Molecule Fragments": [[1833, "non-covalently-bonded-molecule-fragments"]], "Non-OO theoretical methods accessible through OCC/DFOCC": [[1798, "id72"]], "Non-QC Dependencies": [[1736, "non-qc-dependencies"]], "Notes on Options": [[1795, null], [1796, null]], "Notes on PSI Variables": [[1795, "notes-on-psi-variables"]], "NumIntHelper": [[110, null]], "NumPy Views": [[1797, "numpy-views"]], "Numerical integration and discretisation parameters": [[1754, "numerical-integration-and-discretisation-parameters"]], "O24by5": [[1692, "o24by5"], [1752, "o24by5"]], "O24by5mb": [[1692, "o24by5mb"], [1752, "o24by5mb"]], "OCC": [[1225, null], [1684, null]], "OCC: Orbital-Optimized Coupled-Cluster and M\u00f8ller\u2013Plesset Perturbation Theories": [[1798, null]], "OCC_ORBS_PRINT": [[941, null], [1213, "occ-orbs-print"], [1225, "occ-orbs-print"], [1277, null], [1798, "occ-orbs-print"]], "OCC_PERCENTAGE": [[1084, null], [1219, "occ-percentage"]], "OCC_TOLERANCE": [[1085, null], [1219, "occ-tolerance"], [1230, "occ-tolerance"], [1462, null], [1771, "occ-tolerance"], [1837, "occ-tolerance"]], "ODC_GUESS": [[742, null], [1208, "odc-guess"]], "OEPROP": [[942, null], [1213, "oeprop"], [1225, "oeprop"], [1278, null], [1685, null]], "OEProp": [[111, null]], "OFFDIAGONAL_CCSD_T": [[1229, "offdiagonal-ccsd-t"], [1420, null]], "OMEGA": [[550, null], [1203, "omega"], [1742, "omega"]], "OMEGA_ERF": [[1196, null], [1223, "omega-erf"]], "ONEPDM": [[909, null], [1212, "onepdm"]], "ONEPOT_GRID_READ": [[1231, "onepot-grid-read"], [1583, null]], "OO_SCALE": [[943, null], [1213, "oo-scale"]], "OPDM": [[743, null], [872, null], [1208, "opdm"], [1210, "opdm"], [1755, "opdm"]], "OPDM_ONLY": [[416, null], [1198, "opdm-only"]], "OPDM_RELAX": [[417, null], [910, null], [1198, "opdm-relax"], [1212, "opdm-relax"]], "OPTKING": [[1226, null]], "OPT_COORDINATES": [[1226, "opt-coordinates"], [1352, null]], "OPT_METHOD": [[944, null], [1213, "opt-method"], [1225, "opt-method"], [1279, null], [1798, "opt-method"], [1798, "id40"]], "OPT_RESTART": [[1226, "opt-restart"], [1353, null]], "OPT_TYPE": [[1226, "opt-type"], [1354, null], [1802, "opt-type"]], "ORBITALS_WRITE": [[1231, "orbitals-write"], [1584, null]], "ORBITAL_LEVEL_SHIFT": [[744, null], [1208, "orbital-level-shift"]], "ORB_OPT": [[945, null], [1213, "orb-opt"], [1225, "orb-opt"], [1280, null], [1798, "orb-opt"], [1798, "id39"]], "ORB_RESP_SOLVER": [[946, null], [1213, "orb-resp-solver"], [1225, "orb-resp-solver"], [1281, null]], "ORTH_TYPE": [[947, null], [1213, "orth-type"], [1225, "orth-type"], [1282, null], [1798, "orth-type"], [1798, "id41"]], "OS_SCALE": [[1225, "os-scale"], [1283, null]], "OVERLAP_CHECK": [[488, null], [1200, "overlap-check"]], "Objects": [[2, "objects"]], "Obtaining <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1737, null]], "Obtaining and Updating <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1736, "obtaining-and-updating-psifour"]], "On January first": [[1788, "on-january-first"]], "One Electron Integral Algorithm Overview": [[1817, "one-electron-integral-algorithm-overview"]], "One Electron Integrals in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1817, "one-electron-integrals-in-psifour"]], "OneBodyAOInt": [[112, null]], "OneBodySOInt": [[113, null]], "Optimization Algorithm": [[1226, "optimization-algorithm"]], "OptimizationConvergenceError": [[270, null]], "Optimizing Minima": [[1802, "optimizing-minima"]], "OptionState": [[326, null]], "Options": [[114, null], [1775, "options"], [1791, "options"]], "OptionsState": [[327, null]], "OptionsStateCM": [[328, null]], "Orbital Visualization with VMD": [[1750, "orbital-visualization-with-vmd"]], "Orbital ordering and selection of the model space": [[1829, "orbital-ordering-and-selection-of-the-model-space"]], "Orbital spaces for CI computations": [[1755, "id8"]], "Orbital spaces for MCSCF computations": [[1789, "id5"]], "Orbital-Optimized Post-Hartree\u2013Fock Methods": [[1781, "orbital-optimized-post-hartree-fock-methods"]], "Orbital-optimized theoretical methods accessible through OCC/DFOCC": [[1798, "id69"]], "OrbitalSpace": [[115, null]], "Order-1 Visualization with PyMol": [[1770, "order-1-visualization-with-pymol"]], "Ordering of irreducible representations (irreps) used in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1833, "id2"]], "Orthogonalization": [[1838, "orthogonalization"]], "Other F/I-SAPT Keywords": [[1770, "other-f-i-sapt-keywords"]], "Output": [[1740, "output"], [1743, "output"], [1752, "output"], [1802, "output"], [1843, "output"]], "Overall <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span> Package": [[1781, "overall-psifour-package"]], "OverlapInt": [[116, null]], "Overview": [[1781, "overview"]], "Overview of Required Steps": [[1815, "overview-of-required-steps"]], "P": [[1232, "p"], [1665, null], [1843, "p"]], "PAIR_ENERGIES_PRINT": [[453, null], [1199, "pair-energies-print"]], "PARALLEL": [[1231, "parallel"], [1585, null]], "PARENT_SYMMETRY": [[1150, null], [1221, "parent-symmetry"]], "PBS job file": [[1767, "pbs-job-file"]], "PCG_BETA_TYPE": [[948, null], [1213, "pcg-beta-type"], [1225, "pcg-beta-type"], [1284, null]], "PCG_CONVERGENCE": [[949, null], [1213, "pcg-convergence"], [1225, "pcg-convergence"], [1285, null]], "PCG_MAXITER": [[950, null], [1213, "pcg-maxiter"], [1225, "pcg-maxiter"], [1286, null]], "PCM": [[1151, null], [1221, "pcm"], [1227, null], [1686, null], [1803, "pcm"]], "PCMSOLVER": [[1724, null]], "PCMSOLVER_PARSED_FNAME": [[1227, "pcmsolver-parsed-fname"], [1377, null]], "PCM_CC_TYPE": [[1227, "pcm-cc-type"], [1375, null], [1803, "pcm-cc-type"]], "PCM_SCF_TYPE": [[1227, "pcm-scf-type"], [1376, null], [1803, "pcm-scf-type"]], "PE": [[1152, null], [1221, "pe"], [1228, null], [1687, null], [1749, "pe"]], "PEP1: Proposing PsiPEP for <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1804, null]], "PERTURB_CBS": [[1229, "perturb-cbs"], [1421, null]], "PERTURB_CBS_COUPLING": [[1229, "perturb-cbs-coupling"], [1422, null]], "PERTURB_DIPOLE": [[1231, "perturb-dipole"], [1586, null]], "PERTURB_H": [[1231, "perturb-h"], [1587, null]], "PERTURB_MAGNITUDE": [[873, null], [1210, "perturb-magnitude"], [1231, "perturb-magnitude"], [1588, null]], "PERTURB_WITH": [[1231, "perturb-with"], [1589, null]], "PE_ECP": [[1228, "pe-ecp"], [1392, null]], "PHI_POINTS": [[1231, "phi-points"], [1590, null]], "PK_ALL_NONSYM": [[1231, "pk-all-nonsym"], [1591, null]], "PK_MAX_BUCKETS": [[1231, "pk-max-buckets"], [1592, null]], "PMLocalizer": [[117, null]], "PNO_CONVERGENCE": [[975, null], [1214, "pno-convergence"]], "POINTS": [[1028, null], [1217, "points"]], "POTFILE": [[1228, "potfile"], [1393, null], [1749, "potfile"]], "PPL_TYPE": [[951, null], [1213, "ppl-type"]], "PRECONDITIONER": [[874, null], [1210, "preconditioner"]], "PRINT": [[720, null], [1021, null], [1153, null], [1207, "print"], [1216, "print"], [1221, "print"], [1230, "print"], [1463, null], [1837, "print"], [1837, "id25"]], "PRINT_BASIS": [[1231, "print-basis"], [1593, null]], "PRINT_MOS": [[1231, "print-mos"], [1594, null]], "PRINT_NOONS": [[1154, null], [1221, "print-noons"]], "PRINT_OPT_PARAMS": [[1226, "print-opt-params"], [1355, null]], "PRINT_TRAJECTORY_XYZ_FILE": [[1226, "print-trajectory-xyz-file"], [1356, null]], "PROCESS_GRID": [[1231, "process-grid"], [1595, null]], "PROPERTIES": [[1155, null], [1221, "properties"]], "PROPERTIES_ORIGIN": [[1156, null], [1221, "properties-origin"]], "PROPERTY": [[454, null], [551, null], [1199, "property"], [1203, "property"], [1742, "property"]], "PROP_ALL": [[418, null], [526, null], [1198, "prop-all"], [1202, "prop-all"]], "PROP_ROOT": [[419, null], [489, null], [527, null], [1198, "prop-root"], [1200, "prop-root"], [1202, "prop-root"]], "PROP_SYM": [[420, null], [490, null], [528, null], [1198, "prop-sym"], [1200, "prop-sym"], [1202, "prop-sym"]], "PSI Variables": [[1832, "psi-variables"]], "PSI Variables by Alpha": [[1776, null]], "PSI Variables by Module": [[1709, null]], "PSI4NUMPY": [[1725, null]], "PSIMRCC": [[1229, null], [1688, null]], "PSIMRCC Implementation of Mk-MRCC Theory": [[1829, null]], "PSIOH Intermediate Files": [[1708, null]], "PT_ENERGY": [[1229, "pt-energy"], [1423, null]], "PUREAM": [[1157, null], [1221, "puream"]], "PYTHON": [[1726, null]], "ParsingError": [[271, null]], "PastureRequiredError": [[272, null]], "Path of a PsiPEP": [[1804, "path-of-a-psipep"]], "Permitted nesting of Psithon functions": [[1779, "id1"]], "Permutational symmetry": [[1817, "permutational-symmetry"]], "PetiteList": [[118, null]], "Physical Constants": [[1706, null], [1832, "physical-constants"]], "Physical constants in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1706, "id1"]], "Plain Old Data": [[2, "plain-old-data"]], "Planning: how to configure Psi4 and invoke CMake": [[1738, "planning-how-to-configure-psi4-and-invoke-cmake"]], "Plotting one-photon absorption and electronic circular dichroism spectra": [[1841, "plotting-one-photon-absorption-and-electronic-circular-dichroism-spectra"]], "Plugin v2rdm_casscf by A. E. DePrince": [[1807, null]], "PointFunctions": [[119, null]], "PointGroup": [[120, null]], "Post-Release (e.g., v1.8.2)": [[1788, "post-release-e-g-v1-8-2"]], "Post-SCF convergence criteria defaults by calculation type 4": [[1838, "id43"]], "Potential Surface Scans and Counterpoise Correction Made Easy with Psithon": [[1844, "potential-surface-scans-and-counterpoise-correction-made-easy-with-psithon"]], "PotentialInt": [[121, null]], "Pre-Release (e.g., v1.3rc1)": [[1788, "pre-release-e-g-v1-3rc1"]], "Prefer GiB for memory printing": [[1821, "prefer-gib-for-memory-printing"]], "Prefer auto to explicit type declarations": [[1821, "prefer-auto-to-explicit-type-declarations"]], "Prefer nullptr to 0 or NULL": [[1821, "prefer-nullptr-to-0-or-null"]], "Prefer std::make_shared to direct use of new": [[1821, "prefer-std-make-shared-to-direct-use-of-new"]], "PrimitiveType": [[122, null]], "Profiling": [[1813, "profiling"]], "Programmers FAQ": [[1814, null]], "Programmers\u2019 Manual": [[1777, "programmers-manual"]], "Programming with the Core Libraries": [[1812, null]], "Prop": [[123, null]], "Properties evaluated on a grid": [[1799, "properties-evaluated-on-a-grid"]], "Property": [[1826, null]], "ProtoIntVector": [[124, null]], "ProtoVector": [[125, null]], "Psi4 Control of CFOUR": [[1206, "psi4-control-of-cfour"]], "Psi4FockCI: A General Fock-Space CI For Spin-Flip And IP/EA": [[1805, null]], "PsiAPI Tutorial: Using Psi4 as a Python Module": [[1828, null]], "PsiAPI usage": [[1841, "psiapi-usage"]], "PsiException": [[273, null]], "PsiPEP: Plans and Practices to Organize <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1830, null]], "PsiReturnType": [[126, null]], "Psithon Functions: Invoking a Calculation": [[1831, null]], "Psithon Tutorial: Using <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span> as an Executable": [[1844, null]], "Psithon keywords": [[1841, "psithon-keywords"]], "Psithon: Structuring an Input File": [[1832, null]], "PubChem Database": [[1833, "pubchem-database"]], "Publish GitHub postrelease": [[1788, "publish-github-postrelease"]], "Publish GitHub release": [[1788, "publish-github-release"]], "Publish psicode.org release": [[1788, "publish-psicode-org-release"]], "Python Style": [[1822, null]], "Python Wrappers": [[1832, "python-wrappers"]], "QC Dependencies and Extensions": [[1736, "qc-dependencies-and-extensions"]], "QCHF": [[952, null], [1213, "qchf"], [1231, "qchf"], [1596, null]], "QCISD(T), CCSD(T), MP4, and CEPA": [[1771, "qcisd-t-ccsd-t-mp4-and-cepa"]], "QCVariables (aka PSI Variables)": [[400, "qcvariables-aka-psi-variables"]], "QC_COUPLING": [[745, null], [1208, "qc-coupling"]], "QC_MODULE": [[1158, null], [1221, "qc-module"]], "QC_TYPE": [[746, null], [1208, "qc-type"]], "QMEFP": [[1022, null], [1216, "qmefp"]], "QMMM": [[274, null]], "QMMMbohr": [[275, null]], "Quadratic configuration interaction and coupled cluster": [[1771, "quadratic-configuration-interaction-and-coupled-cluster"]], "QuadrupoleInt": [[127, null]], "Quick Installation": [[1748, "quick-installation"]], "R4S": [[875, null], [1210, "r4s"]], "RADIUS": [[1231, "radius"], [1598, null]], "RANGED_BEND": [[1226, "ranged-bend"], [1357, null]], "RANGED_DIHEDRAL": [[1226, "ranged-dihedral"], [1358, null]], "RANGED_DISTANCE": [[1226, "ranged-distance"], [1359, null]], "RANGED_OOFP": [[1226, "ranged-oofp"], [1360, null]], "RAS1": [[1159, null], [1221, "ras1"]], "RAS2": [[1160, null], [1221, "ras2"]], "RAS3": [[1161, null], [1221, "ras3"]], "RAS34_MAX": [[877, null], [1210, "ras34-max"]], "RAS3_MAX": [[878, null], [1210, "ras3-max"]], "RAS4": [[1162, null], [1221, "ras4"]], "RAS4_MAX": [[879, null], [1210, "ras4-max"]], "READ_SCF_3INDEX": [[954, null], [1213, "read-scf-3index"]], "REFERENCE": [[0, "reference"], [1, "reference"], [409, null], [421, null], [456, null], [492, null], [553, null], [560, null], [565, null], [748, null], [880, null], [1187, null], [1197, "reference"], [1198, "reference"], [1199, "reference"], [1200, "reference"], [1203, "reference"], [1204, "reference"], [1205, "reference"], [1208, "reference"], [1210, "reference"], [1222, "reference"], [1231, "reference"], [1599, null], [1742, "reference"], [1755, "reference"]], "REFERENCE_SYM": [[881, null], [1210, "reference-sym"]], "REGULARIZATION": [[956, null], [1213, "regularization"]], "REG_PARAM": [[955, null], [1213, "reg-param"]], "RELATIVISTIC": [[1163, null], [1221, "relativistic"], [1762, "relativistic"], [1836, "relativistic"]], "RELAXED": [[1225, "relaxed"], [1288, null]], "RELAX_GUESS_ORBITALS": [[749, null], [1208, "relax-guess-orbitals"]], "REMP_A": [[957, null], [1213, "remp-a"], [1225, "remp-a"], [1289, null]], "REPL_OTF": [[882, null], [1210, "repl-otf"]], "RESPONSE_ALGORITHM": [[750, null], [1208, "response-algorithm"]], "RESTART": [[457, null], [530, null], [554, null], [883, null], [1199, "restart"], [1202, "restart"], [1203, "restart"], [1210, "restart"], [1742, "restart"]], "RESTART_EOM_CC3": [[493, null], [1200, "restart-eom-cc3"]], "RESTRICTED_DOCC": [[1164, null], [1221, "restricted-docc"], [1755, "restricted-docc"]], "RESTRICTED_UOCC": [[1165, null], [1221, "restricted-uocc"], [1755, "restricted-uocc"]], "RFO_FOLLOW_ROOT": [[1226, "rfo-follow-root"], [1361, null]], "RFO_NORMALIZATION_MAX": [[1226, "rfo-normalization-max"], [1362, null]], "RFO_ROOT": [[1226, "rfo-root"], [1363, null]], "RGC10": [[1692, "rgc10"], [1752, "rgc10"]], "RHF": [[128, null]], "RHF_TRIPLETS": [[494, null], [1200, "rhf-triplets"]], "RKSFunctions": [[129, null]], "RMS_DISP_G_CONVERGENCE": [[1226, "rms-disp-g-convergence"], [1364, null]], "RMS_FORCE_G_CONVERGENCE": [[1226, "rms-force-g-convergence"], [1365, null]], "RMS_MOGRAD_CONVERGENCE": [[958, null], [1213, "rms-mograd-convergence"], [1225, "rms-mograd-convergence"], [1290, null], [1798, "rms-mograd-convergence"], [1798, "id36"]], "ROHF": [[130, null]], "ROOTS_PER_IRREP": [[1, "roots-per-irrep"], [410, null], [422, null], [495, null], [531, null], [1197, "roots-per-irrep"], [1198, "roots-per-irrep"], [1200, "roots-per-irrep"], [1202, "roots-per-irrep"], [1742, "roots-per-irrep"]], "ROTATE_MO_ANGLE": [[1188, null], [1222, "rotate-mo-angle"]], "ROTATE_MO_IRREP": [[1189, null], [1222, "rotate-mo-irrep"]], "ROTATE_MO_P": [[1190, null], [1222, "rotate-mo-p"]], "ROTATE_MO_Q": [[1191, null], [1222, "rotate-mo-q"]], "ROTATIONAL_SYMMETRY_NUMBER": [[1232, "rotational-symmetry-number"], [1666, null], [1843, "rotational-symmetry-number"]], "RSE42": [[1692, "rse42"], [1752, "rse42"]], "RSRFO_ALPHA_MAX": [[1226, "rsrfo-alpha-max"], [1366, null]], "RUN_CCSD": [[1087, null], [1219, "run-ccsd"], [1771, "run-ccsd"]], "RUN_CCTRANSORT": [[561, null], [1204, "run-cctransort"]], "RUN_CEPA": [[1088, null], [1219, "run-cepa"], [1771, "run-cepa"]], "RUN_MP2": [[1089, null], [1219, "run-mp2"], [1771, "run-mp2"]], "RUN_MP3": [[1090, null], [1219, "run-mp3"], [1771, "run-mp3"]], "RUN_MP4": [[1091, null], [1219, "run-mp4"], [1771, "run-mp4"]], "R_CONVERGENCE": [[0, "r-convergence"], [1, "r-convergence"], [408, null], [455, null], [491, null], [529, null], [552, null], [747, null], [876, null], [953, null], [976, null], [1086, null], [1197, "r-convergence"], [1199, "r-convergence"], [1200, "r-convergence"], [1202, "r-convergence"], [1203, "r-convergence"], [1208, "r-convergence"], [1210, "r-convergence"], [1213, "r-convergence"], [1214, "r-convergence"], [1219, "r-convergence"], [1225, "r-convergence"], [1229, "r-convergence"], [1287, null], [1424, null], [1742, "r-convergence"], [1755, "r-convergence"], [1771, "r-convergence"], [1798, "r-convergence"], [1798, "id35"]], "R_POINTS": [[1231, "r-points"], [1597, null]], "Rapid initial development using Psi4NumPy": [[1824, "rapid-initial-development-using-psi4numpy"]], "Reading Options in Module": [[1801, "reading-options-in-module"]], "Recommendations": [[1753, "recommendations"], [1756, "recommendations"], [1757, "recommendations"], [1763, "recommendations"], [1838, "recommendations"]], "Reference": [[1762, "reference"]], "Release (e.g., v1.3)": [[1788, "release-e-g-v1-3"]], "Release Procedures": [[1788, null]], "Releasing <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1814, "releasing-psifour"]], "Reporting Bugs": [[1816, "reporting-bugs"]], "Restarting the SCF": [[1838, "restarting-the-scf"]], "Results accessible through psi4.core.Wavefunction.frequency_analysis": [[1772, "id1"]], "Return Values": [[1832, "return-values"]], "Roles of a PsiPEP Include": [[1804, "roles-of-a-psipep-include"]], "Root Following": [[1210, "root-following"]], "Run long tests": [[1788, "run-long-tests"]], "Running <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1736, "running-psifour"]], "Running ADC calculations": [[0, "running-adc-calculations"]], "Running DFTD3 or DFTD4": [[1759, "running-dftd3-or-dftd4"]], "Running EFP": [[1782, "running-efp"]], "Running MRCC": [[1792, "running-mrcc"]], "Running a Basic Hartree\u2013Fock Calculation": [[1844, "running-a-basic-hartree-fock-calculation"]], "Running for Debugging": [[2, "running-for-debugging"], [2, "id1"]], "Running gCP": [[1774, "running-gcp"]], "Running the Script": [[1750, "running-the-script"]], "Runtime Errors and Debugging": [[1736, "runtime-errors-and-debugging"]], "Runtime Setup": [[1736, "runtime-setup"]], "S": [[884, null], [1210, "s"]], "S22": [[1692, "s22"], [1752, "s22"]], "S22by5": [[1692, "s22by5"], [1752, "s22by5"]], "S66": [[1692, "s66"], [1752, "s66"]], "S66by8": [[1692, "s66by8"], [1752, "s66by8"]], "SAD Guess Algorithm": [[1231, "sad-guess-algorithm"]], "SADGuess": [[131, null]], "SAD_CHOL_TOLERANCE": [[1231, "sad-chol-tolerance"], [1603, null]], "SAD_D_CONVERGENCE": [[1231, "sad-d-convergence"], [1604, null]], "SAD_E_CONVERGENCE": [[1231, "sad-e-convergence"], [1605, null]], "SAD_FRAC_OCC": [[1231, "sad-frac-occ"], [1606, null]], "SAD_MAXITER": [[1231, "sad-maxiter"], [1607, null]], "SAD_PRINT": [[1231, "sad-print"], [1608, null]], "SAD_SCF_TYPE": [[1231, "sad-scf-type"], [1609, null]], "SAD_SPIN_AVERAGE": [[1231, "sad-spin-average"], [1610, null]], "SAPGAU_BASIS": [[1231, "sapgau-basis"], [1611, null]], "SAPT": [[1230, null], [1231, "sapt"], [1612, null], [1689, null]], "SAPT(DFT)": [[1230, "sapt-dft"], [1837, "sapt-dft"]], "SAPT(HF)": [[1230, "sapt-hf"]], "SAPT0": [[1837, "sapt0"]], "SAPT0-D": [[1837, "sapt0-d"]], "SAPT0_E10": [[1230, "sapt0-e10"], [1464, null]], "SAPT0_E20DISP": [[1230, "sapt0-e20disp"], [1465, null]], "SAPT0_E20IND": [[1230, "sapt0-e20ind"], [1466, null]], "SAPT: Symmetry-Adapted Perturbation Theory": [[1837, null]], "SAPT_DFT_DO_DHF": [[1230, "sapt-dft-do-dhf"], [1467, null], [1837, "sapt-dft-do-dhf"]], "SAPT_DFT_DO_HYBRID": [[1230, "sapt-dft-do-hybrid"], [1468, null], [1837, "sapt-dft-do-hybrid"]], "SAPT_DFT_EXCH_DISP_FIXED_SCALE": [[1230, "sapt-dft-exch-disp-fixed-scale"], [1469, null], [1837, "sapt-dft-exch-disp-fixed-scale"]], "SAPT_DFT_EXCH_DISP_SCALE_SCHEME": [[1230, "sapt-dft-exch-disp-scale-scheme"], [1470, null], [1837, "sapt-dft-exch-disp-scale-scheme"]], "SAPT_DFT_FUNCTIONAL": [[1230, "sapt-dft-functional"], [1471, null], [1837, "sapt-dft-functional"]], "SAPT_DFT_GRAC_DETERMINATION": [[1230, "sapt-dft-grac-determination"], [1472, null]], "SAPT_DFT_GRAC_SHIFT_A": [[1230, "sapt-dft-grac-shift-a"], [1473, null], [1837, "sapt-dft-grac-shift-a"]], "SAPT_DFT_GRAC_SHIFT_B": [[1230, "sapt-dft-grac-shift-b"], [1474, null], [1837, "sapt-dft-grac-shift-b"]], "SAPT_DFT_MP2_DISP_ALG": [[1230, "sapt-dft-mp2-disp-alg"], [1475, null], [1837, "sapt-dft-mp2-disp-alg"]], "SAPT_FDDS_DISP_LEG_LAMBDA": [[1230, "sapt-fdds-disp-leg-lambda"], [1476, null]], "SAPT_FDDS_DISP_NUM_POINTS": [[1230, "sapt-fdds-disp-num-points"], [1477, null]], "SAPT_FDDS_V2_RHO_CUTOFF": [[1230, "sapt-fdds-v2-rho-cutoff"], [1478, null]], "SAPT_LEVEL": [[1230, "sapt-level"], [1479, null], [1837, "sapt-level"]], "SAPT_MEM_CHECK": [[1230, "sapt-mem-check"], [1480, null], [1837, "sapt-mem-check"]], "SAPT_MEM_FACTOR": [[1230, "sapt-mem-factor"], [1481, null]], "SAPT_MEM_SAFETY": [[1230, "sapt-mem-safety"], [1482, null], [1837, "sapt-mem-safety"]], "SAPT_QUIET": [[1230, "sapt-quiet"], [1483, null], [1837, "sapt-quiet"]], "SAVE_JK": [[1231, "save-jk"], [1613, null]], "SAVE_OPTIMIZATION": [[1226, "save-optimization"], [1367, null]], "SAVE_UHF_NOS": [[1231, "save-uhf-nos"], [1614, null]], "SCF": [[1231, null], [1690, null]], "SCF algorithm and convergence criteria defaults by calculation type 1": [[1838, "id42"]], "SCFConvergenceError": [[276, null]], "SCF_INITIAL_ACCELERATOR": [[1231, "scf-initial-accelerator"], [1615, null]], "SCF_INITIAL_FINISH_DIIS_TRANSITION": [[1231, "scf-initial-finish-diis-transition"], [1616, null]], "SCF_INITIAL_START_DIIS_TRANSITION": [[1231, "scf-initial-start-diis-transition"], [1617, null]], "SCF_MEM_SAFETY_FACTOR": [[1231, "scf-mem-safety-factor"], [1618, null]], "SCF_PROPERTIES": [[1231, "scf-properties"], [1619, null]], "SCF_SUBTYPE": [[1231, "scf-subtype"], [1620, null]], "SCF_TYPE": [[721, null], [1166, null], [1207, "scf-type"], [1221, "scf-type"]], "SCHMIDT_ADD_RESIDUAL_TOLERANCE": [[496, null], [1200, "schmidt-add-residual-tolerance"], [1742, "schmidt-add-residual-tolerance"]], "SCREENING": [[1167, null], [1221, "screening"]], "SCS Double-Hybrid": [[1758, "scs-double-hybrid"]], "SCSN_MP2": [[460, null], [1199, "scsn-mp2"]], "SCS_CCSD": [[458, null], [1092, null], [1199, "scs-ccsd"], [1219, "scs-ccsd"], [1771, "scs-ccsd"]], "SCS_CEPA": [[1093, null], [1219, "scs-cepa"]], "SCS_MP2": [[459, null], [1094, null], [1199, "scs-mp2"], [1219, "scs-mp2"], [1771, "scs-mp2"]], "SCS_TYPE": [[959, null], [1213, "scs-type"], [1225, "scs-type"], [1291, null]], "SEKINO": [[532, null], [555, null], [1202, "sekino"], [1203, "sekino"]], "SEMICANONICAL": [[461, null], [497, null], [562, null], [566, null], [1199, "semicanonical"], [1200, "semicanonical"], [1204, "semicanonical"], [1205, "semicanonical"]], "SF_RESTRICT": [[885, null], [1210, "sf-restrict"]], "SIGMA_OVERLAP": [[886, null], [1210, "sigma-overlap"]], "SIMINT": [[1727, null]], "SINGLES_PRINT": [[498, null], [1200, "singles-print"], [1742, "singles-print"]], "SMALL_CUTOFF": [[1229, "small-cutoff"], [1425, null]], "SNLINK_BASIS_TOLERANCE": [[1231, "snlink-basis-tolerance"], [1621, null]], "SNLINK_DENSITY_TOLERANCE": [[1231, "snlink-density-tolerance"], [1622, null]], "SNLINK_FORCE_CARTESIAN": [[1231, "snlink-force-cartesian"], [1623, null]], "SNLINK_GPU_MEM": [[1231, "snlink-gpu-mem"], [1624, null]], "SNLINK_GRID_BATCH_SIZE": [[1231, "snlink-grid-batch-size"], [1625, null]], "SNLINK_INTEGRATOR_KERNEL": [[1231, "snlink-integrator-kernel"], [1626, null]], "SNLINK_INTS_TOLERANCE": [[1231, "snlink-ints-tolerance"], [1627, null]], "SNLINK_LOAD_BALANCER_KERNEL": [[1231, "snlink-load-balancer-kernel"], [1628, null]], "SNLINK_LWD_KERNEL": [[1231, "snlink-lwd-kernel"], [1629, null]], "SNLINK_MOL_WEIGHTS_KERNEL": [[1231, "snlink-mol-weights-kernel"], [1630, null]], "SNLINK_PRUNING_SCHEME": [[1231, "snlink-pruning-scheme"], [1631, null]], "SNLINK_RADIAL_POINTS": [[1231, "snlink-radial-points"], [1632, null]], "SNLINK_RADIAL_SCHEME": [[1231, "snlink-radial-scheme"], [1633, null]], "SNLINK_REDUCTION_KERNEL": [[1231, "snlink-reduction-kernel"], [1634, null]], "SNLINK_SPHERICAL_POINTS": [[1231, "snlink-spherical-points"], [1635, null]], "SNLINK_USE_DEBUG_GRID": [[1231, "snlink-use-debug-grid"], [1636, null]], "SNLINK_USE_GPU": [[1231, "snlink-use-gpu"], [1637, null]], "SNSMP2": [[1728, null]], "SOBasisSet": [[132, null]], "SOCC": [[1168, null], [1192, null], [1221, "socc"], [1222, "socc"]], "SOLVER_CONVERGENCE": [[722, null], [1207, "solver-convergence"], [1231, "solver-convergence"], [1638, null]], "SOLVER_MAXITER": [[723, null], [1207, "solver-maxiter"], [1231, "solver-maxiter"], [1639, null]], "SOLVER_N_GUESS": [[724, null], [1207, "solver-n-guess"], [1231, "solver-n-guess"], [1640, null]], "SOLVER_N_ROOT": [[1231, "solver-n-root"], [1641, null]], "SOLVER_PRECONDITION": [[725, null], [1207, "solver-precondition"]], "SOLVER_ROOTS_PER_IRREP": [[1231, "solver-roots-per-irrep"], [1642, null]], "SOMCSCF": [[133, null]], "SOSCF": [[1231, "soscf"], [1643, null]], "SOSCF_CONV": [[1231, "soscf-conv"], [1644, null]], "SOSCF_MAX_ITER": [[1231, "soscf-max-iter"], [1645, null]], "SOSCF_MIN_ITER": [[1231, "soscf-min-iter"], [1646, null]], "SOSCF_PRINT": [[1231, "soscf-print"], [1647, null]], "SOSCF_START_CONVERGENCE": [[1231, "soscf-start-convergence"], [1648, null]], "SOS_TYPE": [[960, null], [1213, "sos-type"], [1225, "sos-type"], [1292, null]], "SPIN_SCALE_TYPE": [[1225, "spin-scale-type"], [1293, null]], "SSAPT0_SCALE": [[1064, null], [1218, "ssapt0-scale"]], "SSI": [[1692, "ssi"], [1752, "ssi"]], "SS_E_CONVERGENCE": [[499, null], [1200, "ss-e-convergence"]], "SS_R_CONVERGENCE": [[500, null], [1200, "ss-r-convergence"]], "SS_SCALE": [[1225, "ss-scale"], [1294, null]], "SS_SKIP_DIAG": [[501, null], [1200, "ss-skip-diag"]], "SS_VECS_PER_ROOT": [[502, null], [1200, "ss-vecs-per-root"]], "STABILITY_ADD_VECTORS": [[751, null], [1208, "stability-add-vectors"]], "STABILITY_ANALYSIS": [[1231, "stability-analysis"], [1649, null]], "STABILITY_AUGMENT_SPACE_TOL": [[752, null], [1208, "stability-augment-space-tol"]], "STABILITY_CHECK": [[753, null], [1208, "stability-check"]], "STABILITY_CONVERGENCE": [[754, null], [1208, "stability-convergence"]], "STABILITY_MAX_SPACE_SIZE": [[755, null], [1208, "stability-max-space-size"]], "STABILITY_N_EIGENVALUES": [[756, null], [1208, "stability-n-eigenvalues"]], "STABILITY_N_GUESS_VECTORS": [[757, null], [1208, "stability-n-guess-vectors"]], "STEP_TYPE": [[1226, "step-type"], [1368, null], [1802, "step-type"]], "SUMMATION_FIELDS": [[1228, "summation-fields"], [1394, null]], "SYMMETRIZE": [[1225, "symmetrize"], [1295, null]], "S^inf Keywords": [[1837, "s-inf-keywords"]], "S_CHOLESKY_TOLERANCE": [[1231, "s-cholesky-tolerance"], [1600, null]], "S_CUT": [[977, null], [1214, "s-cut"]], "S_ORTHOGONALIZATION": [[1231, "s-orthogonalization"], [1601, null]], "S_TOLERANCE": [[1231, "s-tolerance"], [1602, null]], "SalcComponent": [[134, null]], "Sample Input": [[1805, "sample-input"], [1806, "sample-input"]], "Sample Input Files": [[1844, "sample-input-files"]], "SaveType": [[135, null]], "Saving the Wavefunction": [[1767, "saving-the-wavefunction"]], "Scalar Relativistic Corrections": [[1781, "scalar-relativistic-corrections"]], "Scalar relativistic Hamiltonians": [[1836, null]], "Scratch Files": [[1767, "scratch-files"]], "Script Options": [[1750, "script-options"]], "Script Prerequisites": [[1750, "script-prerequisites"]], "Second-order Convergence": [[1838, "second-order-convergence"]], "Seminumerical Linear Exchange": [[1838, "seminumerical-linear-exchange"]], "Setting Up Your Development Environment": [[1820, null]], "Shell Pairs": [[1817, "shell-pairs"]], "Shell blocking": [[1817, "shell-blocking"]], "ShellInfo": [[136, null]], "Sieving": [[1817, "sieving"]], "Single-Point Energy \u2014 energy()": [[1766, null]], "Slack": [[1816, "slack"]], "Slice": [[137, null]], "Solvent model and solvent cavity definition": [[1754, "solvent-model-and-solvent-cavity-definition"]], "SolverEngine": [[329, null]], "Specific open-shell SAPT0 keywords": [[1837, "specific-open-shell-sapt0-keywords"]], "Specification Details": [[1743, "specification-details"]], "Spectroscopic Constants for Diatomics": [[1761, null]], "Spin Multiplicities of Higher Roots": [[1755, "spin-multiplicities-of-higher-roots"]], "Spin-Component-Scaled Orbital-Optimized MP capabilities of OCC/DFOCC modules": [[1798, "id71"]], "Spin-Flip SAPT": [[1837, "spin-flip-sapt"]], "Spin-Network-Scaled MP2 (SNS-MP2) by D. E. Shaw": [[1806, null]], "Spin/Symmetry Treatment": [[1757, "spin-symmetry-treatment"], [1838, "spin-symmetry-treatment"]], "Stability Analysis": [[1838, "stability-analysis"]], "Stability analysis methods available in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1838, "id41"]], "Summary capabilities of <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>. \u201c\u2713\u201d runs analytically. \u201c\u2237\u201d runs derivative with internal finite difference. Double underline \u201c\u2713\u0333\u201d or \u201c\u2237\u0333\u201d is default algorithm type when type selector (e.g., CC_TYPE) unspecified.": [[1781, "id59"]], "Summary of Dunning Douglas-Kroll orbital basis sets available in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1733, "id18"]], "Summary of Dunning F12 orbital basis sets available in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1733, "id19"]], "Summary of Dunning JK-fitting basis sets available in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1733, "id20"]], "Summary of Dunning MP2-fitting basis sets available in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1733, "id21"]], "Summary of Dunning dual-basis helper basis sets available in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1733, "id22"]], "Summary of Dunning orbital basis sets available in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1733, "id17"]], "Summary of Jensen orbital basis sets available in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1733, "id24"]], "Summary of Karlsruhe orbital basis sets available in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1733, "id23"]], "Summary of Petersson orbital basis sets available in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1733, "id25"]], "Summary of Pople-style orbital basis sets available in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span> 1": [[1733, "id15"]], "Summary of other orbital basis sets available in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1733, "id26"]], "Summary of sets of geometry optimization criteria available in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1802, "id26"]], "Summary of theoretical methods available in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1781, "id58"]], "SuperFunctional": [[138, null]], "Supported Systems": [[1781, "supported-systems"]], "Supported methods": [[1771, "supported-methods"]], "Symmetry": [[1833, "symmetry"]], "Symmetry-Adapted Perturbation Theory (SAPT)": [[1781, "symmetry-adapted-perturbation-theory-sapt"]], "SymmetryOperation": [[139, null]], "T": [[1232, "t"], [1667, null], [1843, "t"]], "T2_COUPLED": [[462, null], [1199, "t2-coupled"]], "T3_WS_INCORE": [[463, null], [503, null], [1199, "t3-ws-incore"], [1200, "t3-ws-incore"]], "TDM": [[887, null], [1210, "tdm"], [1755, "tdm"]], "TDSCF": [[1231, "tdscf"]], "TDSCF: Time-dependent Hartree\u2013Fock and density-functional theory": [[1841, null]], "TDSCFConvergenceError": [[277, null]], "TDSCF_COEFF_CUTOFF": [[1231, "tdscf-coeff-cutoff"], [1650, null], [1841, "tdscf-coeff-cutoff"]], "TDSCF_GUESS": [[1231, "tdscf-guess"], [1651, null], [1841, "tdscf-guess"]], "TDSCF_MAXITER": [[1231, "tdscf-maxiter"], [1652, null], [1841, "tdscf-maxiter"]], "TDSCF_PRINT": [[1231, "tdscf-print"], [1653, null], [1841, "tdscf-print"]], "TDSCF_R_CONVERGENCE": [[1231, "tdscf-r-convergence"], [1654, null], [1841, "tdscf-r-convergence"]], "TDSCF_STATES": [[1231, "tdscf-states"], [1655, null], [1841, "tdscf-states"]], "TDSCF_TDA": [[1231, "tdscf-tda"], [1656, null], [1841, "tdscf-tda"]], "TDSCF_TDM_PRINT": [[1231, "tdscf-tdm-print"], [1657, null], [1841, "tdscf-tdm-print"]], "TDSCF_TRIPLETS": [[1231, "tdscf-triplets"], [1658, null], [1841, "tdscf-triplets"]], "TEST_B": [[1226, "test-b"], [1369, null]], "TEST_DERIVATIVE_B": [[1226, "test-derivative-b"], [1370, null]], "THERMO": [[1232, null], [1691, null]], "THETA_POINTS": [[1231, "theta-points"], [1659, null]], "THICKNESS": [[1231, "thickness"], [1660, null]], "THREE_PARTICLE": [[758, null], [1208, "three-particle"]], "TIKHONOW_MAX": [[1229, "tikhonow-max"], [1426, null]], "TIKHONOW_OMEGA": [[759, null], [1208, "tikhonow-omega"], [1229, "tikhonow-omega"], [1427, null]], "TIKHONOW_TRIPLES": [[1229, "tikhonow-triples"], [1428, null]], "TILE_SZ": [[1231, "tile-sz"], [1661, null]], "TLaplaceDenominator": [[140, null]], "TPDM": [[888, null], [1210, "tpdm"]], "TPDM_ABCD_TYPE": [[1225, "tpdm-abcd-type"], [1296, null], [1798, "tpdm-abcd-type"]], "TRANSLATE_PSI4": [[713, null], [1206, "translate-psi4"]], "TREE_EXPANSION_ORDER": [[1228, "tree-expansion-order"], [1395, null]], "TREE_THETA": [[1228, "tree-theta"], [1396, null]], "TRIPLES_ALGORITHM": [[1229, "triples-algorithm"], [1429, null]], "TRIPLES_DIIS": [[1229, "triples-diis"], [1430, null]], "TRIPLES_IABC_TYPE": [[961, null], [1213, "triples-iabc-type"]], "TRIPLES_LOW_MEMORY": [[1095, null], [1219, "triples-low-memory"], [1771, "triples-low-memory"]], "TURN_ON_ACTV": [[1193, null], [1222, "turn-on-actv"]], "T_AMPS": [[509, null], [1201, "t-amps"]], "T_CUT_CLMO": [[978, null], [1214, "t-cut-clmo"]], "T_CUT_CPAO": [[979, null], [1214, "t-cut-cpao"]], "T_CUT_DO": [[980, null], [1214, "t-cut-do"]], "T_CUT_DO_IJ": [[981, null], [1214, "t-cut-do-ij"]], "T_CUT_DO_PRE": [[982, null], [1214, "t-cut-do-pre"]], "T_CUT_MKN": [[983, null], [1214, "t-cut-mkn"]], "T_CUT_PNO": [[984, null], [1214, "t-cut-pno"]], "T_CUT_PRE": [[985, null], [1214, "t-cut-pre"]], "Tables of Results": [[1832, "tables-of-results"]], "Tag (pre)release": [[1788, "tag-pre-release"]], "Tag postrelease": [[1788, "tag-postrelease"]], "Tarball from GitHub Repository": [[1737, "tarball-from-github-repository"]], "Technical Support": [[1781, "technical-support"]], "Test Contents": [[2, "test-contents"]], "Test Suite": [[2, null]], "Test Suite and Sample Inputs": [[1842, null]], "TestComparisonError": [[278, null]], "Testing": [[1736, "testing"]], "The <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span> community": [[1825, "the-psifour-community"]], "The Map of the Sphinx": [[1764, "the-map-of-the-sphinx"]], "The S2 approximation and scaling": [[1837, "the-s2-approximation-and-scaling"]], "The new syntax": [[1817, "the-new-syntax"]], "The older style": [[1817, "the-older-style"]], "Theoretical Methods: SCF to FCI": [[1790, null]], "Theoretical methods accessible through FNOCC": [[1771, "id12"]], "Theory": [[1753, "theory"], [1756, "theory"], [1757, "theory"], [1759, "theory"], [1763, "theory"], [1798, "theory"], [1836, "theory"], [1838, "theory"], [1841, "theory"]], "Threading": [[1767, "threading"]], "Three-Body Dispersion Corrections": [[1759, "three-body-dispersion-corrections"]], "ThreeCenterOverlapInt": [[141, null]], "TracelessQuadrupoleInt": [[142, null]], "Transition States and Reaction Paths": [[1802, "transition-states-and-reaction-paths"]], "Tweak Conda for postrelease": [[1788, "tweak-conda-for-postrelease"]], "TwoBodyAOInt": [[143, null]], "TwoElectronInt": [[144, null]], "UHF": [[145, null]], "UHF_NOONS": [[1231, "uhf-noons"], [1662, null]], "UKSFunctions": [[146, null]], "UNFREEZE_DIHEDRALS": [[1226, "unfreeze-dihedrals"], [1371, null]], "UPDATE": [[889, null], [1210, "update"]], "USE_DF_INTS": [[1096, null], [1219, "use-df-ints"]], "USE_SPIN_SYM": [[1229, "use-spin-sym"], [1431, null]], "USE_SPIN_SYMMETRY": [[1229, "use-spin-symmetry"], [1432, null]], "Update copyright year": [[1788, "update-copyright-year"]], "Update counter scripts": [[1788, "update-counter-scripts"]], "Update samples": [[1788, "update-samples"]], "Updating the <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span> Users\u2019 and Programmers\u2019 Manual": [[1764, null]], "UpgradeHelper": [[279, null]], "Useful Commands": [[1748, "useful-commands"]], "User-Defined Basis Sets": [[1730, "user-defined-basis-sets"]], "Using <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1816, "using-psifour"]], "Using BrianQC from <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1735, "using-brianqc-from-psifour"]], "Using bra-ket symmetry": [[1817, "using-bra-ket-symmetry"]], "Using dd-based continum solvation models": [[1754, "using-dd-based-continum-solvation-models"]], "Using the polarizable continuum model": [[1803, "using-the-polarizable-continuum-model"]], "Using the polarizable embedding model": [[1749, "using-the-polarizable-embedding-model"]], "V. Potential Surface Scans and Counterpoise Correction Made Easy": [[1828, "V.-Potential-Surface-Scans-and-Counterpoise-Correction-Made-Easy"]], "V2RDM_CASSCF": [[1729, null]], "VAL_EX_LEVEL": [[890, null], [1210, "val-ex-level"]], "VBase": [[147, null]], "VECS_CC3": [[504, null], [1200, "vecs-cc3"]], "VECS_PER_ROOT": [[505, null], [1200, "vecs-per-root"]], "ValidationError": [[280, null]], "Variants of dispersion corrections": [[1759, "id36"]], "Vector": [[148, null]], "Vector3": [[149, null]], "Versioning <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1814, "versioning-psifour"]], "Vibrational and Thermochemical Analysis": [[1843, null]], "Visualization of Normal Modes": [[1772, "visualization-of-normal-modes"]], "WABEI_LOWDISK": [[510, null], [1201, "wabei-lowdisk"]], "WCOMBINE": [[1231, "wcombine"], [1663, null]], "WFN": [[423, null], [464, null], [506, null], [511, null], [533, null], [556, null], [563, null], [567, null], [891, null], [1169, null], [1198, "wfn"], [1199, "wfn"], [1200, "wfn"], [1201, "wfn"], [1202, "wfn"], [1203, "wfn"], [1204, "wfn"], [1205, "wfn"], [1210, "wfn"], [1221, "wfn"], [1231, "wfn"], [1664, null]], "WFN_SYM": [[1194, null], [1222, "wfn-sym"], [1229, "wfn-sym"], [1433, null]], "WFN_TYPE": [[962, null], [1213, "wfn-type"], [1225, "wfn-type"], [1297, null], [1798, "wfn-type"]], "WRITER_FILE_LABEL": [[1170, null], [1221, "writer-file-label"], [1772, "writer-file-label"], [1791, "writer-file-label"]], "WRITE_NOS": [[424, null], [1198, "write-nos"]], "WRITE_OPT_HISTORY": [[1226, "write-opt-history"], [1372, null]], "WRITE_OPT_RESULT": [[1226, "write-opt-result"], [1373, null]], "WRITE_TRAJECTORY": [[1226, "write-trajectory"], [1374, null]], "Wavefunction": [[150, null]], "Ways to Add Code: Psi4NumPy, Plugins, Full Integration": [[1824, null]], "Welcome to New Programmers": [[1825, null]], "What C and C++ compilers and versions are approved": [[1738, "what-c-and-c-compilers-and-versions-are-approved"]], "What Fortran compilers are approved": [[1738, "what-fortran-compilers-are-approved"]], "What Psi4 version is running": [[1786, "what-psi4-version-is-running"]], "What Python is Psi4 running": [[1738, "what-python-is-psi4-running"]], "What are the add-on capabilities for Psi4 and what are their dependencies": [[1738, "what-are-the-add-on-capabilities-for-psi4-and-what-are-their-dependencies"]], "What are the tools and dependencies strictly required for building Psi4": [[1738, "what-are-the-tools-and-dependencies-strictly-required-for-building-psi4"]], "What do the conda packages psi4 & psi4-dev and the installer psi4conda contain": [[1748, "what-do-the-conda-packages-psi4-psi4-dev-and-the-installer-psi4conda-contain"]], "What is has_changed ?": [[1801, "what-is-has-changed"]], "What is the directory layout of the installed or staged Psi4": [[1738, "what-is-the-directory-layout-of-the-installed-or-staged-psi4"]], "What is the suggested GitHub workflow": [[1737, "what-is-the-suggested-github-workflow"]], "When to enable BrianQC": [[1735, "when-to-enable-brianqc"]], "Where to Get Help": [[1816, null]], "Why not to set PSIDATADIR": [[1738, "why-not-to-set-psidatadir"]], "Workflow": [[1814, "workflow"]], "XI": [[425, null], [1198, "xi"]], "XI_CONNECT": [[426, null], [1198, "xi-connect"]], "ZERO_INTERNAL_AMPS": [[1229, "zero-internal-amps"], [1434, null]], "ZETA": [[427, null], [534, null], [1198, "zeta"], [1202, "zeta"]], "activate": [[281, null]], "all_casings": [[330, null]], "array_to_matrix": [[331, null]], "array_variable": [[151, null]], "array_variables": [[152, null]], "banner": [[282, null], [332, null]], "basis_helper": [[283, null], [333, null]], "be_quiet": [[153, null]], "benchmark_blas1": [[154, null]], "benchmark_blas2": [[155, null]], "benchmark_blas3": [[156, null]], "benchmark_disk": [[157, null]], "benchmark_integrals": [[158, null]], "benchmark_math": [[159, null]], "block_diagonal_array": [[334, null]], "cbs": [[284, null]], "ccdensity": [[160, null]], "ccenergy": [[161, null]], "cceom": [[162, null]], "cchbar": [[163, null]], "cclambda": [[164, null]], "ccresponse": [[165, null]], "cctransort": [[166, null]], "cctriples": [[167, null]], "cg_solver": [[335, null]], "clean": [[168, null]], "clean_options": [[169, null]], "clean_timers": [[170, null]], "clean_variables": [[171, null]], "close_outfile": [[172, null]], "compare_fchkfiles": [[285, null], [336, null]], "compare_fcidumps": [[286, null], [337, null]], "compare_moldenfiles": [[287, null], [338, null]], "compare_vibinfos": [[383, null]], "copy_file_from_scratch": [[288, null], [339, null]], "copy_file_to_scratch": [[289, null], [340, null]], "create_plugin": [[290, null]], "cubeprop": [[291, null], [341, null]], "davidson_solver": [[342, null]], "dct": [[173, null]], "del_array_variable": [[174, null]], "del_scalar_variable": [[175, null]], "del_variable": [[176, null]], "detci": [[177, null]], "dfmp2": [[178, null]], "dfocc": [[179, null]], "dlpno": [[180, null]], "dmrg": [[181, null]], "docs_table_link": [[292, null], [343, null]], "doublet": [[182, null]], "dpdbuf4": [[183, null]], "dpdfile2": [[184, null]], "drop_duplicates": [[344, null]], "dummy_einsums": [[185, null]], "dummy_integratorxx": [[186, null]], "dynamic_variable_bind": [[293, null]], "else": [[1785, "else"]], "energies_from_fcidump": [[294, null], [345, null]], "energy": [[295, null]], "expand_psivars": [[346, null]], "fchk": [[296, null]], "fcidump": [[297, null], [347, null]], "fcidump_from_file": [[298, null], [348, null]], "fcidump_tei_helper": [[187, null]], "filter_nonvib": [[384, null]], "filter_omega_to_real": [[385, null]], "finalize": [[188, null]], "find_approximate_string_matches": [[299, null], [349, null]], "flush_outfile": [[189, null]], "fnocc": [[190, null]], "format_molecule_for_input": [[350, null]], "format_options_for_input": [[351, null]], "free_atom_volumes": [[352, null]], "freq": [[300, null]], "frequencies": [[301, null]], "frequency": [[302, null]], "gdma": [[303, null]], "geometry": [[304, null]], "get_active_molecule": [[191, null]], "get_array_variable": [[192, null]], "get_array_variables": [[193, null]], "get_datadir": [[194, null]], "get_global_option": [[195, null]], "get_global_option_list": [[196, null]], "get_local_option": [[197, null]], "get_memory": [[198, null], [305, null], [353, null]], "get_num_threads": [[199, null]], "get_option": [[200, null]], "get_options": [[201, null]], "get_output_file": [[202, null]], "get_psifile": [[354, null]], "get_variable": [[203, null]], "get_variables": [[204, null]], "get_writer_file_prefix": [[205, null]], "getattr_ignorecase": [[355, null]], "git_version": [[206, null]], "gradient": [[306, null]], "hamiltonian_solver": [[356, null]], "harmonic_analysis": [[386, null]], "has_array_variable": [[207, null]], "has_global_option_changed": [[208, null]], "has_local_option_changed": [[209, null]], "has_option_changed": [[210, null]], "has_scalar_variable": [[211, null]], "has_variable": [[212, null]], "hessian": [[307, null]], "hessian_symmetrize": [[387, null]], "hold_options_state": [[357, null]], "import_ignorecase": [[358, null]], "initialize": [[213, null]], "input.dat": [[2, "input-dat"]], "ipi_broker": [[308, null]], "kwargs_lower": [[359, null]], "levenshtein": [[309, null], [360, null]], "libint2_configuration": [[310, null], [361, null]], "libint2_print_out": [[311, null], [362, null]], "libint2_solid_harmonics_ordering": [[214, null]], "mat2arr": [[363, null]], "mcscf": [[215, null]], "mdi_run": [[312, null]], "message_box": [[313, null], [364, null]], "molden": [[314, null]], "molecule_get_attr": [[315, null]], "molecule_set_attr": [[316, null]], "mrcc_generate_input": [[216, null]], "mrcc_load_densities": [[217, null]], "occ": [[218, null]], "oeprop": [[317, null], [365, null]], "opt": [[318, null]], "optimize": [[319, null]], "optimize_geometric": [[320, null]], "option_exists_in_module": [[219, null]], "options_to_python": [[220, null]], "outfile_name": [[221, null]], "output.ref": [[2, "output-ref"]], "pcm_helper": [[366, null], [379, null]], "plugin": [[222, null]], "plugin_close": [[223, null]], "plugin_close_all": [[224, null]], "plugin_load": [[225, null]], "plump_qcvar": [[367, null]], "post-SCF time savings": [[1760, "post-scf-time-savings"]], "prefactor_ecd": [[368, null]], "prefactor_opa": [[369, null]], "prepare_options_for_module": [[226, null]], "prepare_options_for_modules": [[370, null]], "prepare_options_for_set_options": [[371, null]], "print_global_options": [[227, null]], "print_molden_vibs": [[388, null]], "print_options": [[228, null]], "print_out": [[229, null]], "print_variables": [[230, null]], "print_vibs": [[389, null]], "proc.py": [[1809, "proc-py"]], "process_input": [[380, null]], "prop": [[381, null]], "properties": [[382, null]], "provenance_stamp": [[372, null]], "psi4.core Module": [[1827, "module-psi4.core"]], "psi4.driver Package": [[1827, "module-psi4.driver"]], "psi4.driver.p4util Package": [[1827, "module-psi4.driver.p4util"]], "psi4.driver.qcdb.vib Module": [[1772, "module-psi4.driver.qcdb.vib"]], "psi_top_srcdir": [[231, null]], "psimrcc": [[232, null]], "psio_entry": [[233, null]], "reStructuredText": [[1764, "restructuredtext"]], "reopen_outfile": [[234, null]], "revoke_global_option_changed": [[235, null]], "revoke_local_option_changed": [[236, null]], "sanitize_method": [[373, null], [391, null]], "sanitize_name": [[392, null]], "sapt": [[237, null]], "scalar_variable": [[238, null]], "scalar_variables": [[239, null]], "scatter": [[240, null]], "scf_helper": [[393, null]], "scf_wavefunction_factory": [[394, null]], "scfgrad": [[241, null]], "scfhess": [[242, null]], "set_active_molecule": [[243, null]], "set_array_variable": [[244, null]], "set_datadir": [[245, null]], "set_global_option": [[246, null]], "set_global_option_python": [[247, null]], "set_local_option": [[248, null]], "set_local_option_python": [[249, null]], "set_memory": [[374, null], [395, null]], "set_memory_bytes": [[250, null]], "set_module_options": [[375, null], [396, null]], "set_num_threads": [[251, null]], "set_options": [[376, null], [397, null]], "set_output_file": [[252, null]], "set_psi_file_prefix": [[253, null]], "set_scalar_variable": [[254, null]], "set_variable": [[255, null]], "snLinK Algorithm": [[1231, "snlink-algorithm"]], "spectrum": [[377, null]], "state_to_atomicinput": [[378, null]], "tdscf": [[398, null]], "test_input.py": [[2, "test-input-py"]], "test_matrix_dpd_interface": [[256, null]], "thermo": [[390, null]], "timer_off": [[257, null]], "timer_on": [[258, null]], "triplet": [[259, null]], "tstart": [[260, null]], "tstop": [[261, null]], "variable": [[262, null]], "variables": [[263, null]], "version": [[264, null]], "vibanal_wfn": [[399, null]], "~/.psi4rc File": [[1767, "psirc-file"]]}, "docnames": ["adc", "adcc", "add_tests", "api/psi4.core.AOShellCombinationsIterator", "api/psi4.core.AngularMomentumInt", "api/psi4.core.BSVec", "api/psi4.core.BasisExtents", "api/psi4.core.BasisFunctions", "api/psi4.core.BasisSet", "api/psi4.core.BlockOPoints", "api/psi4.core.BoysLocalizer", "api/psi4.core.CCWavefunction", "api/psi4.core.CIVector", "api/psi4.core.CIWavefunction", "api/psi4.core.CUHF", "api/psi4.core.CdSalc", "api/psi4.core.CdSalcList", "api/psi4.core.CharacterTable", "api/psi4.core.CompositeJK", "api/psi4.core.CorrelationFactor", "api/psi4.core.CorrelationTable", "api/psi4.core.CubeProperties", "api/psi4.core.DASUM", "api/psi4.core.DAXPY", "api/psi4.core.DCOPY", "api/psi4.core.DDOT", "api/psi4.core.DFEP2Wavefunction", "api/psi4.core.DFHelper", "api/psi4.core.DFSOMCSCF", "api/psi4.core.DFTGrid", "api/psi4.core.DFTensor", "api/psi4.core.DGBMV", "api/psi4.core.DGEEV", "api/psi4.core.DGEMM", "api/psi4.core.DGEMV", "api/psi4.core.DGER", "api/psi4.core.DGETRF", "api/psi4.core.DGETRI", "api/psi4.core.DGETRS", "api/psi4.core.DNRM2", "api/psi4.core.DPOTRF", "api/psi4.core.DPOTRI", "api/psi4.core.DPOTRS", "api/psi4.core.DROT", "api/psi4.core.DSBMV", "api/psi4.core.DSCAL", "api/psi4.core.DSWAP", "api/psi4.core.DSYEV", "api/psi4.core.DSYMM", "api/psi4.core.DSYMV", "api/psi4.core.DSYR", "api/psi4.core.DSYR2", "api/psi4.core.DSYR2K", "api/psi4.core.DSYRK", "api/psi4.core.DSYSV", "api/psi4.core.DTBMV", "api/psi4.core.DTBSV", "api/psi4.core.DTRMM", "api/psi4.core.DTRMV", "api/psi4.core.DTRSM", "api/psi4.core.DTRSV", "api/psi4.core.Deriv", "api/psi4.core.DerivCalcType", "api/psi4.core.DiagonalizeOrder", "api/psi4.core.Dimension", "api/psi4.core.DipoleInt", "api/psi4.core.DirectJK", "api/psi4.core.DiskSOMCSCF", "api/psi4.core.Dispersion", "api/psi4.core.ERI", "api/psi4.core.ESPPropCalc", "api/psi4.core.ElectricFieldInt", "api/psi4.core.ElectrostaticInt", "api/psi4.core.ExternalPotential", "api/psi4.core.FCHKWriter", "api/psi4.core.FDDS_Dispersion", "api/psi4.core.FISAPT", "api/psi4.core.FittedSlaterCorrelationFactor", "api/psi4.core.FittingMetric", "api/psi4.core.FragmentType", "api/psi4.core.Functional", "api/psi4.core.GaussianShell", "api/psi4.core.GaussianType", "api/psi4.core.GeometryUnits", "api/psi4.core.HF", "api/psi4.core.IDAMAX", "api/psi4.core.IO", "api/psi4.core.IOManager", "api/psi4.core.IntVector", "api/psi4.core.IntegralFactory", "api/psi4.core.IntegralTransform", "api/psi4.core.IrreducibleRepresentation", "api/psi4.core.JK", "api/psi4.core.KineticInt", "api/psi4.core.LS_THC_Computer", "api/psi4.core.LaplaceDenominator", "api/psi4.core.LibXCFunctional", "api/psi4.core.Localizer", "api/psi4.core.MOSpace", "api/psi4.core.MOWriter", "api/psi4.core.Matrix", "api/psi4.core.MatrixFactory", "api/psi4.core.MemDFJK", "api/psi4.core.MintsHelper", "api/psi4.core.MoldenWriter", "api/psi4.core.MolecularGrid", "api/psi4.core.Molecule", "api/psi4.core.MultipoleInt", "api/psi4.core.MultipoleSymmetry", "api/psi4.core.NablaInt", "api/psi4.core.NumIntHelper", "api/psi4.core.OEProp", "api/psi4.core.OneBodyAOInt", "api/psi4.core.OneBodySOInt", "api/psi4.core.Options", "api/psi4.core.OrbitalSpace", "api/psi4.core.OverlapInt", "api/psi4.core.PMLocalizer", "api/psi4.core.PetiteList", "api/psi4.core.PointFunctions", "api/psi4.core.PointGroup", "api/psi4.core.PotentialInt", "api/psi4.core.PrimitiveType", "api/psi4.core.Prop", "api/psi4.core.ProtoIntVector", "api/psi4.core.ProtoVector", "api/psi4.core.PsiReturnType", "api/psi4.core.QuadrupoleInt", "api/psi4.core.RHF", "api/psi4.core.RKSFunctions", "api/psi4.core.ROHF", "api/psi4.core.SADGuess", "api/psi4.core.SOBasisSet", "api/psi4.core.SOMCSCF", "api/psi4.core.SalcComponent", "api/psi4.core.SaveType", "api/psi4.core.ShellInfo", "api/psi4.core.Slice", "api/psi4.core.SuperFunctional", "api/psi4.core.SymmetryOperation", "api/psi4.core.TLaplaceDenominator", "api/psi4.core.ThreeCenterOverlapInt", "api/psi4.core.TracelessQuadrupoleInt", "api/psi4.core.TwoBodyAOInt", "api/psi4.core.TwoElectronInt", "api/psi4.core.UHF", "api/psi4.core.UKSFunctions", "api/psi4.core.VBase", "api/psi4.core.Vector", "api/psi4.core.Vector3", "api/psi4.core.Wavefunction", "api/psi4.core.array_variable", "api/psi4.core.array_variables", "api/psi4.core.be_quiet", "api/psi4.core.benchmark_blas1", "api/psi4.core.benchmark_blas2", "api/psi4.core.benchmark_blas3", "api/psi4.core.benchmark_disk", "api/psi4.core.benchmark_integrals", "api/psi4.core.benchmark_math", "api/psi4.core.ccdensity", "api/psi4.core.ccenergy", "api/psi4.core.cceom", "api/psi4.core.cchbar", "api/psi4.core.cclambda", "api/psi4.core.ccresponse", "api/psi4.core.cctransort", "api/psi4.core.cctriples", "api/psi4.core.clean", "api/psi4.core.clean_options", "api/psi4.core.clean_timers", "api/psi4.core.clean_variables", "api/psi4.core.close_outfile", "api/psi4.core.dct", "api/psi4.core.del_array_variable", "api/psi4.core.del_scalar_variable", "api/psi4.core.del_variable", "api/psi4.core.detci", "api/psi4.core.dfmp2", "api/psi4.core.dfocc", "api/psi4.core.dlpno", "api/psi4.core.dmrg", "api/psi4.core.doublet", "api/psi4.core.dpdbuf4", "api/psi4.core.dpdfile2", "api/psi4.core.dummy_einsums", "api/psi4.core.dummy_integratorxx", "api/psi4.core.fcidump_tei_helper", "api/psi4.core.finalize", "api/psi4.core.flush_outfile", "api/psi4.core.fnocc", "api/psi4.core.get_active_molecule", "api/psi4.core.get_array_variable", "api/psi4.core.get_array_variables", "api/psi4.core.get_datadir", "api/psi4.core.get_global_option", "api/psi4.core.get_global_option_list", "api/psi4.core.get_local_option", "api/psi4.core.get_memory", "api/psi4.core.get_num_threads", "api/psi4.core.get_option", "api/psi4.core.get_options", "api/psi4.core.get_output_file", "api/psi4.core.get_variable", "api/psi4.core.get_variables", "api/psi4.core.get_writer_file_prefix", "api/psi4.core.git_version", "api/psi4.core.has_array_variable", "api/psi4.core.has_global_option_changed", "api/psi4.core.has_local_option_changed", "api/psi4.core.has_option_changed", "api/psi4.core.has_scalar_variable", "api/psi4.core.has_variable", "api/psi4.core.initialize", "api/psi4.core.libint2_solid_harmonics_ordering", "api/psi4.core.mcscf", "api/psi4.core.mrcc_generate_input", "api/psi4.core.mrcc_load_densities", "api/psi4.core.occ", "api/psi4.core.option_exists_in_module", "api/psi4.core.options_to_python", "api/psi4.core.outfile_name", "api/psi4.core.plugin", "api/psi4.core.plugin_close", "api/psi4.core.plugin_close_all", "api/psi4.core.plugin_load", "api/psi4.core.prepare_options_for_module", "api/psi4.core.print_global_options", "api/psi4.core.print_options", "api/psi4.core.print_out", "api/psi4.core.print_variables", "api/psi4.core.psi_top_srcdir", "api/psi4.core.psimrcc", "api/psi4.core.psio_entry", "api/psi4.core.reopen_outfile", "api/psi4.core.revoke_global_option_changed", "api/psi4.core.revoke_local_option_changed", "api/psi4.core.sapt", "api/psi4.core.scalar_variable", "api/psi4.core.scalar_variables", "api/psi4.core.scatter", "api/psi4.core.scfgrad", "api/psi4.core.scfhess", "api/psi4.core.set_active_molecule", "api/psi4.core.set_array_variable", "api/psi4.core.set_datadir", "api/psi4.core.set_global_option", "api/psi4.core.set_global_option_python", "api/psi4.core.set_local_option", "api/psi4.core.set_local_option_python", "api/psi4.core.set_memory_bytes", "api/psi4.core.set_num_threads", "api/psi4.core.set_output_file", "api/psi4.core.set_psi_file_prefix", "api/psi4.core.set_scalar_variable", "api/psi4.core.set_variable", "api/psi4.core.test_matrix_dpd_interface", "api/psi4.core.timer_off", "api/psi4.core.timer_on", "api/psi4.core.triplet", "api/psi4.core.tstart", "api/psi4.core.tstop", "api/psi4.core.variable", "api/psi4.core.variables", "api/psi4.core.version", "api/psi4.driver.AtomicComputer", "api/psi4.driver.ConvergenceError", "api/psi4.driver.EmpiricalDispersion", "api/psi4.driver.ManagedMethodError", "api/psi4.driver.MissingMethodError", "api/psi4.driver.OptimizationConvergenceError", "api/psi4.driver.ParsingError", "api/psi4.driver.PastureRequiredError", "api/psi4.driver.PsiException", "api/psi4.driver.QMMM", "api/psi4.driver.QMMMbohr", "api/psi4.driver.SCFConvergenceError", "api/psi4.driver.TDSCFConvergenceError", "api/psi4.driver.TestComparisonError", "api/psi4.driver.UpgradeHelper", "api/psi4.driver.ValidationError", "api/psi4.driver.activate", "api/psi4.driver.banner", "api/psi4.driver.basis_helper", "api/psi4.driver.cbs", "api/psi4.driver.compare_fchkfiles", "api/psi4.driver.compare_fcidumps", "api/psi4.driver.compare_moldenfiles", "api/psi4.driver.copy_file_from_scratch", "api/psi4.driver.copy_file_to_scratch", "api/psi4.driver.create_plugin", "api/psi4.driver.cubeprop", "api/psi4.driver.docs_table_link", "api/psi4.driver.dynamic_variable_bind", "api/psi4.driver.energies_from_fcidump", "api/psi4.driver.energy", "api/psi4.driver.fchk", "api/psi4.driver.fcidump", "api/psi4.driver.fcidump_from_file", "api/psi4.driver.find_approximate_string_matches", "api/psi4.driver.freq", "api/psi4.driver.frequencies", "api/psi4.driver.frequency", "api/psi4.driver.gdma", "api/psi4.driver.geometry", "api/psi4.driver.get_memory", "api/psi4.driver.gradient", "api/psi4.driver.hessian", "api/psi4.driver.ipi_broker", "api/psi4.driver.levenshtein", "api/psi4.driver.libint2_configuration", "api/psi4.driver.libint2_print_out", "api/psi4.driver.mdi_run", "api/psi4.driver.message_box", "api/psi4.driver.molden", "api/psi4.driver.molecule_get_attr", "api/psi4.driver.molecule_set_attr", "api/psi4.driver.oeprop", "api/psi4.driver.opt", "api/psi4.driver.optimize", "api/psi4.driver.optimize_geometric", "api/psi4.driver.p4util.DIIS", "api/psi4.driver.p4util.Gaussian", "api/psi4.driver.p4util.InPsight", "api/psi4.driver.p4util.Lineshape", "api/psi4.driver.p4util.Lorentzian", "api/psi4.driver.p4util.OptionState", "api/psi4.driver.p4util.OptionsState", "api/psi4.driver.p4util.OptionsStateCM", "api/psi4.driver.p4util.SolverEngine", "api/psi4.driver.p4util.all_casings", "api/psi4.driver.p4util.array_to_matrix", "api/psi4.driver.p4util.banner", "api/psi4.driver.p4util.basis_helper", "api/psi4.driver.p4util.block_diagonal_array", "api/psi4.driver.p4util.cg_solver", "api/psi4.driver.p4util.compare_fchkfiles", "api/psi4.driver.p4util.compare_fcidumps", "api/psi4.driver.p4util.compare_moldenfiles", "api/psi4.driver.p4util.copy_file_from_scratch", "api/psi4.driver.p4util.copy_file_to_scratch", "api/psi4.driver.p4util.cubeprop", "api/psi4.driver.p4util.davidson_solver", "api/psi4.driver.p4util.docs_table_link", "api/psi4.driver.p4util.drop_duplicates", "api/psi4.driver.p4util.energies_from_fcidump", "api/psi4.driver.p4util.expand_psivars", "api/psi4.driver.p4util.fcidump", "api/psi4.driver.p4util.fcidump_from_file", "api/psi4.driver.p4util.find_approximate_string_matches", "api/psi4.driver.p4util.format_molecule_for_input", "api/psi4.driver.p4util.format_options_for_input", "api/psi4.driver.p4util.free_atom_volumes", "api/psi4.driver.p4util.get_memory", "api/psi4.driver.p4util.get_psifile", "api/psi4.driver.p4util.getattr_ignorecase", "api/psi4.driver.p4util.hamiltonian_solver", "api/psi4.driver.p4util.hold_options_state", "api/psi4.driver.p4util.import_ignorecase", "api/psi4.driver.p4util.kwargs_lower", "api/psi4.driver.p4util.levenshtein", "api/psi4.driver.p4util.libint2_configuration", "api/psi4.driver.p4util.libint2_print_out", "api/psi4.driver.p4util.mat2arr", "api/psi4.driver.p4util.message_box", "api/psi4.driver.p4util.oeprop", "api/psi4.driver.p4util.pcm_helper", "api/psi4.driver.p4util.plump_qcvar", "api/psi4.driver.p4util.prefactor_ecd", "api/psi4.driver.p4util.prefactor_opa", "api/psi4.driver.p4util.prepare_options_for_modules", "api/psi4.driver.p4util.prepare_options_for_set_options", "api/psi4.driver.p4util.provenance_stamp", "api/psi4.driver.p4util.sanitize_method", "api/psi4.driver.p4util.set_memory", "api/psi4.driver.p4util.set_module_options", "api/psi4.driver.p4util.set_options", "api/psi4.driver.p4util.spectrum", "api/psi4.driver.p4util.state_to_atomicinput", "api/psi4.driver.pcm_helper", "api/psi4.driver.process_input", "api/psi4.driver.prop", "api/psi4.driver.properties", "api/psi4.driver.qcdb.vib.compare_vibinfos", "api/psi4.driver.qcdb.vib.filter_nonvib", "api/psi4.driver.qcdb.vib.filter_omega_to_real", "api/psi4.driver.qcdb.vib.harmonic_analysis", "api/psi4.driver.qcdb.vib.hessian_symmetrize", "api/psi4.driver.qcdb.vib.print_molden_vibs", "api/psi4.driver.qcdb.vib.print_vibs", "api/psi4.driver.qcdb.vib.thermo", "api/psi4.driver.sanitize_method", "api/psi4.driver.sanitize_name", "api/psi4.driver.scf_helper", "api/psi4.driver.scf_wavefunction_factory", "api/psi4.driver.set_memory", "api/psi4.driver.set_module_options", "api/psi4.driver.set_options", "api/psi4.driver.tdscf", "api/psi4.driver.vibanal_wfn", "appendices", "autodir_options_c/adc__cutoff_amps_print", "autodir_options_c/adc__gauge", "autodir_options_c/adc__kind", "autodir_options_c/adc__max_num_vecs", "autodir_options_c/adc__maxiter", "autodir_options_c/adc__num_core_orbitals", "autodir_options_c/adc__num_guesses", "autodir_options_c/adc__r_convergence", "autodir_options_c/adc__reference", "autodir_options_c/adc__roots_per_irrep", "autodir_options_c/ccdensity__ao_basis", "autodir_options_c/ccdensity__cachelevel", "autodir_options_c/ccdensity__debug", "autodir_options_c/ccdensity__gauge", "autodir_options_c/ccdensity__ints_tolerance", "autodir_options_c/ccdensity__opdm_only", "autodir_options_c/ccdensity__opdm_relax", "autodir_options_c/ccdensity__prop_all", "autodir_options_c/ccdensity__prop_root", "autodir_options_c/ccdensity__prop_sym", "autodir_options_c/ccdensity__reference", "autodir_options_c/ccdensity__roots_per_irrep", "autodir_options_c/ccdensity__wfn", "autodir_options_c/ccdensity__write_nos", "autodir_options_c/ccdensity__xi", "autodir_options_c/ccdensity__xi_connect", "autodir_options_c/ccdensity__zeta", "autodir_options_c/ccenergy__abcd", "autodir_options_c/ccenergy__analyze", "autodir_options_c/ccenergy__ao_basis", "autodir_options_c/ccenergy__bccd_maxiter", "autodir_options_c/ccenergy__brueckner_orbs_r_convergence", "autodir_options_c/ccenergy__cachelevel", "autodir_options_c/ccenergy__cachetype", "autodir_options_c/ccenergy__cc_num_threads", "autodir_options_c/ccenergy__cc_os_scale", "autodir_options_c/ccenergy__cc_ss_scale", "autodir_options_c/ccenergy__diis", "autodir_options_c/ccenergy__e_convergence", "autodir_options_c/ccenergy__force_restart", "autodir_options_c/ccenergy__local", "autodir_options_c/ccenergy__local_cphf_cutoff", "autodir_options_c/ccenergy__local_cutoff", "autodir_options_c/ccenergy__local_method", "autodir_options_c/ccenergy__local_pairdef", "autodir_options_c/ccenergy__local_weakp", "autodir_options_c/ccenergy__maxiter", "autodir_options_c/ccenergy__mp2_amps_print", "autodir_options_c/ccenergy__mp2_os_scale", "autodir_options_c/ccenergy__mp2_ss_scale", "autodir_options_c/ccenergy__new_triples", "autodir_options_c/ccenergy__num_amps_print", "autodir_options_c/ccenergy__pair_energies_print", "autodir_options_c/ccenergy__property", "autodir_options_c/ccenergy__r_convergence", "autodir_options_c/ccenergy__reference", "autodir_options_c/ccenergy__restart", "autodir_options_c/ccenergy__scs_ccsd", "autodir_options_c/ccenergy__scs_mp2", "autodir_options_c/ccenergy__scsn_mp2", "autodir_options_c/ccenergy__semicanonical", "autodir_options_c/ccenergy__t2_coupled", "autodir_options_c/ccenergy__t3_ws_incore", "autodir_options_c/ccenergy__wfn", "autodir_options_c/cceom__abcd", "autodir_options_c/cceom__cachelevel", "autodir_options_c/cceom__cachetype", "autodir_options_c/cceom__cc3_follow_root", "autodir_options_c/cceom__cc_num_threads", "autodir_options_c/cceom__collapse_with_last", "autodir_options_c/cceom__collapse_with_last_cc3", "autodir_options_c/cceom__complex_tolerance", "autodir_options_c/cceom__e_convergence", "autodir_options_c/cceom__eom_guess", "autodir_options_c/cceom__eom_reference", "autodir_options_c/cceom__excitation_range", "autodir_options_c/cceom__full_matrix", "autodir_options_c/cceom__local", "autodir_options_c/cceom__local_cutoff", "autodir_options_c/cceom__local_do_singles", "autodir_options_c/cceom__local_filter_singles", "autodir_options_c/cceom__local_method", "autodir_options_c/cceom__local_preconditioner", "autodir_options_c/cceom__local_weakp", "autodir_options_c/cceom__maxiter", "autodir_options_c/cceom__new_triples", "autodir_options_c/cceom__num_amps_print", "autodir_options_c/cceom__overlap_check", "autodir_options_c/cceom__prop_root", "autodir_options_c/cceom__prop_sym", "autodir_options_c/cceom__r_convergence", "autodir_options_c/cceom__reference", "autodir_options_c/cceom__restart_eom_cc3", "autodir_options_c/cceom__rhf_triplets", "autodir_options_c/cceom__roots_per_irrep", "autodir_options_c/cceom__schmidt_add_residual_tolerance", "autodir_options_c/cceom__semicanonical", "autodir_options_c/cceom__singles_print", "autodir_options_c/cceom__ss_e_convergence", "autodir_options_c/cceom__ss_r_convergence", "autodir_options_c/cceom__ss_skip_diag", "autodir_options_c/cceom__ss_vecs_per_root", "autodir_options_c/cceom__t3_ws_incore", "autodir_options_c/cceom__vecs_cc3", "autodir_options_c/cceom__vecs_per_root", "autodir_options_c/cceom__wfn", "autodir_options_c/cchbar__cachelevel", "autodir_options_c/cchbar__eom_reference", "autodir_options_c/cchbar__t_amps", "autodir_options_c/cchbar__wabei_lowdisk", "autodir_options_c/cchbar__wfn", "autodir_options_c/cclambda__abcd", "autodir_options_c/cclambda__ao_basis", "autodir_options_c/cclambda__cachelevel", "autodir_options_c/cclambda__diis", "autodir_options_c/cclambda__jobtype", "autodir_options_c/cclambda__local", "autodir_options_c/cclambda__local_cphf_cutoff", "autodir_options_c/cclambda__local_cutoff", "autodir_options_c/cclambda__local_filter_singles", "autodir_options_c/cclambda__local_method", "autodir_options_c/cclambda__local_pairdef", "autodir_options_c/cclambda__local_weakp", "autodir_options_c/cclambda__maxiter", "autodir_options_c/cclambda__num_amps_print", "autodir_options_c/cclambda__prop_all", "autodir_options_c/cclambda__prop_root", "autodir_options_c/cclambda__prop_sym", "autodir_options_c/cclambda__r_convergence", "autodir_options_c/cclambda__restart", "autodir_options_c/cclambda__roots_per_irrep", "autodir_options_c/cclambda__sekino", "autodir_options_c/cclambda__wfn", "autodir_options_c/cclambda__zeta", "autodir_options_c/ccresponse__abcd", "autodir_options_c/ccresponse__analyze", "autodir_options_c/ccresponse__cachelevel", "autodir_options_c/ccresponse__diis", "autodir_options_c/ccresponse__gauge", "autodir_options_c/ccresponse__linear", "autodir_options_c/ccresponse__local", "autodir_options_c/ccresponse__local_cphf_cutoff", "autodir_options_c/ccresponse__local_cutoff", "autodir_options_c/ccresponse__local_filter_singles", "autodir_options_c/ccresponse__local_method", "autodir_options_c/ccresponse__local_pairdef", "autodir_options_c/ccresponse__local_weakp", "autodir_options_c/ccresponse__maxiter", "autodir_options_c/ccresponse__num_amps_print", "autodir_options_c/ccresponse__omega", "autodir_options_c/ccresponse__property", "autodir_options_c/ccresponse__r_convergence", "autodir_options_c/ccresponse__reference", "autodir_options_c/ccresponse__restart", "autodir_options_c/ccresponse__sekino", "autodir_options_c/ccresponse__wfn", "autodir_options_c/cctransort__ao_basis", "autodir_options_c/cctransort__cachelevel", "autodir_options_c/cctransort__delete_tei", "autodir_options_c/cctransort__reference", "autodir_options_c/cctransort__run_cctransort", "autodir_options_c/cctransort__semicanonical", "autodir_options_c/cctransort__wfn", "autodir_options_c/cctriples__cc_num_threads", "autodir_options_c/cctriples__reference", "autodir_options_c/cctriples__semicanonical", "autodir_options_c/cctriples__wfn", "autodir_options_c/cfour__cfour_abcdtype", "autodir_options_c/cfour__cfour_active_orbi", "autodir_options_c/cfour__cfour_anh_algorithm", "autodir_options_c/cfour__cfour_anh_derivatives", "autodir_options_c/cfour__cfour_anh_stepsize", "autodir_options_c/cfour__cfour_anh_symmetry", "autodir_options_c/cfour__cfour_anharmonic", "autodir_options_c/cfour__cfour_ao_ladders", "autodir_options_c/cfour__cfour_av_scf", "autodir_options_c/cfour__cfour_basis", "autodir_options_c/cfour__cfour_bruck_conv", "autodir_options_c/cfour__cfour_brueckner", "autodir_options_c/cfour__cfour_cache_recs", "autodir_options_c/cfour__cfour_calc_level", "autodir_options_c/cfour__cfour_cc_conv", "autodir_options_c/cfour__cfour_cc_exporder", "autodir_options_c/cfour__cfour_cc_extrapolation", "autodir_options_c/cfour__cfour_cc_maxcyc", "autodir_options_c/cfour__cfour_cc_program", "autodir_options_c/cfour__cfour_charge", "autodir_options_c/cfour__cfour_cis_conv", "autodir_options_c/cfour__cfour_continuum", "autodir_options_c/cfour__cfour_contraction", "autodir_options_c/cfour__cfour_convergence", "autodir_options_c/cfour__cfour_coordinates", "autodir_options_c/cfour__cfour_core_orbitals", "autodir_options_c/cfour__cfour_cphf_conver", "autodir_options_c/cfour__cfour_cphf_maxcyc", "autodir_options_c/cfour__cfour_curvilinear", "autodir_options_c/cfour__cfour_dboc", "autodir_options_c/cfour__cfour_dct", "autodir_options_c/cfour__cfour_deriv_level", "autodir_options_c/cfour__cfour_diff_type", "autodir_options_c/cfour__cfour_dropmo", "autodir_options_c/cfour__cfour_ecp", "autodir_options_c/cfour__cfour_eigenvector", "autodir_options_c/cfour__cfour_el_anharm", "autodir_options_c/cfour__cfour_eom_nonit", "autodir_options_c/cfour__cfour_estate_conv", "autodir_options_c/cfour__cfour_estate_maxcyc", "autodir_options_c/cfour__cfour_estate_prop", "autodir_options_c/cfour__cfour_estate_sym", "autodir_options_c/cfour__cfour_estate_trans", "autodir_options_c/cfour__cfour_eval_hess", "autodir_options_c/cfour__cfour_excitation", "autodir_options_c/cfour__cfour_excite", "autodir_options_c/cfour__cfour_fc_field", "autodir_options_c/cfour__cfour_fd_calctype", "autodir_options_c/cfour__cfour_fd_irreps", "autodir_options_c/cfour__cfour_fd_project", "autodir_options_c/cfour__cfour_fd_stepsize", "autodir_options_c/cfour__cfour_fd_usegroup", "autodir_options_c/cfour__cfour_file_recsiz", "autodir_options_c/cfour__cfour_file_stripe", "autodir_options_c/cfour__cfour_finite_perturbation", "autodir_options_c/cfour__cfour_fock", "autodir_options_c/cfour__cfour_freq_algorithm", "autodir_options_c/cfour__cfour_frozen_core", "autodir_options_c/cfour__cfour_frozen_virt", "autodir_options_c/cfour__cfour_gamma_abcd", "autodir_options_c/cfour__cfour_genbas_1", "autodir_options_c/cfour__cfour_genbas_2", "autodir_options_c/cfour__cfour_genbas_3", "autodir_options_c/cfour__cfour_genbas_4", "autodir_options_c/cfour__cfour_geo_conv", "autodir_options_c/cfour__cfour_geo_maxcyc", "autodir_options_c/cfour__cfour_geo_maxstep", "autodir_options_c/cfour__cfour_geo_method", "autodir_options_c/cfour__cfour_giao", "autodir_options_c/cfour__cfour_grid", "autodir_options_c/cfour__cfour_guess", "autodir_options_c/cfour__cfour_hbar", "autodir_options_c/cfour__cfour_hfstability", "autodir_options_c/cfour__cfour_incore", "autodir_options_c/cfour__cfour_input_mrcc", "autodir_options_c/cfour__cfour_integrals", "autodir_options_c/cfour__cfour_joda_print", "autodir_options_c/cfour__cfour_lineq_conv", "autodir_options_c/cfour__cfour_lineq_maxcy", "autodir_options_c/cfour__cfour_lineq_type", "autodir_options_c/cfour__cfour_lock_orbocc", "autodir_options_c/cfour__cfour_maxstep", "autodir_options_c/cfour__cfour_mem_unit", "autodir_options_c/cfour__cfour_memory_size", "autodir_options_c/cfour__cfour_method", "autodir_options_c/cfour__cfour_mrcc", "autodir_options_c/cfour__cfour_multiplicity", "autodir_options_c/cfour__cfour_nacoupling", "autodir_options_c/cfour__cfour_negeval", "autodir_options_c/cfour__cfour_newnorm", "autodir_options_c/cfour__cfour_nonhf", "autodir_options_c/cfour__cfour_ntop_tamp", "autodir_options_c/cfour__cfour_occupation", "autodir_options_c/cfour__cfour_omp_num_threads", "autodir_options_c/cfour__cfour_open-shell", "autodir_options_c/cfour__cfour_opt_maxcyc", "autodir_options_c/cfour__cfour_orbitals", "autodir_options_c/cfour__cfour_pert_orb", "autodir_options_c/cfour__cfour_points", "autodir_options_c/cfour__cfour_print", "autodir_options_c/cfour__cfour_prop_integral", "autodir_options_c/cfour__cfour_props", "autodir_options_c/cfour__cfour_qrhf_general", "autodir_options_c/cfour__cfour_qrhf_orbital", "autodir_options_c/cfour__cfour_qrhfgues", "autodir_options_c/cfour__cfour_raman_int", "autodir_options_c/cfour__cfour_raman_orb", "autodir_options_c/cfour__cfour_rdo", "autodir_options_c/cfour__cfour_reference", "autodir_options_c/cfour__cfour_relativistic", "autodir_options_c/cfour__cfour_relax_dens", "autodir_options_c/cfour__cfour_res_raman", "autodir_options_c/cfour__cfour_restart_cc", "autodir_options_c/cfour__cfour_rot_evec", "autodir_options_c/cfour__cfour_save_ints", "autodir_options_c/cfour__cfour_scale_on", "autodir_options_c/cfour__cfour_scf_conv", "autodir_options_c/cfour__cfour_scf_damping", "autodir_options_c/cfour__cfour_scf_exporder", "autodir_options_c/cfour__cfour_scf_expstart", "autodir_options_c/cfour__cfour_scf_extrapolation", "autodir_options_c/cfour__cfour_scf_maxcyc", "autodir_options_c/cfour__cfour_sd_field", "autodir_options_c/cfour__cfour_spherical", "autodir_options_c/cfour__cfour_spin_flip", "autodir_options_c/cfour__cfour_spin_orbit", "autodir_options_c/cfour__cfour_spin_scal", "autodir_options_c/cfour__cfour_spinrotation", "autodir_options_c/cfour__cfour_subgroup", "autodir_options_c/cfour__cfour_sym_check", "autodir_options_c/cfour__cfour_symmetry", "autodir_options_c/cfour__cfour_t3_extrapol", "autodir_options_c/cfour__cfour_tamp_sum", "autodir_options_c/cfour__cfour_thermochemistry", "autodir_options_c/cfour__cfour_trans_inv", "autodir_options_c/cfour__cfour_treat_pert", "autodir_options_c/cfour__cfour_uij_threshold", "autodir_options_c/cfour__cfour_units", "autodir_options_c/cfour__cfour_update_hessian", "autodir_options_c/cfour__cfour_vibration", "autodir_options_c/cfour__cfour_vtran", "autodir_options_c/cfour__cfour_xfield", "autodir_options_c/cfour__cfour_xform_tol", "autodir_options_c/cfour__cfour_yfield", "autodir_options_c/cfour__cfour_zfield", "autodir_options_c/cfour__translate_psi4", "autodir_options_c/cphf__cphf_mem_safety_factor", "autodir_options_c/cphf__cphf_tasks", "autodir_options_c/cphf__debug", "autodir_options_c/cphf__df_basis_scf", "autodir_options_c/cphf__explicit_hamiltonian", "autodir_options_c/cphf__module", "autodir_options_c/cphf__print", "autodir_options_c/cphf__scf_type", "autodir_options_c/cphf__solver_convergence", "autodir_options_c/cphf__solver_maxiter", "autodir_options_c/cphf__solver_n_guess", "autodir_options_c/cphf__solver_precondition", "autodir_options_c/dct__algorithm", "autodir_options_c/dct__ao_basis", "autodir_options_c/dct__cachelevel", "autodir_options_c/dct__damping_percentage", "autodir_options_c/dct__dct_functional", "autodir_options_c/dct__dct_guess", "autodir_options_c/dct__dct_type", "autodir_options_c/dct__df_basis_dct", "autodir_options_c/dct__diis_max_vecs", "autodir_options_c/dct__diis_min_vecs", "autodir_options_c/dct__diis_start_convergence", "autodir_options_c/dct__e_convergence", "autodir_options_c/dct__energy_level_shift", "autodir_options_c/dct__guess_r_convergence", "autodir_options_c/dct__ints_tolerance", "autodir_options_c/dct__maxiter", "autodir_options_c/dct__odc_guess", "autodir_options_c/dct__opdm", "autodir_options_c/dct__orbital_level_shift", "autodir_options_c/dct__qc_coupling", "autodir_options_c/dct__qc_type", "autodir_options_c/dct__r_convergence", "autodir_options_c/dct__reference", "autodir_options_c/dct__relax_guess_orbitals", "autodir_options_c/dct__response_algorithm", "autodir_options_c/dct__stability_add_vectors", "autodir_options_c/dct__stability_augment_space_tol", "autodir_options_c/dct__stability_check", "autodir_options_c/dct__stability_convergence", "autodir_options_c/dct__stability_max_space_size", "autodir_options_c/dct__stability_n_eigenvalues", "autodir_options_c/dct__stability_n_guess_vectors", "autodir_options_c/dct__three_particle", "autodir_options_c/dct__tikhonow_omega", "autodir_options_c/ddx__ddx_diis_max_vecs", "autodir_options_c/ddx__ddx_eta", "autodir_options_c/ddx__ddx_fmm", "autodir_options_c/ddx__ddx_fmm_local_lmax", "autodir_options_c/ddx__ddx_fmm_multipole_lmax", "autodir_options_c/ddx__ddx_incore", "autodir_options_c/ddx__ddx_lmax", "autodir_options_c/ddx__ddx_logfile", "autodir_options_c/ddx__ddx_maxiter", "autodir_options_c/ddx__ddx_model", "autodir_options_c/ddx__ddx_n_lebedev", "autodir_options_c/ddx__ddx_radii", "autodir_options_c/ddx__ddx_radii_scaling", "autodir_options_c/ddx__ddx_radii_set", "autodir_options_c/ddx__ddx_shift", "autodir_options_c/ddx__ddx_solute_radial_points", "autodir_options_c/ddx__ddx_solute_spherical_points", "autodir_options_c/ddx__ddx_solvation_convergence", "autodir_options_c/ddx__ddx_solvent", "autodir_options_c/ddx__ddx_solvent_epsilon", "autodir_options_c/ddx__ddx_solvent_epsilon_optical", "autodir_options_c/ddx__ddx_solvent_kappa", "autodir_options_c/detci__a_ras3_max", "autodir_options_c/detci__avg_states", "autodir_options_c/detci__avg_weights", "autodir_options_c/detci__b_ras3_max", "autodir_options_c/detci__bendazzoli", "autodir_options_c/detci__calc_s_squared", "autodir_options_c/detci__cc", "autodir_options_c/detci__cc_a_ras3_max", "autodir_options_c/detci__cc_b_ras3_max", "autodir_options_c/detci__cc_ex_level", "autodir_options_c/detci__cc_fix_external", "autodir_options_c/detci__cc_fix_external_min", "autodir_options_c/detci__cc_macro", "autodir_options_c/detci__cc_mixed", "autodir_options_c/detci__cc_ras34_max", "autodir_options_c/detci__cc_ras3_max", "autodir_options_c/detci__cc_ras4_max", "autodir_options_c/detci__cc_update_eps", "autodir_options_c/detci__cc_val_ex_level", "autodir_options_c/detci__cc_variational", "autodir_options_c/detci__cc_vecs_read", "autodir_options_c/detci__cc_vecs_write", "autodir_options_c/detci__ci_file_start", "autodir_options_c/detci__ci_maxiter", "autodir_options_c/detci__ci_num_threads", "autodir_options_c/detci__ciblks_print", "autodir_options_c/detci__collapse_size", "autodir_options_c/detci__detci_freeze_core", "autodir_options_c/detci__df_basis_mcscf", "autodir_options_c/detci__diag_method", "autodir_options_c/detci__diis", "autodir_options_c/detci__diis_freq", "autodir_options_c/detci__diis_max_vecs", "autodir_options_c/detci__diis_min_vecs", "autodir_options_c/detci__diis_start_iter", "autodir_options_c/detci__dipmom", "autodir_options_c/detci__e_convergence", "autodir_options_c/detci__ex_allow", "autodir_options_c/detci__ex_level", "autodir_options_c/detci__fci", "autodir_options_c/detci__fci_strings", "autodir_options_c/detci__filter_guess", "autodir_options_c/detci__filter_guess_det1", "autodir_options_c/detci__filter_guess_det2", "autodir_options_c/detci__filter_guess_sign", "autodir_options_c/detci__filter_zero_det", "autodir_options_c/detci__follow_root", "autodir_options_c/detci__follow_vector", "autodir_options_c/detci__guess_vector", "autodir_options_c/detci__h0_block_coupling", "autodir_options_c/detci__h0_block_coupling_size", "autodir_options_c/detci__h0_blocksize", "autodir_options_c/detci__h0_guess_size", "autodir_options_c/detci__hd_avg", "autodir_options_c/detci__hd_otf", "autodir_options_c/detci__icore", "autodir_options_c/detci__istop", "autodir_options_c/detci__lse", "autodir_options_c/detci__lse_collapse", "autodir_options_c/detci__lse_tolerance", "autodir_options_c/detci__max_num_vecs", "autodir_options_c/detci__mcscf_algorithm", "autodir_options_c/detci__mcscf_ci_cleanup", "autodir_options_c/detci__mcscf_diis_error_type", "autodir_options_c/detci__mcscf_diis_freq", "autodir_options_c/detci__mcscf_diis_max_vecs", "autodir_options_c/detci__mcscf_diis_start", "autodir_options_c/detci__mcscf_dpd_cleanup", "autodir_options_c/detci__mcscf_e_convergence", "autodir_options_c/detci__mcscf_guess", "autodir_options_c/detci__mcscf_max_rot", "autodir_options_c/detci__mcscf_maxiter", "autodir_options_c/detci__mcscf_r_convergence", "autodir_options_c/detci__mcscf_rotate", "autodir_options_c/detci__mcscf_so_start_e", "autodir_options_c/detci__mcscf_so_start_grad", "autodir_options_c/detci__mcscf_type", "autodir_options_c/detci__mixed", "autodir_options_c/detci__mixed4", "autodir_options_c/detci__mpn", "autodir_options_c/detci__mpn_order_save", "autodir_options_c/detci__mpn_schmidt", "autodir_options_c/detci__mpn_wigner", "autodir_options_c/detci__ms0", "autodir_options_c/detci__nat_orbs", "autodir_options_c/detci__no_dfile", "autodir_options_c/detci__num_amps_print", "autodir_options_c/detci__num_dets_print", "autodir_options_c/detci__num_init_vecs", "autodir_options_c/detci__num_roots", "autodir_options_c/detci__opdm", "autodir_options_c/detci__perturb_magnitude", "autodir_options_c/detci__preconditioner", "autodir_options_c/detci__r4s", "autodir_options_c/detci__r_convergence", "autodir_options_c/detci__ras34_max", "autodir_options_c/detci__ras3_max", "autodir_options_c/detci__ras4_max", "autodir_options_c/detci__reference", "autodir_options_c/detci__reference_sym", "autodir_options_c/detci__repl_otf", "autodir_options_c/detci__restart", "autodir_options_c/detci__s", "autodir_options_c/detci__sf_restrict", "autodir_options_c/detci__sigma_overlap", "autodir_options_c/detci__tdm", "autodir_options_c/detci__tpdm", "autodir_options_c/detci__update", "autodir_options_c/detci__val_ex_level", "autodir_options_c/detci__wfn", "autodir_options_c/dfep2__df_basis_ep2", "autodir_options_c/dfep2__ep2_convergence", "autodir_options_c/dfep2__ep2_maxiter", "autodir_options_c/dfep2__ep2_num_ea", "autodir_options_c/dfep2__ep2_num_ip", "autodir_options_c/dfep2__ep2_orbitals", "autodir_options_c/dfmp2__basis", "autodir_options_c/dfmp2__df_basis_mp2", "autodir_options_c/dfmp2__df_ints_io", "autodir_options_c/dfmp2__df_ints_num_threads", "autodir_options_c/dfmp2__dfmp2_mem_factor", "autodir_options_c/dfmp2__dfmp2_p2_tolerance", "autodir_options_c/dfmp2__dfmp2_p_tolerance", "autodir_options_c/dfmp2__ints_tolerance", "autodir_options_c/dfmp2__madmp2_sleep", "autodir_options_c/dfmp2__mp2_os_scale", "autodir_options_c/dfmp2__mp2_ss_scale", "autodir_options_c/dfmp2__onepdm", "autodir_options_c/dfmp2__opdm_relax", "autodir_options_c/dfocc__cc_diis_max_vecs", "autodir_options_c/dfocc__cc_diis_min_vecs", "autodir_options_c/dfocc__cc_lambda", "autodir_options_c/dfocc__cc_maxiter", "autodir_options_c/dfocc__cholesky", "autodir_options_c/dfocc__cholesky_tolerance", "autodir_options_c/dfocc__comput_s2", "autodir_options_c/dfocc__cutoff", "autodir_options_c/dfocc__do_diis", "autodir_options_c/dfocc__do_level_shift", "autodir_options_c/dfocc__do_scs", "autodir_options_c/dfocc__do_sos", "autodir_options_c/dfocc__e3_scale", "autodir_options_c/dfocc__e_convergence", "autodir_options_c/dfocc__ekt_ip", "autodir_options_c/dfocc__hess_type", "autodir_options_c/dfocc__integral_cutoff", "autodir_options_c/dfocc__level_shift", "autodir_options_c/dfocc__lineq_solver", "autodir_options_c/dfocc__max_mograd_convergence", "autodir_options_c/dfocc__mo_diis_num_vecs", "autodir_options_c/dfocc__mo_maxiter", "autodir_options_c/dfocc__mo_step_max", "autodir_options_c/dfocc__molden_write", "autodir_options_c/dfocc__mp2_amp_type", "autodir_options_c/dfocc__mp2_os_scale", "autodir_options_c/dfocc__mp2_sos_scale", "autodir_options_c/dfocc__mp2_sos_scale2", "autodir_options_c/dfocc__mp2_ss_scale", "autodir_options_c/dfocc__nat_orbs", "autodir_options_c/dfocc__occ_orbs_print", "autodir_options_c/dfocc__oeprop", "autodir_options_c/dfocc__oo_scale", "autodir_options_c/dfocc__opt_method", "autodir_options_c/dfocc__orb_opt", "autodir_options_c/dfocc__orb_resp_solver", "autodir_options_c/dfocc__orth_type", "autodir_options_c/dfocc__pcg_beta_type", "autodir_options_c/dfocc__pcg_convergence", "autodir_options_c/dfocc__pcg_maxiter", "autodir_options_c/dfocc__ppl_type", "autodir_options_c/dfocc__qchf", "autodir_options_c/dfocc__r_convergence", "autodir_options_c/dfocc__read_scf_3index", "autodir_options_c/dfocc__reg_param", "autodir_options_c/dfocc__regularization", "autodir_options_c/dfocc__remp_a", "autodir_options_c/dfocc__rms_mograd_convergence", "autodir_options_c/dfocc__scs_type", "autodir_options_c/dfocc__sos_type", "autodir_options_c/dfocc__triples_iabc_type", "autodir_options_c/dfocc__wfn_type", "autodir_options_c/dlpno__df_basis_mp2", "autodir_options_c/dlpno__dlpno_algorithm", "autodir_options_c/dlpno__dlpno_local_orbitals", "autodir_options_c/dlpno__dlpno_maxiter", "autodir_options_c/dlpno__doi_basis_tolerance", "autodir_options_c/dlpno__doi_pruning_scheme", "autodir_options_c/dlpno__doi_radial_points", "autodir_options_c/dlpno__doi_spherical_points", "autodir_options_c/dlpno__e_convergence", "autodir_options_c/dlpno__f_cut", "autodir_options_c/dlpno__local_convergence", "autodir_options_c/dlpno__local_maxiter", "autodir_options_c/dlpno__pno_convergence", "autodir_options_c/dlpno__r_convergence", "autodir_options_c/dlpno__s_cut", "autodir_options_c/dlpno__t_cut_clmo", "autodir_options_c/dlpno__t_cut_cpao", "autodir_options_c/dlpno__t_cut_do", "autodir_options_c/dlpno__t_cut_do_ij", "autodir_options_c/dlpno__t_cut_do_pre", "autodir_options_c/dlpno__t_cut_mkn", "autodir_options_c/dlpno__t_cut_pno", "autodir_options_c/dlpno__t_cut_pre", "autodir_options_c/dmrg__dmrg_caspt2_calc", "autodir_options_c/dmrg__dmrg_caspt2_imag", "autodir_options_c/dmrg__dmrg_caspt2_ipea", "autodir_options_c/dmrg__dmrg_caspt2_orbs", "autodir_options_c/dmrg__dmrg_diis", "autodir_options_c/dmrg__dmrg_diis_write", "autodir_options_c/dmrg__dmrg_excitation", "autodir_options_c/dmrg__dmrg_irrep", "autodir_options_c/dmrg__dmrg_local_init", "autodir_options_c/dmrg__dmrg_molden_write", "autodir_options_c/dmrg__dmrg_mps_write", "autodir_options_c/dmrg__dmrg_multiplicity", "autodir_options_c/dmrg__dmrg_opdm_ao_print", "autodir_options_c/dmrg__dmrg_print_corr", "autodir_options_c/dmrg__dmrg_scf_active_space", "autodir_options_c/dmrg__dmrg_scf_diis_thr", "autodir_options_c/dmrg__dmrg_scf_grad_thr", "autodir_options_c/dmrg__dmrg_scf_max_iter", "autodir_options_c/dmrg__dmrg_scf_state_avg", "autodir_options_c/dmrg__dmrg_sweep_dvdson_rtol", "autodir_options_c/dmrg__dmrg_sweep_energy_conv", "autodir_options_c/dmrg__dmrg_sweep_max_sweeps", "autodir_options_c/dmrg__dmrg_sweep_noise_prefac", "autodir_options_c/dmrg__dmrg_sweep_states", "autodir_options_c/dmrg__dmrg_unitary_write", "autodir_options_c/efp__dertype", "autodir_options_c/efp__efp_disp", "autodir_options_c/efp__efp_disp_damping", "autodir_options_c/efp__efp_elst", "autodir_options_c/efp__efp_elst_damping", "autodir_options_c/efp__efp_exch", "autodir_options_c/efp__efp_ind", "autodir_options_c/efp__efp_ind_damping", "autodir_options_c/efp__efp_qm_elst", "autodir_options_c/efp__efp_qm_ind", "autodir_options_c/efp__print", "autodir_options_c/efp__qmefp", "autodir_options_c/findif__disp_size", "autodir_options_c/findif__fd_project", "autodir_options_c/findif__gradient_write", "autodir_options_c/findif__hessian_write", "autodir_options_c/findif__normal_modes_write", "autodir_options_c/findif__points", "autodir_options_c/fisapt__cphf_r_convergence", "autodir_options_c/fisapt__cubic_basis_tolerance", "autodir_options_c/fisapt__cubic_block_max_points", "autodir_options_c/fisapt__cubic_grid_overage", "autodir_options_c/fisapt__cubic_grid_spacing", "autodir_options_c/fisapt__fisapt_charge_completeness", "autodir_options_c/fisapt__fisapt_cube_densmat", "autodir_options_c/fisapt__fisapt_cube_linkibos", "autodir_options_c/fisapt__fisapt_cube_linkihos", "autodir_options_c/fisapt__fisapt_do_fsapt", "autodir_options_c/fisapt__fisapt_do_fsapt_disp", "autodir_options_c/fisapt__fisapt_do_plot", "autodir_options_c/fisapt__fisapt_exch_parperp", "autodir_options_c/fisapt__fisapt_fsapt_exch_scale", "autodir_options_c/fisapt__fisapt_fsapt_filepath", "autodir_options_c/fisapt__fisapt_fsapt_ind_response", "autodir_options_c/fisapt__fisapt_fsapt_ind_scale", "autodir_options_c/fisapt__fisapt_fssapt_filepath", "autodir_options_c/fisapt__fisapt_link_assignment", "autodir_options_c/fisapt__fisapt_link_ortho", "autodir_options_c/fisapt__fisapt_link_selection", "autodir_options_c/fisapt__fisapt_manual_links", "autodir_options_c/fisapt__fisapt_mem_safety_factor", "autodir_options_c/fisapt__fisapt_plot_filepath", "autodir_options_c/fisapt__ints_tolerance", "autodir_options_c/fisapt__local_convergence", "autodir_options_c/fisapt__local_ibo_condition", "autodir_options_c/fisapt__local_ibo_power", "autodir_options_c/fisapt__local_ibo_stars", "autodir_options_c/fisapt__local_ibo_stars_completeness", "autodir_options_c/fisapt__local_ibo_use_stars", "autodir_options_c/fisapt__local_maxiter", "autodir_options_c/fisapt__local_use_ghosts", "autodir_options_c/fisapt__maxiter", "autodir_options_c/fisapt__minao_basis", "autodir_options_c/fisapt__ssapt0_scale", "autodir_options_c/fnocc__active_nat_orbs", "autodir_options_c/fnocc__brueckner_maxiter", "autodir_options_c/fnocc__cc_scale_os", "autodir_options_c/fnocc__cc_scale_ss", "autodir_options_c/fnocc__cc_timings", "autodir_options_c/fnocc__cepa_level", "autodir_options_c/fnocc__cepa_no_singles", "autodir_options_c/fnocc__cholesky_tolerance", "autodir_options_c/fnocc__compute_mp4_triples", "autodir_options_c/fnocc__compute_triples", "autodir_options_c/fnocc__df_basis_cc", "autodir_options_c/fnocc__dfcc", "autodir_options_c/fnocc__diis_max_vecs", "autodir_options_c/fnocc__dipmom", "autodir_options_c/fnocc__e_convergence", "autodir_options_c/fnocc__maxiter", "autodir_options_c/fnocc__mp2_scale_os", "autodir_options_c/fnocc__mp2_scale_ss", "autodir_options_c/fnocc__nat_orbs", "autodir_options_c/fnocc__occ_percentage", "autodir_options_c/fnocc__occ_tolerance", "autodir_options_c/fnocc__r_convergence", "autodir_options_c/fnocc__run_ccsd", "autodir_options_c/fnocc__run_cepa", "autodir_options_c/fnocc__run_mp2", "autodir_options_c/fnocc__run_mp3", "autodir_options_c/fnocc__run_mp4", "autodir_options_c/fnocc__scs_ccsd", "autodir_options_c/fnocc__scs_cepa", "autodir_options_c/fnocc__scs_mp2", "autodir_options_c/fnocc__triples_low_memory", "autodir_options_c/fnocc__use_df_ints", "autodir_options_c/gdma__gdma_limit", "autodir_options_c/gdma__gdma_multipole_units", "autodir_options_c/gdma__gdma_origin", "autodir_options_c/gdma__gdma_radius", "autodir_options_c/gdma__gdma_switch", "autodir_options_c/globals__active", "autodir_options_c/globals__basis_relativistic", "autodir_options_c/globals__bench", "autodir_options_c/globals__brianqc_enable", "autodir_options_c/globals__cc_type", "autodir_options_c/globals__ci_type", "autodir_options_c/globals__cubeprop_basis_functions", "autodir_options_c/globals__cubeprop_filepath", "autodir_options_c/globals__cubeprop_isocontour_threshold", "autodir_options_c/globals__cubeprop_orbitals", "autodir_options_c/globals__cubeprop_tasks", "autodir_options_c/globals__cubic_basis_tolerance", "autodir_options_c/globals__cubic_block_max_points", "autodir_options_c/globals__cubic_grid_overage", "autodir_options_c/globals__cubic_grid_spacing", "autodir_options_c/globals__ddx", "autodir_options_c/globals__debug", "autodir_options_c/globals__dertype", "autodir_options_c/globals__df_basis_cc", "autodir_options_c/globals__die_if_not_converged", "autodir_options_c/globals__dkh_order", "autodir_options_c/globals__docc", "autodir_options_c/globals__external_potential_symmetry", "autodir_options_c/globals__freeze_core", "autodir_options_c/globals__freeze_core_policy", "autodir_options_c/globals__frozen_docc", "autodir_options_c/globals__frozen_uocc", "autodir_options_c/globals__integral_package", "autodir_options_c/globals__literal_cfour", "autodir_options_c/globals__ls_thc_basis_tolerance", "autodir_options_c/globals__ls_thc_df", "autodir_options_c/globals__ls_thc_pruning_scheme", "autodir_options_c/globals__ls_thc_radial_points", "autodir_options_c/globals__ls_thc_s_epsilon", "autodir_options_c/globals__ls_thc_spherical_points", "autodir_options_c/globals__ls_thc_weights_tolerance", "autodir_options_c/globals__mat_num_column_print", "autodir_options_c/globals__max_radial_moment", "autodir_options_c/globals__mbis_d_convergence", "autodir_options_c/globals__mbis_maxiter", "autodir_options_c/globals__mbis_pruning_scheme", "autodir_options_c/globals__mbis_radial_points", "autodir_options_c/globals__mbis_spherical_points", "autodir_options_c/globals__molden_with_virtual", "autodir_options_c/globals__mp2_type", "autodir_options_c/globals__mp_type", "autodir_options_c/globals__num_frozen_docc", "autodir_options_c/globals__num_frozen_uocc", "autodir_options_c/globals__parent_symmetry", "autodir_options_c/globals__pcm", "autodir_options_c/globals__pe", "autodir_options_c/globals__print", "autodir_options_c/globals__print_noons", "autodir_options_c/globals__properties", "autodir_options_c/globals__properties_origin", "autodir_options_c/globals__puream", "autodir_options_c/globals__qc_module", "autodir_options_c/globals__ras1", "autodir_options_c/globals__ras2", "autodir_options_c/globals__ras3", "autodir_options_c/globals__ras4", "autodir_options_c/globals__relativistic", "autodir_options_c/globals__restricted_docc", "autodir_options_c/globals__restricted_uocc", "autodir_options_c/globals__scf_type", "autodir_options_c/globals__screening", "autodir_options_c/globals__socc", "autodir_options_c/globals__wfn", "autodir_options_c/globals__writer_file_label", "autodir_options_c/mcscf__canonicalize_active_favg", "autodir_options_c/mcscf__canonicalize_inactive_favg", "autodir_options_c/mcscf__ci_diis", "autodir_options_c/mcscf__d_convergence", "autodir_options_c/mcscf__diis", "autodir_options_c/mcscf__diis_max_vecs", "autodir_options_c/mcscf__docc", "autodir_options_c/mcscf__e_convergence", "autodir_options_c/mcscf__favg", "autodir_options_c/mcscf__favg_start", "autodir_options_c/mcscf__follow_root", "autodir_options_c/mcscf__force_twocon", "autodir_options_c/mcscf__internal_rotations", "autodir_options_c/mcscf__level_shift", "autodir_options_c/mcscf__maxiter", "autodir_options_c/mcscf__mo_read", "autodir_options_c/mcscf__reference", "autodir_options_c/mcscf__rotate_mo_angle", "autodir_options_c/mcscf__rotate_mo_irrep", "autodir_options_c/mcscf__rotate_mo_p", "autodir_options_c/mcscf__rotate_mo_q", "autodir_options_c/mcscf__socc", "autodir_options_c/mcscf__turn_on_actv", "autodir_options_c/mcscf__wfn_sym", "autodir_options_c/mints__basis", "autodir_options_c/mints__omega_erf", "autodir_options_c/module__adc", "autodir_options_c/module__ccdensity", "autodir_options_c/module__ccenergy", "autodir_options_c/module__cceom", "autodir_options_c/module__cchbar", "autodir_options_c/module__cclambda", "autodir_options_c/module__ccresponse", "autodir_options_c/module__cctransort", "autodir_options_c/module__cctriples", "autodir_options_c/module__cfour", "autodir_options_c/module__cphf", "autodir_options_c/module__dct", "autodir_options_c/module__ddx", "autodir_options_c/module__detci", "autodir_options_c/module__dfep2", "autodir_options_c/module__dfmp2", "autodir_options_c/module__dfocc", "autodir_options_c/module__dlpno", "autodir_options_c/module__dmrg", "autodir_options_c/module__efp", "autodir_options_c/module__findif", "autodir_options_c/module__fisapt", "autodir_options_c/module__fnocc", "autodir_options_c/module__gdma", "autodir_options_c/module__globals", "autodir_options_c/module__mcscf", "autodir_options_c/module__mints", "autodir_options_c/module__mrcc", "autodir_options_c/module__occ", "autodir_options_c/module__optking", "autodir_options_c/module__pcm", "autodir_options_c/module__pe", "autodir_options_c/module__psimrcc", "autodir_options_c/module__sapt", "autodir_options_c/module__scf", "autodir_options_c/module__thermo", "autodir_options_c/mrcc__e_convergence", "autodir_options_c/mrcc__ints_tolerance", "autodir_options_c/mrcc__mrcc_level", "autodir_options_c/mrcc__mrcc_method", "autodir_options_c/mrcc__mrcc_num_doublet_roots", "autodir_options_c/mrcc__mrcc_num_singlet_roots", "autodir_options_c/mrcc__mrcc_num_triplet_roots", "autodir_options_c/mrcc__mrcc_omp_num_threads", "autodir_options_c/mrcc__mrcc_restart", "autodir_options_c/occ__cachelevel", "autodir_options_c/occ__cc_maxiter", "autodir_options_c/occ__ccl_energy", "autodir_options_c/occ__cepa_os_scale", "autodir_options_c/occ__cepa_sos_scale", "autodir_options_c/occ__cepa_ss_scale", "autodir_options_c/occ__cepa_type", "autodir_options_c/occ__cutoff", "autodir_options_c/occ__diis_max_vecs", "autodir_options_c/occ__diis_min_vecs", "autodir_options_c/occ__do_diis", "autodir_options_c/occ__do_level_shift", "autodir_options_c/occ__do_scs", "autodir_options_c/occ__do_sos", "autodir_options_c/occ__e3_scale", "autodir_options_c/occ__e_convergence", "autodir_options_c/occ__ea_poles", "autodir_options_c/occ__ekt_ea", "autodir_options_c/occ__ekt_ip", "autodir_options_c/occ__ep_ea_poles", "autodir_options_c/occ__ep_ip_poles", "autodir_options_c/occ__ep_maxiter", "autodir_options_c/occ__ip_poles", "autodir_options_c/occ__level_shift", "autodir_options_c/occ__max_mograd_convergence", "autodir_options_c/occ__mo_maxiter", "autodir_options_c/occ__mo_read", "autodir_options_c/occ__mo_step_max", "autodir_options_c/occ__mo_write", "autodir_options_c/occ__mograd_damping", "autodir_options_c/occ__mp2_os_scale", "autodir_options_c/occ__mp2_sos_scale", "autodir_options_c/occ__mp2_sos_scale2", "autodir_options_c/occ__mp2_ss_scale", "autodir_options_c/occ__nat_orbs", "autodir_options_c/occ__occ_orbs_print", "autodir_options_c/occ__oeprop", "autodir_options_c/occ__opt_method", "autodir_options_c/occ__orb_opt", "autodir_options_c/occ__orb_resp_solver", "autodir_options_c/occ__orth_type", "autodir_options_c/occ__os_scale", "autodir_options_c/occ__pcg_beta_type", "autodir_options_c/occ__pcg_convergence", "autodir_options_c/occ__pcg_maxiter", "autodir_options_c/occ__r_convergence", "autodir_options_c/occ__relaxed", "autodir_options_c/occ__remp_a", "autodir_options_c/occ__rms_mograd_convergence", "autodir_options_c/occ__scs_type", "autodir_options_c/occ__sos_type", "autodir_options_c/occ__spin_scale_type", "autodir_options_c/occ__ss_scale", "autodir_options_c/occ__symmetrize", "autodir_options_c/occ__tpdm_abcd_type", "autodir_options_c/occ__wfn_type", "autodir_options_c/optking__add_auxiliary_bonds", "autodir_options_c/optking__auxiliary_bond_factor", "autodir_options_c/optking__cart_hess_read", "autodir_options_c/optking__cartesian_sym_tolerance", "autodir_options_c/optking__consecutive_backsteps", "autodir_options_c/optking__covalent_connect", "autodir_options_c/optking__custom_coords", "autodir_options_c/optking__dynamic_level", "autodir_options_c/optking__ensure_bt_convergence", "autodir_options_c/optking__ext_force_bend", "autodir_options_c/optking__ext_force_cartesian", "autodir_options_c/optking__ext_force_dihedral", "autodir_options_c/optking__ext_force_distance", "autodir_options_c/optking__ext_force_oofp", "autodir_options_c/optking__flexible_g_convergence", "autodir_options_c/optking__frag_mode", "autodir_options_c/optking__frag_ref_atoms", "autodir_options_c/optking__freeze_all_dihedrals", "autodir_options_c/optking__freeze_interfrag", "autodir_options_c/optking__freeze_intrafrag", "autodir_options_c/optking__frozen_bend", "autodir_options_c/optking__frozen_cartesian", "autodir_options_c/optking__frozen_dihedral", "autodir_options_c/optking__frozen_distance", "autodir_options_c/optking__frozen_oofp", "autodir_options_c/optking__full_hess_every", "autodir_options_c/optking__g_convergence", "autodir_options_c/optking__geom_maxiter", "autodir_options_c/optking__h_bond_connect", "autodir_options_c/optking__h_guess_every", "autodir_options_c/optking__h_update_den_tol", "autodir_options_c/optking__hess_update", "autodir_options_c/optking__hess_update_limit", "autodir_options_c/optking__hess_update_limit_max", "autodir_options_c/optking__hess_update_limit_scale", "autodir_options_c/optking__hess_update_use_last", "autodir_options_c/optking__intcos_generate_exit", "autodir_options_c/optking__interfrag_collinear_tol", "autodir_options_c/optking__interfrag_coords", "autodir_options_c/optking__interfrag_dist_inv", "autodir_options_c/optking__interfrag_hess", "autodir_options_c/optking__interfrag_mode", "autodir_options_c/optking__interfrag_step_limit", "autodir_options_c/optking__interfragment_connect", "autodir_options_c/optking__intrafrag_hess", "autodir_options_c/optking__intrafrag_step_limit", "autodir_options_c/optking__intrafrag_step_limit_max", "autodir_options_c/optking__intrafrag_step_limit_min", "autodir_options_c/optking__irc_direction", "autodir_options_c/optking__irc_points", "autodir_options_c/optking__irc_step_size", "autodir_options_c/optking__max_disp_g_convergence", "autodir_options_c/optking__max_energy_g_convergence", "autodir_options_c/optking__max_force_g_convergence", "autodir_options_c/optking__opt_coordinates", "autodir_options_c/optking__opt_restart", "autodir_options_c/optking__opt_type", "autodir_options_c/optking__print_opt_params", "autodir_options_c/optking__print_trajectory_xyz_file", "autodir_options_c/optking__ranged_bend", "autodir_options_c/optking__ranged_dihedral", "autodir_options_c/optking__ranged_distance", "autodir_options_c/optking__ranged_oofp", "autodir_options_c/optking__rfo_follow_root", "autodir_options_c/optking__rfo_normalization_max", "autodir_options_c/optking__rfo_root", "autodir_options_c/optking__rms_disp_g_convergence", "autodir_options_c/optking__rms_force_g_convergence", "autodir_options_c/optking__rsrfo_alpha_max", "autodir_options_c/optking__save_optimization", "autodir_options_c/optking__step_type", "autodir_options_c/optking__test_b", "autodir_options_c/optking__test_derivative_b", "autodir_options_c/optking__unfreeze_dihedrals", "autodir_options_c/optking__write_opt_history", "autodir_options_c/optking__write_opt_result", "autodir_options_c/optking__write_trajectory", "autodir_options_c/pcm__pcm_cc_type", "autodir_options_c/pcm__pcm_scf_type", "autodir_options_c/pcm__pcmsolver_parsed_fname", "autodir_options_c/pe__border", "autodir_options_c/pe__border_n_redist", "autodir_options_c/pe__border_redist_order", "autodir_options_c/pe__border_redist_pol", "autodir_options_c/pe__border_rmin", "autodir_options_c/pe__border_rmin_unit", "autodir_options_c/pe__border_type", "autodir_options_c/pe__damp_induced", "autodir_options_c/pe__damp_multipole", "autodir_options_c/pe__damping_factor_induced", "autodir_options_c/pe__damping_factor_multipole", "autodir_options_c/pe__induced_convergence", "autodir_options_c/pe__isotropic_pol", "autodir_options_c/pe__maxiter", "autodir_options_c/pe__pe_ecp", "autodir_options_c/pe__potfile", "autodir_options_c/pe__summation_fields", "autodir_options_c/pe__tree_expansion_order", "autodir_options_c/pe__tree_theta", "autodir_options_c/psimrcc__cc_num_threads", "autodir_options_c/psimrcc__corr_ansatz", "autodir_options_c/psimrcc__corr_ccsd_t", "autodir_options_c/psimrcc__corr_charge", "autodir_options_c/psimrcc__corr_multp", "autodir_options_c/psimrcc__corr_wfn", "autodir_options_c/psimrcc__coupling", "autodir_options_c/psimrcc__coupling_terms", "autodir_options_c/psimrcc__damping_percentage", "autodir_options_c/psimrcc__diagonal_ccsd_t", "autodir_options_c/psimrcc__diagonalize_heff", "autodir_options_c/psimrcc__diis_max_vecs", "autodir_options_c/psimrcc__diis_start", "autodir_options_c/psimrcc__e_convergence", "autodir_options_c/psimrcc__favg_ccsd_t", "autodir_options_c/psimrcc__follow_root", "autodir_options_c/psimrcc__heff4", "autodir_options_c/psimrcc__heff_print", "autodir_options_c/psimrcc__lock_singlet", "autodir_options_c/psimrcc__maxiter", "autodir_options_c/psimrcc__mp2_ccsd_method", "autodir_options_c/psimrcc__mp2_guess", "autodir_options_c/psimrcc__no_singles", "autodir_options_c/psimrcc__offdiagonal_ccsd_t", "autodir_options_c/psimrcc__perturb_cbs", "autodir_options_c/psimrcc__perturb_cbs_coupling", "autodir_options_c/psimrcc__pt_energy", "autodir_options_c/psimrcc__r_convergence", "autodir_options_c/psimrcc__small_cutoff", "autodir_options_c/psimrcc__tikhonow_max", "autodir_options_c/psimrcc__tikhonow_omega", "autodir_options_c/psimrcc__tikhonow_triples", "autodir_options_c/psimrcc__triples_algorithm", "autodir_options_c/psimrcc__triples_diis", "autodir_options_c/psimrcc__use_spin_sym", "autodir_options_c/psimrcc__use_spin_symmetry", "autodir_options_c/psimrcc__wfn_sym", "autodir_options_c/psimrcc__zero_internal_amps", "autodir_options_c/sapt__aio_cphf", "autodir_options_c/sapt__aio_df_ints", "autodir_options_c/sapt__basis", "autodir_options_c/sapt__ccd_e_convergence", "autodir_options_c/sapt__ccd_maxiter", "autodir_options_c/sapt__ccd_t_convergence", "autodir_options_c/sapt__coupled_induction", "autodir_options_c/sapt__cphf_r_convergence", "autodir_options_c/sapt__denominator_algorithm", "autodir_options_c/sapt__denominator_delta", "autodir_options_c/sapt__df_basis_elst", "autodir_options_c/sapt__df_basis_sapt", "autodir_options_c/sapt__do_ccd_disp", "autodir_options_c/sapt__do_disp_exch_sinf", "autodir_options_c/sapt__do_ind30_exch_sinf", "autodir_options_c/sapt__do_ind_exch_sinf", "autodir_options_c/sapt__do_mbpt_disp", "autodir_options_c/sapt__do_third_order", "autodir_options_c/sapt__exch_scale_alpha", "autodir_options_c/sapt__freeze_core", "autodir_options_c/sapt__ints_tolerance", "autodir_options_c/sapt__max_ccd_diisvecs", "autodir_options_c/sapt__maxiter", "autodir_options_c/sapt__min_ccd_diisvecs", "autodir_options_c/sapt__nat_orbs_t2", "autodir_options_c/sapt__nat_orbs_t3", "autodir_options_c/sapt__nat_orbs_v4", "autodir_options_c/sapt__occ_tolerance", "autodir_options_c/sapt__print", "autodir_options_c/sapt__sapt0_e10", "autodir_options_c/sapt__sapt0_e20disp", "autodir_options_c/sapt__sapt0_e20ind", "autodir_options_c/sapt__sapt_dft_do_dhf", "autodir_options_c/sapt__sapt_dft_do_hybrid", "autodir_options_c/sapt__sapt_dft_exch_disp_fixed_scale", "autodir_options_c/sapt__sapt_dft_exch_disp_scale_scheme", "autodir_options_c/sapt__sapt_dft_functional", "autodir_options_c/sapt__sapt_dft_grac_determination", "autodir_options_c/sapt__sapt_dft_grac_shift_a", "autodir_options_c/sapt__sapt_dft_grac_shift_b", "autodir_options_c/sapt__sapt_dft_mp2_disp_alg", "autodir_options_c/sapt__sapt_fdds_disp_leg_lambda", "autodir_options_c/sapt__sapt_fdds_disp_num_points", "autodir_options_c/sapt__sapt_fdds_v2_rho_cutoff", "autodir_options_c/sapt__sapt_level", "autodir_options_c/sapt__sapt_mem_check", "autodir_options_c/sapt__sapt_mem_factor", "autodir_options_c/sapt__sapt_mem_safety", "autodir_options_c/sapt__sapt_quiet", "autodir_options_c/scf__basis", "autodir_options_c/scf__basis_guess", "autodir_options_c/scf__cholesky_tolerance", "autodir_options_c/scf__cosx_basis_tolerance", "autodir_options_c/scf__cosx_density_tolerance", "autodir_options_c/scf__cosx_ints_tolerance", "autodir_options_c/scf__cosx_maxiter_final", "autodir_options_c/scf__cosx_overlap_fitting", "autodir_options_c/scf__cosx_pruning_scheme", "autodir_options_c/scf__cosx_radial_points_final", "autodir_options_c/scf__cosx_radial_points_initial", "autodir_options_c/scf__cosx_spherical_points_final", "autodir_options_c/scf__cosx_spherical_points_initial", "autodir_options_c/scf__d_convergence", "autodir_options_c/scf__damping_convergence", "autodir_options_c/scf__damping_percentage", "autodir_options_c/scf__df_basis_guess", "autodir_options_c/scf__df_basis_sad", "autodir_options_c/scf__df_basis_scf", "autodir_options_c/scf__df_bump_r0", "autodir_options_c/scf__df_bump_r1", "autodir_options_c/scf__df_domains", "autodir_options_c/scf__df_fitting_condition", "autodir_options_c/scf__df_ints_io", "autodir_options_c/scf__df_ints_num_threads", "autodir_options_c/scf__df_metric", "autodir_options_c/scf__df_scf_guess", "autodir_options_c/scf__df_theta", "autodir_options_c/scf__dft_alpha", "autodir_options_c/scf__dft_alpha_c", "autodir_options_c/scf__dft_basis_tolerance", "autodir_options_c/scf__dft_block_max_points", "autodir_options_c/scf__dft_block_max_radius", "autodir_options_c/scf__dft_block_min_points", "autodir_options_c/scf__dft_block_scheme", "autodir_options_c/scf__dft_bs_radius_alpha", "autodir_options_c/scf__dft_density_tolerance", "autodir_options_c/scf__dft_dispersion_parameters", "autodir_options_c/scf__dft_grac_alpha", "autodir_options_c/scf__dft_grac_beta", "autodir_options_c/scf__dft_grac_c_func", "autodir_options_c/scf__dft_grac_shift", "autodir_options_c/scf__dft_grac_x_func", "autodir_options_c/scf__dft_grid_name", "autodir_options_c/scf__dft_nuclear_scheme", "autodir_options_c/scf__dft_omega", "autodir_options_c/scf__dft_omega_c", "autodir_options_c/scf__dft_pruning_alpha", "autodir_options_c/scf__dft_pruning_scheme", "autodir_options_c/scf__dft_radial_points", "autodir_options_c/scf__dft_radial_scheme", "autodir_options_c/scf__dft_remove_distant_points", "autodir_options_c/scf__dft_spherical_points", "autodir_options_c/scf__dft_spherical_scheme", "autodir_options_c/scf__dft_v2_rho_cutoff", "autodir_options_c/scf__dft_vv10_b", "autodir_options_c/scf__dft_vv10_c", "autodir_options_c/scf__dft_vv10_postscf", "autodir_options_c/scf__dft_vv10_radial_points", "autodir_options_c/scf__dft_vv10_rho_cutoff", "autodir_options_c/scf__dft_vv10_spherical_points", "autodir_options_c/scf__dft_weights_tolerance", "autodir_options_c/scf__diis", "autodir_options_c/scf__diis_max_vecs", "autodir_options_c/scf__diis_min_vecs", "autodir_options_c/scf__diis_rms_error", "autodir_options_c/scf__diis_start", "autodir_options_c/scf__distributed_matrix", "autodir_options_c/scf__e_convergence", "autodir_options_c/scf__extern", "autodir_options_c/scf__fail_on_maxiter", "autodir_options_c/scf__follow_step_increment", "autodir_options_c/scf__follow_step_scale", "autodir_options_c/scf__frac_diis", "autodir_options_c/scf__frac_load", "autodir_options_c/scf__frac_occ", "autodir_options_c/scf__frac_renormalize", "autodir_options_c/scf__frac_start", "autodir_options_c/scf__frac_val", "autodir_options_c/scf__guess", "autodir_options_c/scf__guess_mix", "autodir_options_c/scf__guess_persist", "autodir_options_c/scf__incfock", "autodir_options_c/scf__incfock_convergence", "autodir_options_c/scf__incfock_full_fock_every", "autodir_options_c/scf__ints_tolerance", "autodir_options_c/scf__level_shift", "autodir_options_c/scf__level_shift_cutoff", "autodir_options_c/scf__link_ints_tolerance", "autodir_options_c/scf__local_convergence", "autodir_options_c/scf__local_maxiter", "autodir_options_c/scf__max_attempts", "autodir_options_c/scf__max_mem_buf", "autodir_options_c/scf__maxiter", "autodir_options_c/scf__molden_write", "autodir_options_c/scf__mom_occ", "autodir_options_c/scf__mom_start", "autodir_options_c/scf__mom_vir", "autodir_options_c/scf__nl_dispersion_parameters", "autodir_options_c/scf__onepot_grid_read", "autodir_options_c/scf__orbitals_write", "autodir_options_c/scf__parallel", "autodir_options_c/scf__perturb_dipole", "autodir_options_c/scf__perturb_h", "autodir_options_c/scf__perturb_magnitude", "autodir_options_c/scf__perturb_with", "autodir_options_c/scf__phi_points", "autodir_options_c/scf__pk_all_nonsym", "autodir_options_c/scf__pk_max_buckets", "autodir_options_c/scf__print_basis", "autodir_options_c/scf__print_mos", "autodir_options_c/scf__process_grid", "autodir_options_c/scf__qchf", "autodir_options_c/scf__r_points", "autodir_options_c/scf__radius", "autodir_options_c/scf__reference", "autodir_options_c/scf__s_cholesky_tolerance", "autodir_options_c/scf__s_orthogonalization", "autodir_options_c/scf__s_tolerance", "autodir_options_c/scf__sad_chol_tolerance", "autodir_options_c/scf__sad_d_convergence", "autodir_options_c/scf__sad_e_convergence", "autodir_options_c/scf__sad_frac_occ", "autodir_options_c/scf__sad_maxiter", "autodir_options_c/scf__sad_print", "autodir_options_c/scf__sad_scf_type", "autodir_options_c/scf__sad_spin_average", "autodir_options_c/scf__sapgau_basis", "autodir_options_c/scf__sapt", "autodir_options_c/scf__save_jk", "autodir_options_c/scf__save_uhf_nos", "autodir_options_c/scf__scf_initial_accelerator", "autodir_options_c/scf__scf_initial_finish_diis_transition", "autodir_options_c/scf__scf_initial_start_diis_transition", "autodir_options_c/scf__scf_mem_safety_factor", "autodir_options_c/scf__scf_properties", "autodir_options_c/scf__scf_subtype", "autodir_options_c/scf__snlink_basis_tolerance", "autodir_options_c/scf__snlink_density_tolerance", "autodir_options_c/scf__snlink_force_cartesian", "autodir_options_c/scf__snlink_gpu_mem", "autodir_options_c/scf__snlink_grid_batch_size", "autodir_options_c/scf__snlink_integrator_kernel", "autodir_options_c/scf__snlink_ints_tolerance", "autodir_options_c/scf__snlink_load_balancer_kernel", "autodir_options_c/scf__snlink_lwd_kernel", "autodir_options_c/scf__snlink_mol_weights_kernel", "autodir_options_c/scf__snlink_pruning_scheme", "autodir_options_c/scf__snlink_radial_points", "autodir_options_c/scf__snlink_radial_scheme", "autodir_options_c/scf__snlink_reduction_kernel", "autodir_options_c/scf__snlink_spherical_points", "autodir_options_c/scf__snlink_use_debug_grid", "autodir_options_c/scf__snlink_use_gpu", "autodir_options_c/scf__solver_convergence", "autodir_options_c/scf__solver_maxiter", "autodir_options_c/scf__solver_n_guess", "autodir_options_c/scf__solver_n_root", "autodir_options_c/scf__solver_roots_per_irrep", "autodir_options_c/scf__soscf", "autodir_options_c/scf__soscf_conv", "autodir_options_c/scf__soscf_max_iter", "autodir_options_c/scf__soscf_min_iter", "autodir_options_c/scf__soscf_print", "autodir_options_c/scf__soscf_start_convergence", "autodir_options_c/scf__stability_analysis", "autodir_options_c/scf__tdscf_coeff_cutoff", "autodir_options_c/scf__tdscf_guess", "autodir_options_c/scf__tdscf_maxiter", "autodir_options_c/scf__tdscf_print", "autodir_options_c/scf__tdscf_r_convergence", "autodir_options_c/scf__tdscf_states", "autodir_options_c/scf__tdscf_tda", "autodir_options_c/scf__tdscf_tdm_print", "autodir_options_c/scf__tdscf_triplets", "autodir_options_c/scf__theta_points", "autodir_options_c/scf__thickness", "autodir_options_c/scf__tile_sz", "autodir_options_c/scf__uhf_noons", "autodir_options_c/scf__wcombine", "autodir_options_c/scf__wfn", "autodir_options_c/thermo__p", "autodir_options_c/thermo__rotational_symmetry_number", "autodir_options_c/thermo__t", "autodir_psivariables/module__adc", "autodir_psivariables/module__ccenergy", "autodir_psivariables/module__cfour", "autodir_psivariables/module__dct", "autodir_psivariables/module__ddx", "autodir_psivariables/module__detci", "autodir_psivariables/module__dfmp2", "autodir_psivariables/module__dfocc", "autodir_psivariables/module__dlpno", "autodir_psivariables/module__dmrg", "autodir_psivariables/module__efp", "autodir_psivariables/module__fisapt", "autodir_psivariables/module__fnocc", "autodir_psivariables/module__gdma", "autodir_psivariables/module__mcscf", "autodir_psivariables/module__mrcc", "autodir_psivariables/module__occ", "autodir_psivariables/module__oeprop", "autodir_psivariables/module__pcm", "autodir_psivariables/module__pe", "autodir_psivariables/module__psimrcc", "autodir_psivariables/module__sapt", "autodir_psivariables/module__scf", "autodir_psivariables/module__thermo", "autodoc_available_databases", "autodoc_available_efpfrag", "autodoc_basissets_byfamily", "autodoc_dft_all", "autodoc_dft_dhybrid", "autodoc_dft_disp", "autodoc_dft_energy", "autodoc_dft_gga", "autodoc_dft_hybrid", "autodoc_dft_lrc", "autodoc_dft_meta", "autodoc_dft_opt", "autodoc_glossary_options_c", "autodoc_options_c_bymodule", "autodoc_physconst", "autodoc_psi4bases", "autodoc_psifiles", "autodoc_psivariables_bymodule", "autodoc_testsuite_brianqc", "autodoc_testsuite_cfour", "autodoc_testsuite_chemps2", "autodoc_testsuite_cookbook", "autodoc_testsuite_corepsi4", "autodoc_testsuite_dftd3", "autodoc_testsuite_dftd4", "autodoc_testsuite_dkh", "autodoc_testsuite_gcp", "autodoc_testsuite_gdma", "autodoc_testsuite_gpu_dfcc", "autodoc_testsuite_json", "autodoc_testsuite_libefp", "autodoc_testsuite_mrcc", "autodoc_testsuite_pcmsolver", "autodoc_testsuite_psi4numpy", "autodoc_testsuite_python", "autodoc_testsuite_simint", "autodoc_testsuite_snsmp2", "autodoc_testsuite_v2rdm_casscf", "basissets", "basissets_byelement", "basissets_byfamily", "basissets_tables", "bibliography", "brianqc", "build_faq", "build_obtaining", "build_planning", "capabilities", "cbs", "cbs_eqn", "cc", "cfour", "cfour_table_energy", "cfour_table_grad", "chemps2", "code_style", "conda", "cppe", "cubeprop", "customizing", "db", "dct", "ddx", "detci", "dfmp2", "dft", "dft_byfunctional", "dftd3", "dftnl", "diatomic", "dkh", "dlpnomp2", "documentation", "ecpint", "energy", "external", "external_apis", "fchk", "fisapt", "fnocc", "freq", "gau2grid", "gcp", "gdma", "glossary_psivariables", "index", "index_tutorials", "intercalls", "interfacing", "introduction", "libefp", "libint", "libxc", "manage_addon", "manage_git", "manage_index", "manage_release", "mcscf", "methods", "molden", "mrcc", "mrcc_table_energy", "nbody", "notes_c", "notes_py", "numpy", "occ", "oeprop", "opt", "optionshandling", "optking", "pcmsolver", "pep0001", "plugin_psi4fockci", "plugin_snsmp2", "plugin_v2rdm_casscf", "plugins", "proc_py", "prog_blas", "prog_conduct", "prog_corelibs", "prog_debug_profile", "prog_faq", "prog_full_integration", "prog_help", "prog_integrals", "prog_intro", "prog_newcode", "prog_setup", "prog_style_c", "prog_style_py", "prog_tour", "prog_ways_to_add", "prog_welcome", "prop", "psi4api", "psiapi", "psimrcc", "psipep", "psithonfunc", "psithoninput", "psithonmol", "quickaddalias", "quickadddatabase", "relativistic", "sapt", "scf", "simint", "sowreap", "tdscf", "testsuite", "thermo", "tutorial"], "envversion": {"nbsphinx": 4, "sphinx": 62, "sphinx.domains.c": 3, "sphinx.domains.changeset": 1, "sphinx.domains.citation": 1, "sphinx.domains.cpp": 9, "sphinx.domains.index": 1, "sphinx.domains.javascript": 3, "sphinx.domains.math": 2, "sphinx.domains.python": 4, "sphinx.domains.rst": 2, "sphinx.domains.std": 2, "sphinx.ext.intersphinx": 1, "sphinx.ext.viewcode": 1}, "filenames": ["adc.rst", "adcc.rst", "add_tests.rst", "api/psi4.core.AOShellCombinationsIterator.rst", "api/psi4.core.AngularMomentumInt.rst", "api/psi4.core.BSVec.rst", "api/psi4.core.BasisExtents.rst", "api/psi4.core.BasisFunctions.rst", "api/psi4.core.BasisSet.rst", "api/psi4.core.BlockOPoints.rst", "api/psi4.core.BoysLocalizer.rst", "api/psi4.core.CCWavefunction.rst", "api/psi4.core.CIVector.rst", "api/psi4.core.CIWavefunction.rst", "api/psi4.core.CUHF.rst", "api/psi4.core.CdSalc.rst", "api/psi4.core.CdSalcList.rst", "api/psi4.core.CharacterTable.rst", "api/psi4.core.CompositeJK.rst", "api/psi4.core.CorrelationFactor.rst", "api/psi4.core.CorrelationTable.rst", "api/psi4.core.CubeProperties.rst", "api/psi4.core.DASUM.rst", "api/psi4.core.DAXPY.rst", "api/psi4.core.DCOPY.rst", "api/psi4.core.DDOT.rst", "api/psi4.core.DFEP2Wavefunction.rst", "api/psi4.core.DFHelper.rst", "api/psi4.core.DFSOMCSCF.rst", "api/psi4.core.DFTGrid.rst", "api/psi4.core.DFTensor.rst", "api/psi4.core.DGBMV.rst", "api/psi4.core.DGEEV.rst", "api/psi4.core.DGEMM.rst", "api/psi4.core.DGEMV.rst", "api/psi4.core.DGER.rst", "api/psi4.core.DGETRF.rst", "api/psi4.core.DGETRI.rst", "api/psi4.core.DGETRS.rst", "api/psi4.core.DNRM2.rst", "api/psi4.core.DPOTRF.rst", "api/psi4.core.DPOTRI.rst", "api/psi4.core.DPOTRS.rst", "api/psi4.core.DROT.rst", "api/psi4.core.DSBMV.rst", "api/psi4.core.DSCAL.rst", "api/psi4.core.DSWAP.rst", "api/psi4.core.DSYEV.rst", "api/psi4.core.DSYMM.rst", "api/psi4.core.DSYMV.rst", "api/psi4.core.DSYR.rst", "api/psi4.core.DSYR2.rst", "api/psi4.core.DSYR2K.rst", "api/psi4.core.DSYRK.rst", "api/psi4.core.DSYSV.rst", "api/psi4.core.DTBMV.rst", "api/psi4.core.DTBSV.rst", "api/psi4.core.DTRMM.rst", "api/psi4.core.DTRMV.rst", "api/psi4.core.DTRSM.rst", "api/psi4.core.DTRSV.rst", "api/psi4.core.Deriv.rst", "api/psi4.core.DerivCalcType.rst", "api/psi4.core.DiagonalizeOrder.rst", "api/psi4.core.Dimension.rst", "api/psi4.core.DipoleInt.rst", "api/psi4.core.DirectJK.rst", "api/psi4.core.DiskSOMCSCF.rst", "api/psi4.core.Dispersion.rst", "api/psi4.core.ERI.rst", "api/psi4.core.ESPPropCalc.rst", "api/psi4.core.ElectricFieldInt.rst", "api/psi4.core.ElectrostaticInt.rst", "api/psi4.core.ExternalPotential.rst", "api/psi4.core.FCHKWriter.rst", "api/psi4.core.FDDS_Dispersion.rst", "api/psi4.core.FISAPT.rst", "api/psi4.core.FittedSlaterCorrelationFactor.rst", "api/psi4.core.FittingMetric.rst", "api/psi4.core.FragmentType.rst", "api/psi4.core.Functional.rst", "api/psi4.core.GaussianShell.rst", "api/psi4.core.GaussianType.rst", "api/psi4.core.GeometryUnits.rst", "api/psi4.core.HF.rst", "api/psi4.core.IDAMAX.rst", "api/psi4.core.IO.rst", "api/psi4.core.IOManager.rst", "api/psi4.core.IntVector.rst", "api/psi4.core.IntegralFactory.rst", "api/psi4.core.IntegralTransform.rst", "api/psi4.core.IrreducibleRepresentation.rst", "api/psi4.core.JK.rst", "api/psi4.core.KineticInt.rst", "api/psi4.core.LS_THC_Computer.rst", "api/psi4.core.LaplaceDenominator.rst", "api/psi4.core.LibXCFunctional.rst", "api/psi4.core.Localizer.rst", "api/psi4.core.MOSpace.rst", "api/psi4.core.MOWriter.rst", "api/psi4.core.Matrix.rst", "api/psi4.core.MatrixFactory.rst", "api/psi4.core.MemDFJK.rst", "api/psi4.core.MintsHelper.rst", "api/psi4.core.MoldenWriter.rst", "api/psi4.core.MolecularGrid.rst", "api/psi4.core.Molecule.rst", "api/psi4.core.MultipoleInt.rst", "api/psi4.core.MultipoleSymmetry.rst", "api/psi4.core.NablaInt.rst", "api/psi4.core.NumIntHelper.rst", "api/psi4.core.OEProp.rst", "api/psi4.core.OneBodyAOInt.rst", "api/psi4.core.OneBodySOInt.rst", "api/psi4.core.Options.rst", "api/psi4.core.OrbitalSpace.rst", "api/psi4.core.OverlapInt.rst", "api/psi4.core.PMLocalizer.rst", "api/psi4.core.PetiteList.rst", "api/psi4.core.PointFunctions.rst", "api/psi4.core.PointGroup.rst", "api/psi4.core.PotentialInt.rst", "api/psi4.core.PrimitiveType.rst", "api/psi4.core.Prop.rst", "api/psi4.core.ProtoIntVector.rst", "api/psi4.core.ProtoVector.rst", "api/psi4.core.PsiReturnType.rst", "api/psi4.core.QuadrupoleInt.rst", "api/psi4.core.RHF.rst", "api/psi4.core.RKSFunctions.rst", "api/psi4.core.ROHF.rst", "api/psi4.core.SADGuess.rst", "api/psi4.core.SOBasisSet.rst", "api/psi4.core.SOMCSCF.rst", "api/psi4.core.SalcComponent.rst", "api/psi4.core.SaveType.rst", "api/psi4.core.ShellInfo.rst", "api/psi4.core.Slice.rst", "api/psi4.core.SuperFunctional.rst", "api/psi4.core.SymmetryOperation.rst", "api/psi4.core.TLaplaceDenominator.rst", "api/psi4.core.ThreeCenterOverlapInt.rst", "api/psi4.core.TracelessQuadrupoleInt.rst", "api/psi4.core.TwoBodyAOInt.rst", "api/psi4.core.TwoElectronInt.rst", "api/psi4.core.UHF.rst", "api/psi4.core.UKSFunctions.rst", "api/psi4.core.VBase.rst", "api/psi4.core.Vector.rst", "api/psi4.core.Vector3.rst", "api/psi4.core.Wavefunction.rst", "api/psi4.core.array_variable.rst", "api/psi4.core.array_variables.rst", "api/psi4.core.be_quiet.rst", "api/psi4.core.benchmark_blas1.rst", "api/psi4.core.benchmark_blas2.rst", "api/psi4.core.benchmark_blas3.rst", "api/psi4.core.benchmark_disk.rst", "api/psi4.core.benchmark_integrals.rst", "api/psi4.core.benchmark_math.rst", "api/psi4.core.ccdensity.rst", "api/psi4.core.ccenergy.rst", "api/psi4.core.cceom.rst", "api/psi4.core.cchbar.rst", "api/psi4.core.cclambda.rst", "api/psi4.core.ccresponse.rst", "api/psi4.core.cctransort.rst", "api/psi4.core.cctriples.rst", "api/psi4.core.clean.rst", "api/psi4.core.clean_options.rst", "api/psi4.core.clean_timers.rst", "api/psi4.core.clean_variables.rst", "api/psi4.core.close_outfile.rst", "api/psi4.core.dct.rst", "api/psi4.core.del_array_variable.rst", "api/psi4.core.del_scalar_variable.rst", "api/psi4.core.del_variable.rst", "api/psi4.core.detci.rst", "api/psi4.core.dfmp2.rst", "api/psi4.core.dfocc.rst", "api/psi4.core.dlpno.rst", "api/psi4.core.dmrg.rst", "api/psi4.core.doublet.rst", "api/psi4.core.dpdbuf4.rst", "api/psi4.core.dpdfile2.rst", "api/psi4.core.dummy_einsums.rst", "api/psi4.core.dummy_integratorxx.rst", "api/psi4.core.fcidump_tei_helper.rst", "api/psi4.core.finalize.rst", "api/psi4.core.flush_outfile.rst", "api/psi4.core.fnocc.rst", "api/psi4.core.get_active_molecule.rst", "api/psi4.core.get_array_variable.rst", "api/psi4.core.get_array_variables.rst", "api/psi4.core.get_datadir.rst", "api/psi4.core.get_global_option.rst", "api/psi4.core.get_global_option_list.rst", "api/psi4.core.get_local_option.rst", "api/psi4.core.get_memory.rst", "api/psi4.core.get_num_threads.rst", "api/psi4.core.get_option.rst", "api/psi4.core.get_options.rst", "api/psi4.core.get_output_file.rst", "api/psi4.core.get_variable.rst", "api/psi4.core.get_variables.rst", "api/psi4.core.get_writer_file_prefix.rst", "api/psi4.core.git_version.rst", "api/psi4.core.has_array_variable.rst", "api/psi4.core.has_global_option_changed.rst", "api/psi4.core.has_local_option_changed.rst", "api/psi4.core.has_option_changed.rst", "api/psi4.core.has_scalar_variable.rst", "api/psi4.core.has_variable.rst", "api/psi4.core.initialize.rst", "api/psi4.core.libint2_solid_harmonics_ordering.rst", "api/psi4.core.mcscf.rst", "api/psi4.core.mrcc_generate_input.rst", "api/psi4.core.mrcc_load_densities.rst", "api/psi4.core.occ.rst", "api/psi4.core.option_exists_in_module.rst", "api/psi4.core.options_to_python.rst", "api/psi4.core.outfile_name.rst", "api/psi4.core.plugin.rst", "api/psi4.core.plugin_close.rst", "api/psi4.core.plugin_close_all.rst", "api/psi4.core.plugin_load.rst", "api/psi4.core.prepare_options_for_module.rst", "api/psi4.core.print_global_options.rst", "api/psi4.core.print_options.rst", "api/psi4.core.print_out.rst", "api/psi4.core.print_variables.rst", "api/psi4.core.psi_top_srcdir.rst", "api/psi4.core.psimrcc.rst", "api/psi4.core.psio_entry.rst", "api/psi4.core.reopen_outfile.rst", "api/psi4.core.revoke_global_option_changed.rst", "api/psi4.core.revoke_local_option_changed.rst", "api/psi4.core.sapt.rst", "api/psi4.core.scalar_variable.rst", "api/psi4.core.scalar_variables.rst", "api/psi4.core.scatter.rst", "api/psi4.core.scfgrad.rst", "api/psi4.core.scfhess.rst", "api/psi4.core.set_active_molecule.rst", "api/psi4.core.set_array_variable.rst", "api/psi4.core.set_datadir.rst", "api/psi4.core.set_global_option.rst", "api/psi4.core.set_global_option_python.rst", "api/psi4.core.set_local_option.rst", "api/psi4.core.set_local_option_python.rst", "api/psi4.core.set_memory_bytes.rst", "api/psi4.core.set_num_threads.rst", "api/psi4.core.set_output_file.rst", "api/psi4.core.set_psi_file_prefix.rst", "api/psi4.core.set_scalar_variable.rst", "api/psi4.core.set_variable.rst", "api/psi4.core.test_matrix_dpd_interface.rst", "api/psi4.core.timer_off.rst", "api/psi4.core.timer_on.rst", "api/psi4.core.triplet.rst", "api/psi4.core.tstart.rst", "api/psi4.core.tstop.rst", "api/psi4.core.variable.rst", "api/psi4.core.variables.rst", "api/psi4.core.version.rst", "api/psi4.driver.AtomicComputer.rst", "api/psi4.driver.ConvergenceError.rst", "api/psi4.driver.EmpiricalDispersion.rst", "api/psi4.driver.ManagedMethodError.rst", "api/psi4.driver.MissingMethodError.rst", "api/psi4.driver.OptimizationConvergenceError.rst", "api/psi4.driver.ParsingError.rst", "api/psi4.driver.PastureRequiredError.rst", "api/psi4.driver.PsiException.rst", "api/psi4.driver.QMMM.rst", "api/psi4.driver.QMMMbohr.rst", "api/psi4.driver.SCFConvergenceError.rst", "api/psi4.driver.TDSCFConvergenceError.rst", "api/psi4.driver.TestComparisonError.rst", "api/psi4.driver.UpgradeHelper.rst", "api/psi4.driver.ValidationError.rst", "api/psi4.driver.activate.rst", "api/psi4.driver.banner.rst", "api/psi4.driver.basis_helper.rst", "api/psi4.driver.cbs.rst", "api/psi4.driver.compare_fchkfiles.rst", "api/psi4.driver.compare_fcidumps.rst", "api/psi4.driver.compare_moldenfiles.rst", "api/psi4.driver.copy_file_from_scratch.rst", "api/psi4.driver.copy_file_to_scratch.rst", "api/psi4.driver.create_plugin.rst", "api/psi4.driver.cubeprop.rst", "api/psi4.driver.docs_table_link.rst", "api/psi4.driver.dynamic_variable_bind.rst", "api/psi4.driver.energies_from_fcidump.rst", "api/psi4.driver.energy.rst", "api/psi4.driver.fchk.rst", "api/psi4.driver.fcidump.rst", "api/psi4.driver.fcidump_from_file.rst", "api/psi4.driver.find_approximate_string_matches.rst", "api/psi4.driver.freq.rst", "api/psi4.driver.frequencies.rst", "api/psi4.driver.frequency.rst", "api/psi4.driver.gdma.rst", "api/psi4.driver.geometry.rst", "api/psi4.driver.get_memory.rst", "api/psi4.driver.gradient.rst", "api/psi4.driver.hessian.rst", "api/psi4.driver.ipi_broker.rst", "api/psi4.driver.levenshtein.rst", "api/psi4.driver.libint2_configuration.rst", "api/psi4.driver.libint2_print_out.rst", "api/psi4.driver.mdi_run.rst", "api/psi4.driver.message_box.rst", "api/psi4.driver.molden.rst", "api/psi4.driver.molecule_get_attr.rst", "api/psi4.driver.molecule_set_attr.rst", "api/psi4.driver.oeprop.rst", "api/psi4.driver.opt.rst", "api/psi4.driver.optimize.rst", "api/psi4.driver.optimize_geometric.rst", "api/psi4.driver.p4util.DIIS.rst", "api/psi4.driver.p4util.Gaussian.rst", "api/psi4.driver.p4util.InPsight.rst", "api/psi4.driver.p4util.Lineshape.rst", "api/psi4.driver.p4util.Lorentzian.rst", "api/psi4.driver.p4util.OptionState.rst", "api/psi4.driver.p4util.OptionsState.rst", "api/psi4.driver.p4util.OptionsStateCM.rst", "api/psi4.driver.p4util.SolverEngine.rst", "api/psi4.driver.p4util.all_casings.rst", "api/psi4.driver.p4util.array_to_matrix.rst", "api/psi4.driver.p4util.banner.rst", "api/psi4.driver.p4util.basis_helper.rst", "api/psi4.driver.p4util.block_diagonal_array.rst", "api/psi4.driver.p4util.cg_solver.rst", "api/psi4.driver.p4util.compare_fchkfiles.rst", "api/psi4.driver.p4util.compare_fcidumps.rst", "api/psi4.driver.p4util.compare_moldenfiles.rst", "api/psi4.driver.p4util.copy_file_from_scratch.rst", "api/psi4.driver.p4util.copy_file_to_scratch.rst", "api/psi4.driver.p4util.cubeprop.rst", "api/psi4.driver.p4util.davidson_solver.rst", "api/psi4.driver.p4util.docs_table_link.rst", "api/psi4.driver.p4util.drop_duplicates.rst", "api/psi4.driver.p4util.energies_from_fcidump.rst", "api/psi4.driver.p4util.expand_psivars.rst", "api/psi4.driver.p4util.fcidump.rst", "api/psi4.driver.p4util.fcidump_from_file.rst", "api/psi4.driver.p4util.find_approximate_string_matches.rst", "api/psi4.driver.p4util.format_molecule_for_input.rst", "api/psi4.driver.p4util.format_options_for_input.rst", "api/psi4.driver.p4util.free_atom_volumes.rst", "api/psi4.driver.p4util.get_memory.rst", "api/psi4.driver.p4util.get_psifile.rst", "api/psi4.driver.p4util.getattr_ignorecase.rst", "api/psi4.driver.p4util.hamiltonian_solver.rst", "api/psi4.driver.p4util.hold_options_state.rst", "api/psi4.driver.p4util.import_ignorecase.rst", "api/psi4.driver.p4util.kwargs_lower.rst", "api/psi4.driver.p4util.levenshtein.rst", "api/psi4.driver.p4util.libint2_configuration.rst", "api/psi4.driver.p4util.libint2_print_out.rst", "api/psi4.driver.p4util.mat2arr.rst", "api/psi4.driver.p4util.message_box.rst", "api/psi4.driver.p4util.oeprop.rst", "api/psi4.driver.p4util.pcm_helper.rst", "api/psi4.driver.p4util.plump_qcvar.rst", "api/psi4.driver.p4util.prefactor_ecd.rst", "api/psi4.driver.p4util.prefactor_opa.rst", "api/psi4.driver.p4util.prepare_options_for_modules.rst", "api/psi4.driver.p4util.prepare_options_for_set_options.rst", "api/psi4.driver.p4util.provenance_stamp.rst", "api/psi4.driver.p4util.sanitize_method.rst", "api/psi4.driver.p4util.set_memory.rst", "api/psi4.driver.p4util.set_module_options.rst", "api/psi4.driver.p4util.set_options.rst", "api/psi4.driver.p4util.spectrum.rst", "api/psi4.driver.p4util.state_to_atomicinput.rst", "api/psi4.driver.pcm_helper.rst", "api/psi4.driver.process_input.rst", "api/psi4.driver.prop.rst", "api/psi4.driver.properties.rst", "api/psi4.driver.qcdb.vib.compare_vibinfos.rst", "api/psi4.driver.qcdb.vib.filter_nonvib.rst", "api/psi4.driver.qcdb.vib.filter_omega_to_real.rst", "api/psi4.driver.qcdb.vib.harmonic_analysis.rst", "api/psi4.driver.qcdb.vib.hessian_symmetrize.rst", "api/psi4.driver.qcdb.vib.print_molden_vibs.rst", "api/psi4.driver.qcdb.vib.print_vibs.rst", "api/psi4.driver.qcdb.vib.thermo.rst", "api/psi4.driver.sanitize_method.rst", "api/psi4.driver.sanitize_name.rst", "api/psi4.driver.scf_helper.rst", "api/psi4.driver.scf_wavefunction_factory.rst", "api/psi4.driver.set_memory.rst", "api/psi4.driver.set_module_options.rst", "api/psi4.driver.set_options.rst", "api/psi4.driver.tdscf.rst", "api/psi4.driver.vibanal_wfn.rst", "appendices.rst", "autodir_options_c/adc__cutoff_amps_print.rst", "autodir_options_c/adc__gauge.rst", "autodir_options_c/adc__kind.rst", "autodir_options_c/adc__max_num_vecs.rst", "autodir_options_c/adc__maxiter.rst", "autodir_options_c/adc__num_core_orbitals.rst", "autodir_options_c/adc__num_guesses.rst", "autodir_options_c/adc__r_convergence.rst", "autodir_options_c/adc__reference.rst", "autodir_options_c/adc__roots_per_irrep.rst", "autodir_options_c/ccdensity__ao_basis.rst", "autodir_options_c/ccdensity__cachelevel.rst", "autodir_options_c/ccdensity__debug.rst", "autodir_options_c/ccdensity__gauge.rst", "autodir_options_c/ccdensity__ints_tolerance.rst", "autodir_options_c/ccdensity__opdm_only.rst", "autodir_options_c/ccdensity__opdm_relax.rst", "autodir_options_c/ccdensity__prop_all.rst", "autodir_options_c/ccdensity__prop_root.rst", "autodir_options_c/ccdensity__prop_sym.rst", "autodir_options_c/ccdensity__reference.rst", "autodir_options_c/ccdensity__roots_per_irrep.rst", "autodir_options_c/ccdensity__wfn.rst", "autodir_options_c/ccdensity__write_nos.rst", "autodir_options_c/ccdensity__xi.rst", "autodir_options_c/ccdensity__xi_connect.rst", "autodir_options_c/ccdensity__zeta.rst", "autodir_options_c/ccenergy__abcd.rst", "autodir_options_c/ccenergy__analyze.rst", "autodir_options_c/ccenergy__ao_basis.rst", "autodir_options_c/ccenergy__bccd_maxiter.rst", "autodir_options_c/ccenergy__brueckner_orbs_r_convergence.rst", "autodir_options_c/ccenergy__cachelevel.rst", "autodir_options_c/ccenergy__cachetype.rst", "autodir_options_c/ccenergy__cc_num_threads.rst", "autodir_options_c/ccenergy__cc_os_scale.rst", "autodir_options_c/ccenergy__cc_ss_scale.rst", "autodir_options_c/ccenergy__diis.rst", "autodir_options_c/ccenergy__e_convergence.rst", "autodir_options_c/ccenergy__force_restart.rst", "autodir_options_c/ccenergy__local.rst", "autodir_options_c/ccenergy__local_cphf_cutoff.rst", "autodir_options_c/ccenergy__local_cutoff.rst", "autodir_options_c/ccenergy__local_method.rst", "autodir_options_c/ccenergy__local_pairdef.rst", "autodir_options_c/ccenergy__local_weakp.rst", "autodir_options_c/ccenergy__maxiter.rst", "autodir_options_c/ccenergy__mp2_amps_print.rst", "autodir_options_c/ccenergy__mp2_os_scale.rst", "autodir_options_c/ccenergy__mp2_ss_scale.rst", "autodir_options_c/ccenergy__new_triples.rst", "autodir_options_c/ccenergy__num_amps_print.rst", "autodir_options_c/ccenergy__pair_energies_print.rst", "autodir_options_c/ccenergy__property.rst", "autodir_options_c/ccenergy__r_convergence.rst", "autodir_options_c/ccenergy__reference.rst", "autodir_options_c/ccenergy__restart.rst", "autodir_options_c/ccenergy__scs_ccsd.rst", "autodir_options_c/ccenergy__scs_mp2.rst", "autodir_options_c/ccenergy__scsn_mp2.rst", "autodir_options_c/ccenergy__semicanonical.rst", "autodir_options_c/ccenergy__t2_coupled.rst", "autodir_options_c/ccenergy__t3_ws_incore.rst", "autodir_options_c/ccenergy__wfn.rst", "autodir_options_c/cceom__abcd.rst", "autodir_options_c/cceom__cachelevel.rst", "autodir_options_c/cceom__cachetype.rst", "autodir_options_c/cceom__cc3_follow_root.rst", "autodir_options_c/cceom__cc_num_threads.rst", "autodir_options_c/cceom__collapse_with_last.rst", "autodir_options_c/cceom__collapse_with_last_cc3.rst", "autodir_options_c/cceom__complex_tolerance.rst", "autodir_options_c/cceom__e_convergence.rst", "autodir_options_c/cceom__eom_guess.rst", "autodir_options_c/cceom__eom_reference.rst", "autodir_options_c/cceom__excitation_range.rst", "autodir_options_c/cceom__full_matrix.rst", "autodir_options_c/cceom__local.rst", "autodir_options_c/cceom__local_cutoff.rst", "autodir_options_c/cceom__local_do_singles.rst", "autodir_options_c/cceom__local_filter_singles.rst", "autodir_options_c/cceom__local_method.rst", "autodir_options_c/cceom__local_preconditioner.rst", "autodir_options_c/cceom__local_weakp.rst", "autodir_options_c/cceom__maxiter.rst", "autodir_options_c/cceom__new_triples.rst", "autodir_options_c/cceom__num_amps_print.rst", "autodir_options_c/cceom__overlap_check.rst", "autodir_options_c/cceom__prop_root.rst", "autodir_options_c/cceom__prop_sym.rst", "autodir_options_c/cceom__r_convergence.rst", "autodir_options_c/cceom__reference.rst", "autodir_options_c/cceom__restart_eom_cc3.rst", "autodir_options_c/cceom__rhf_triplets.rst", "autodir_options_c/cceom__roots_per_irrep.rst", "autodir_options_c/cceom__schmidt_add_residual_tolerance.rst", "autodir_options_c/cceom__semicanonical.rst", "autodir_options_c/cceom__singles_print.rst", "autodir_options_c/cceom__ss_e_convergence.rst", "autodir_options_c/cceom__ss_r_convergence.rst", "autodir_options_c/cceom__ss_skip_diag.rst", "autodir_options_c/cceom__ss_vecs_per_root.rst", "autodir_options_c/cceom__t3_ws_incore.rst", "autodir_options_c/cceom__vecs_cc3.rst", "autodir_options_c/cceom__vecs_per_root.rst", "autodir_options_c/cceom__wfn.rst", "autodir_options_c/cchbar__cachelevel.rst", "autodir_options_c/cchbar__eom_reference.rst", "autodir_options_c/cchbar__t_amps.rst", "autodir_options_c/cchbar__wabei_lowdisk.rst", "autodir_options_c/cchbar__wfn.rst", "autodir_options_c/cclambda__abcd.rst", "autodir_options_c/cclambda__ao_basis.rst", "autodir_options_c/cclambda__cachelevel.rst", "autodir_options_c/cclambda__diis.rst", "autodir_options_c/cclambda__jobtype.rst", "autodir_options_c/cclambda__local.rst", "autodir_options_c/cclambda__local_cphf_cutoff.rst", "autodir_options_c/cclambda__local_cutoff.rst", "autodir_options_c/cclambda__local_filter_singles.rst", "autodir_options_c/cclambda__local_method.rst", "autodir_options_c/cclambda__local_pairdef.rst", "autodir_options_c/cclambda__local_weakp.rst", "autodir_options_c/cclambda__maxiter.rst", "autodir_options_c/cclambda__num_amps_print.rst", "autodir_options_c/cclambda__prop_all.rst", "autodir_options_c/cclambda__prop_root.rst", "autodir_options_c/cclambda__prop_sym.rst", "autodir_options_c/cclambda__r_convergence.rst", "autodir_options_c/cclambda__restart.rst", "autodir_options_c/cclambda__roots_per_irrep.rst", "autodir_options_c/cclambda__sekino.rst", "autodir_options_c/cclambda__wfn.rst", "autodir_options_c/cclambda__zeta.rst", "autodir_options_c/ccresponse__abcd.rst", "autodir_options_c/ccresponse__analyze.rst", "autodir_options_c/ccresponse__cachelevel.rst", "autodir_options_c/ccresponse__diis.rst", "autodir_options_c/ccresponse__gauge.rst", "autodir_options_c/ccresponse__linear.rst", "autodir_options_c/ccresponse__local.rst", "autodir_options_c/ccresponse__local_cphf_cutoff.rst", "autodir_options_c/ccresponse__local_cutoff.rst", "autodir_options_c/ccresponse__local_filter_singles.rst", "autodir_options_c/ccresponse__local_method.rst", "autodir_options_c/ccresponse__local_pairdef.rst", "autodir_options_c/ccresponse__local_weakp.rst", "autodir_options_c/ccresponse__maxiter.rst", "autodir_options_c/ccresponse__num_amps_print.rst", "autodir_options_c/ccresponse__omega.rst", "autodir_options_c/ccresponse__property.rst", "autodir_options_c/ccresponse__r_convergence.rst", "autodir_options_c/ccresponse__reference.rst", "autodir_options_c/ccresponse__restart.rst", "autodir_options_c/ccresponse__sekino.rst", "autodir_options_c/ccresponse__wfn.rst", "autodir_options_c/cctransort__ao_basis.rst", "autodir_options_c/cctransort__cachelevel.rst", "autodir_options_c/cctransort__delete_tei.rst", "autodir_options_c/cctransort__reference.rst", "autodir_options_c/cctransort__run_cctransort.rst", "autodir_options_c/cctransort__semicanonical.rst", "autodir_options_c/cctransort__wfn.rst", "autodir_options_c/cctriples__cc_num_threads.rst", "autodir_options_c/cctriples__reference.rst", "autodir_options_c/cctriples__semicanonical.rst", "autodir_options_c/cctriples__wfn.rst", "autodir_options_c/cfour__cfour_abcdtype.rst", "autodir_options_c/cfour__cfour_active_orbi.rst", "autodir_options_c/cfour__cfour_anh_algorithm.rst", "autodir_options_c/cfour__cfour_anh_derivatives.rst", "autodir_options_c/cfour__cfour_anh_stepsize.rst", "autodir_options_c/cfour__cfour_anh_symmetry.rst", "autodir_options_c/cfour__cfour_anharmonic.rst", "autodir_options_c/cfour__cfour_ao_ladders.rst", "autodir_options_c/cfour__cfour_av_scf.rst", "autodir_options_c/cfour__cfour_basis.rst", "autodir_options_c/cfour__cfour_bruck_conv.rst", "autodir_options_c/cfour__cfour_brueckner.rst", "autodir_options_c/cfour__cfour_cache_recs.rst", "autodir_options_c/cfour__cfour_calc_level.rst", "autodir_options_c/cfour__cfour_cc_conv.rst", "autodir_options_c/cfour__cfour_cc_exporder.rst", "autodir_options_c/cfour__cfour_cc_extrapolation.rst", "autodir_options_c/cfour__cfour_cc_maxcyc.rst", "autodir_options_c/cfour__cfour_cc_program.rst", "autodir_options_c/cfour__cfour_charge.rst", "autodir_options_c/cfour__cfour_cis_conv.rst", "autodir_options_c/cfour__cfour_continuum.rst", "autodir_options_c/cfour__cfour_contraction.rst", "autodir_options_c/cfour__cfour_convergence.rst", "autodir_options_c/cfour__cfour_coordinates.rst", "autodir_options_c/cfour__cfour_core_orbitals.rst", "autodir_options_c/cfour__cfour_cphf_conver.rst", "autodir_options_c/cfour__cfour_cphf_maxcyc.rst", "autodir_options_c/cfour__cfour_curvilinear.rst", "autodir_options_c/cfour__cfour_dboc.rst", "autodir_options_c/cfour__cfour_dct.rst", "autodir_options_c/cfour__cfour_deriv_level.rst", "autodir_options_c/cfour__cfour_diff_type.rst", "autodir_options_c/cfour__cfour_dropmo.rst", "autodir_options_c/cfour__cfour_ecp.rst", "autodir_options_c/cfour__cfour_eigenvector.rst", "autodir_options_c/cfour__cfour_el_anharm.rst", "autodir_options_c/cfour__cfour_eom_nonit.rst", "autodir_options_c/cfour__cfour_estate_conv.rst", "autodir_options_c/cfour__cfour_estate_maxcyc.rst", "autodir_options_c/cfour__cfour_estate_prop.rst", "autodir_options_c/cfour__cfour_estate_sym.rst", "autodir_options_c/cfour__cfour_estate_trans.rst", "autodir_options_c/cfour__cfour_eval_hess.rst", "autodir_options_c/cfour__cfour_excitation.rst", "autodir_options_c/cfour__cfour_excite.rst", "autodir_options_c/cfour__cfour_fc_field.rst", "autodir_options_c/cfour__cfour_fd_calctype.rst", "autodir_options_c/cfour__cfour_fd_irreps.rst", "autodir_options_c/cfour__cfour_fd_project.rst", "autodir_options_c/cfour__cfour_fd_stepsize.rst", "autodir_options_c/cfour__cfour_fd_usegroup.rst", "autodir_options_c/cfour__cfour_file_recsiz.rst", "autodir_options_c/cfour__cfour_file_stripe.rst", "autodir_options_c/cfour__cfour_finite_perturbation.rst", "autodir_options_c/cfour__cfour_fock.rst", "autodir_options_c/cfour__cfour_freq_algorithm.rst", "autodir_options_c/cfour__cfour_frozen_core.rst", "autodir_options_c/cfour__cfour_frozen_virt.rst", "autodir_options_c/cfour__cfour_gamma_abcd.rst", "autodir_options_c/cfour__cfour_genbas_1.rst", "autodir_options_c/cfour__cfour_genbas_2.rst", "autodir_options_c/cfour__cfour_genbas_3.rst", "autodir_options_c/cfour__cfour_genbas_4.rst", "autodir_options_c/cfour__cfour_geo_conv.rst", "autodir_options_c/cfour__cfour_geo_maxcyc.rst", "autodir_options_c/cfour__cfour_geo_maxstep.rst", "autodir_options_c/cfour__cfour_geo_method.rst", "autodir_options_c/cfour__cfour_giao.rst", "autodir_options_c/cfour__cfour_grid.rst", "autodir_options_c/cfour__cfour_guess.rst", "autodir_options_c/cfour__cfour_hbar.rst", "autodir_options_c/cfour__cfour_hfstability.rst", "autodir_options_c/cfour__cfour_incore.rst", "autodir_options_c/cfour__cfour_input_mrcc.rst", "autodir_options_c/cfour__cfour_integrals.rst", "autodir_options_c/cfour__cfour_joda_print.rst", "autodir_options_c/cfour__cfour_lineq_conv.rst", "autodir_options_c/cfour__cfour_lineq_maxcy.rst", "autodir_options_c/cfour__cfour_lineq_type.rst", "autodir_options_c/cfour__cfour_lock_orbocc.rst", "autodir_options_c/cfour__cfour_maxstep.rst", "autodir_options_c/cfour__cfour_mem_unit.rst", "autodir_options_c/cfour__cfour_memory_size.rst", "autodir_options_c/cfour__cfour_method.rst", "autodir_options_c/cfour__cfour_mrcc.rst", "autodir_options_c/cfour__cfour_multiplicity.rst", "autodir_options_c/cfour__cfour_nacoupling.rst", "autodir_options_c/cfour__cfour_negeval.rst", "autodir_options_c/cfour__cfour_newnorm.rst", "autodir_options_c/cfour__cfour_nonhf.rst", "autodir_options_c/cfour__cfour_ntop_tamp.rst", "autodir_options_c/cfour__cfour_occupation.rst", "autodir_options_c/cfour__cfour_omp_num_threads.rst", "autodir_options_c/cfour__cfour_open-shell.rst", "autodir_options_c/cfour__cfour_opt_maxcyc.rst", "autodir_options_c/cfour__cfour_orbitals.rst", "autodir_options_c/cfour__cfour_pert_orb.rst", "autodir_options_c/cfour__cfour_points.rst", "autodir_options_c/cfour__cfour_print.rst", "autodir_options_c/cfour__cfour_prop_integral.rst", "autodir_options_c/cfour__cfour_props.rst", "autodir_options_c/cfour__cfour_qrhf_general.rst", "autodir_options_c/cfour__cfour_qrhf_orbital.rst", "autodir_options_c/cfour__cfour_qrhfgues.rst", "autodir_options_c/cfour__cfour_raman_int.rst", "autodir_options_c/cfour__cfour_raman_orb.rst", "autodir_options_c/cfour__cfour_rdo.rst", "autodir_options_c/cfour__cfour_reference.rst", "autodir_options_c/cfour__cfour_relativistic.rst", "autodir_options_c/cfour__cfour_relax_dens.rst", "autodir_options_c/cfour__cfour_res_raman.rst", "autodir_options_c/cfour__cfour_restart_cc.rst", "autodir_options_c/cfour__cfour_rot_evec.rst", "autodir_options_c/cfour__cfour_save_ints.rst", "autodir_options_c/cfour__cfour_scale_on.rst", "autodir_options_c/cfour__cfour_scf_conv.rst", "autodir_options_c/cfour__cfour_scf_damping.rst", "autodir_options_c/cfour__cfour_scf_exporder.rst", "autodir_options_c/cfour__cfour_scf_expstart.rst", "autodir_options_c/cfour__cfour_scf_extrapolation.rst", "autodir_options_c/cfour__cfour_scf_maxcyc.rst", "autodir_options_c/cfour__cfour_sd_field.rst", "autodir_options_c/cfour__cfour_spherical.rst", "autodir_options_c/cfour__cfour_spin_flip.rst", "autodir_options_c/cfour__cfour_spin_orbit.rst", "autodir_options_c/cfour__cfour_spin_scal.rst", "autodir_options_c/cfour__cfour_spinrotation.rst", "autodir_options_c/cfour__cfour_subgroup.rst", "autodir_options_c/cfour__cfour_sym_check.rst", "autodir_options_c/cfour__cfour_symmetry.rst", "autodir_options_c/cfour__cfour_t3_extrapol.rst", "autodir_options_c/cfour__cfour_tamp_sum.rst", "autodir_options_c/cfour__cfour_thermochemistry.rst", "autodir_options_c/cfour__cfour_trans_inv.rst", "autodir_options_c/cfour__cfour_treat_pert.rst", "autodir_options_c/cfour__cfour_uij_threshold.rst", "autodir_options_c/cfour__cfour_units.rst", "autodir_options_c/cfour__cfour_update_hessian.rst", "autodir_options_c/cfour__cfour_vibration.rst", "autodir_options_c/cfour__cfour_vtran.rst", "autodir_options_c/cfour__cfour_xfield.rst", "autodir_options_c/cfour__cfour_xform_tol.rst", "autodir_options_c/cfour__cfour_yfield.rst", "autodir_options_c/cfour__cfour_zfield.rst", "autodir_options_c/cfour__translate_psi4.rst", "autodir_options_c/cphf__cphf_mem_safety_factor.rst", "autodir_options_c/cphf__cphf_tasks.rst", "autodir_options_c/cphf__debug.rst", "autodir_options_c/cphf__df_basis_scf.rst", "autodir_options_c/cphf__explicit_hamiltonian.rst", "autodir_options_c/cphf__module.rst", "autodir_options_c/cphf__print.rst", "autodir_options_c/cphf__scf_type.rst", "autodir_options_c/cphf__solver_convergence.rst", "autodir_options_c/cphf__solver_maxiter.rst", "autodir_options_c/cphf__solver_n_guess.rst", "autodir_options_c/cphf__solver_precondition.rst", "autodir_options_c/dct__algorithm.rst", "autodir_options_c/dct__ao_basis.rst", "autodir_options_c/dct__cachelevel.rst", "autodir_options_c/dct__damping_percentage.rst", "autodir_options_c/dct__dct_functional.rst", "autodir_options_c/dct__dct_guess.rst", "autodir_options_c/dct__dct_type.rst", "autodir_options_c/dct__df_basis_dct.rst", "autodir_options_c/dct__diis_max_vecs.rst", "autodir_options_c/dct__diis_min_vecs.rst", "autodir_options_c/dct__diis_start_convergence.rst", "autodir_options_c/dct__e_convergence.rst", "autodir_options_c/dct__energy_level_shift.rst", "autodir_options_c/dct__guess_r_convergence.rst", "autodir_options_c/dct__ints_tolerance.rst", "autodir_options_c/dct__maxiter.rst", "autodir_options_c/dct__odc_guess.rst", "autodir_options_c/dct__opdm.rst", "autodir_options_c/dct__orbital_level_shift.rst", "autodir_options_c/dct__qc_coupling.rst", "autodir_options_c/dct__qc_type.rst", "autodir_options_c/dct__r_convergence.rst", "autodir_options_c/dct__reference.rst", "autodir_options_c/dct__relax_guess_orbitals.rst", "autodir_options_c/dct__response_algorithm.rst", "autodir_options_c/dct__stability_add_vectors.rst", "autodir_options_c/dct__stability_augment_space_tol.rst", "autodir_options_c/dct__stability_check.rst", "autodir_options_c/dct__stability_convergence.rst", "autodir_options_c/dct__stability_max_space_size.rst", "autodir_options_c/dct__stability_n_eigenvalues.rst", "autodir_options_c/dct__stability_n_guess_vectors.rst", "autodir_options_c/dct__three_particle.rst", "autodir_options_c/dct__tikhonow_omega.rst", "autodir_options_c/ddx__ddx_diis_max_vecs.rst", "autodir_options_c/ddx__ddx_eta.rst", "autodir_options_c/ddx__ddx_fmm.rst", "autodir_options_c/ddx__ddx_fmm_local_lmax.rst", "autodir_options_c/ddx__ddx_fmm_multipole_lmax.rst", "autodir_options_c/ddx__ddx_incore.rst", "autodir_options_c/ddx__ddx_lmax.rst", "autodir_options_c/ddx__ddx_logfile.rst", "autodir_options_c/ddx__ddx_maxiter.rst", "autodir_options_c/ddx__ddx_model.rst", "autodir_options_c/ddx__ddx_n_lebedev.rst", "autodir_options_c/ddx__ddx_radii.rst", "autodir_options_c/ddx__ddx_radii_scaling.rst", "autodir_options_c/ddx__ddx_radii_set.rst", "autodir_options_c/ddx__ddx_shift.rst", "autodir_options_c/ddx__ddx_solute_radial_points.rst", "autodir_options_c/ddx__ddx_solute_spherical_points.rst", "autodir_options_c/ddx__ddx_solvation_convergence.rst", "autodir_options_c/ddx__ddx_solvent.rst", "autodir_options_c/ddx__ddx_solvent_epsilon.rst", "autodir_options_c/ddx__ddx_solvent_epsilon_optical.rst", "autodir_options_c/ddx__ddx_solvent_kappa.rst", "autodir_options_c/detci__a_ras3_max.rst", "autodir_options_c/detci__avg_states.rst", "autodir_options_c/detci__avg_weights.rst", "autodir_options_c/detci__b_ras3_max.rst", "autodir_options_c/detci__bendazzoli.rst", "autodir_options_c/detci__calc_s_squared.rst", "autodir_options_c/detci__cc.rst", "autodir_options_c/detci__cc_a_ras3_max.rst", "autodir_options_c/detci__cc_b_ras3_max.rst", "autodir_options_c/detci__cc_ex_level.rst", "autodir_options_c/detci__cc_fix_external.rst", "autodir_options_c/detci__cc_fix_external_min.rst", "autodir_options_c/detci__cc_macro.rst", "autodir_options_c/detci__cc_mixed.rst", "autodir_options_c/detci__cc_ras34_max.rst", "autodir_options_c/detci__cc_ras3_max.rst", "autodir_options_c/detci__cc_ras4_max.rst", "autodir_options_c/detci__cc_update_eps.rst", "autodir_options_c/detci__cc_val_ex_level.rst", "autodir_options_c/detci__cc_variational.rst", "autodir_options_c/detci__cc_vecs_read.rst", "autodir_options_c/detci__cc_vecs_write.rst", "autodir_options_c/detci__ci_file_start.rst", "autodir_options_c/detci__ci_maxiter.rst", "autodir_options_c/detci__ci_num_threads.rst", "autodir_options_c/detci__ciblks_print.rst", "autodir_options_c/detci__collapse_size.rst", "autodir_options_c/detci__detci_freeze_core.rst", "autodir_options_c/detci__df_basis_mcscf.rst", "autodir_options_c/detci__diag_method.rst", "autodir_options_c/detci__diis.rst", "autodir_options_c/detci__diis_freq.rst", "autodir_options_c/detci__diis_max_vecs.rst", "autodir_options_c/detci__diis_min_vecs.rst", "autodir_options_c/detci__diis_start_iter.rst", "autodir_options_c/detci__dipmom.rst", "autodir_options_c/detci__e_convergence.rst", "autodir_options_c/detci__ex_allow.rst", "autodir_options_c/detci__ex_level.rst", "autodir_options_c/detci__fci.rst", "autodir_options_c/detci__fci_strings.rst", "autodir_options_c/detci__filter_guess.rst", "autodir_options_c/detci__filter_guess_det1.rst", "autodir_options_c/detci__filter_guess_det2.rst", "autodir_options_c/detci__filter_guess_sign.rst", "autodir_options_c/detci__filter_zero_det.rst", "autodir_options_c/detci__follow_root.rst", "autodir_options_c/detci__follow_vector.rst", "autodir_options_c/detci__guess_vector.rst", "autodir_options_c/detci__h0_block_coupling.rst", "autodir_options_c/detci__h0_block_coupling_size.rst", "autodir_options_c/detci__h0_blocksize.rst", "autodir_options_c/detci__h0_guess_size.rst", "autodir_options_c/detci__hd_avg.rst", "autodir_options_c/detci__hd_otf.rst", "autodir_options_c/detci__icore.rst", "autodir_options_c/detci__istop.rst", "autodir_options_c/detci__lse.rst", "autodir_options_c/detci__lse_collapse.rst", "autodir_options_c/detci__lse_tolerance.rst", "autodir_options_c/detci__max_num_vecs.rst", "autodir_options_c/detci__mcscf_algorithm.rst", "autodir_options_c/detci__mcscf_ci_cleanup.rst", "autodir_options_c/detci__mcscf_diis_error_type.rst", "autodir_options_c/detci__mcscf_diis_freq.rst", "autodir_options_c/detci__mcscf_diis_max_vecs.rst", "autodir_options_c/detci__mcscf_diis_start.rst", "autodir_options_c/detci__mcscf_dpd_cleanup.rst", "autodir_options_c/detci__mcscf_e_convergence.rst", "autodir_options_c/detci__mcscf_guess.rst", "autodir_options_c/detci__mcscf_max_rot.rst", "autodir_options_c/detci__mcscf_maxiter.rst", "autodir_options_c/detci__mcscf_r_convergence.rst", "autodir_options_c/detci__mcscf_rotate.rst", "autodir_options_c/detci__mcscf_so_start_e.rst", "autodir_options_c/detci__mcscf_so_start_grad.rst", "autodir_options_c/detci__mcscf_type.rst", "autodir_options_c/detci__mixed.rst", "autodir_options_c/detci__mixed4.rst", "autodir_options_c/detci__mpn.rst", "autodir_options_c/detci__mpn_order_save.rst", "autodir_options_c/detci__mpn_schmidt.rst", "autodir_options_c/detci__mpn_wigner.rst", "autodir_options_c/detci__ms0.rst", "autodir_options_c/detci__nat_orbs.rst", "autodir_options_c/detci__no_dfile.rst", "autodir_options_c/detci__num_amps_print.rst", "autodir_options_c/detci__num_dets_print.rst", "autodir_options_c/detci__num_init_vecs.rst", "autodir_options_c/detci__num_roots.rst", "autodir_options_c/detci__opdm.rst", "autodir_options_c/detci__perturb_magnitude.rst", "autodir_options_c/detci__preconditioner.rst", "autodir_options_c/detci__r4s.rst", "autodir_options_c/detci__r_convergence.rst", "autodir_options_c/detci__ras34_max.rst", "autodir_options_c/detci__ras3_max.rst", "autodir_options_c/detci__ras4_max.rst", "autodir_options_c/detci__reference.rst", "autodir_options_c/detci__reference_sym.rst", "autodir_options_c/detci__repl_otf.rst", "autodir_options_c/detci__restart.rst", "autodir_options_c/detci__s.rst", "autodir_options_c/detci__sf_restrict.rst", "autodir_options_c/detci__sigma_overlap.rst", "autodir_options_c/detci__tdm.rst", "autodir_options_c/detci__tpdm.rst", "autodir_options_c/detci__update.rst", "autodir_options_c/detci__val_ex_level.rst", "autodir_options_c/detci__wfn.rst", "autodir_options_c/dfep2__df_basis_ep2.rst", "autodir_options_c/dfep2__ep2_convergence.rst", "autodir_options_c/dfep2__ep2_maxiter.rst", "autodir_options_c/dfep2__ep2_num_ea.rst", "autodir_options_c/dfep2__ep2_num_ip.rst", "autodir_options_c/dfep2__ep2_orbitals.rst", "autodir_options_c/dfmp2__basis.rst", "autodir_options_c/dfmp2__df_basis_mp2.rst", "autodir_options_c/dfmp2__df_ints_io.rst", "autodir_options_c/dfmp2__df_ints_num_threads.rst", "autodir_options_c/dfmp2__dfmp2_mem_factor.rst", "autodir_options_c/dfmp2__dfmp2_p2_tolerance.rst", "autodir_options_c/dfmp2__dfmp2_p_tolerance.rst", "autodir_options_c/dfmp2__ints_tolerance.rst", "autodir_options_c/dfmp2__madmp2_sleep.rst", "autodir_options_c/dfmp2__mp2_os_scale.rst", "autodir_options_c/dfmp2__mp2_ss_scale.rst", "autodir_options_c/dfmp2__onepdm.rst", "autodir_options_c/dfmp2__opdm_relax.rst", "autodir_options_c/dfocc__cc_diis_max_vecs.rst", "autodir_options_c/dfocc__cc_diis_min_vecs.rst", "autodir_options_c/dfocc__cc_lambda.rst", "autodir_options_c/dfocc__cc_maxiter.rst", "autodir_options_c/dfocc__cholesky.rst", "autodir_options_c/dfocc__cholesky_tolerance.rst", "autodir_options_c/dfocc__comput_s2.rst", "autodir_options_c/dfocc__cutoff.rst", "autodir_options_c/dfocc__do_diis.rst", "autodir_options_c/dfocc__do_level_shift.rst", "autodir_options_c/dfocc__do_scs.rst", "autodir_options_c/dfocc__do_sos.rst", "autodir_options_c/dfocc__e3_scale.rst", "autodir_options_c/dfocc__e_convergence.rst", "autodir_options_c/dfocc__ekt_ip.rst", "autodir_options_c/dfocc__hess_type.rst", "autodir_options_c/dfocc__integral_cutoff.rst", "autodir_options_c/dfocc__level_shift.rst", "autodir_options_c/dfocc__lineq_solver.rst", "autodir_options_c/dfocc__max_mograd_convergence.rst", "autodir_options_c/dfocc__mo_diis_num_vecs.rst", "autodir_options_c/dfocc__mo_maxiter.rst", "autodir_options_c/dfocc__mo_step_max.rst", "autodir_options_c/dfocc__molden_write.rst", "autodir_options_c/dfocc__mp2_amp_type.rst", "autodir_options_c/dfocc__mp2_os_scale.rst", "autodir_options_c/dfocc__mp2_sos_scale.rst", "autodir_options_c/dfocc__mp2_sos_scale2.rst", "autodir_options_c/dfocc__mp2_ss_scale.rst", "autodir_options_c/dfocc__nat_orbs.rst", "autodir_options_c/dfocc__occ_orbs_print.rst", "autodir_options_c/dfocc__oeprop.rst", "autodir_options_c/dfocc__oo_scale.rst", "autodir_options_c/dfocc__opt_method.rst", "autodir_options_c/dfocc__orb_opt.rst", "autodir_options_c/dfocc__orb_resp_solver.rst", "autodir_options_c/dfocc__orth_type.rst", "autodir_options_c/dfocc__pcg_beta_type.rst", "autodir_options_c/dfocc__pcg_convergence.rst", "autodir_options_c/dfocc__pcg_maxiter.rst", "autodir_options_c/dfocc__ppl_type.rst", "autodir_options_c/dfocc__qchf.rst", "autodir_options_c/dfocc__r_convergence.rst", "autodir_options_c/dfocc__read_scf_3index.rst", "autodir_options_c/dfocc__reg_param.rst", "autodir_options_c/dfocc__regularization.rst", "autodir_options_c/dfocc__remp_a.rst", "autodir_options_c/dfocc__rms_mograd_convergence.rst", "autodir_options_c/dfocc__scs_type.rst", "autodir_options_c/dfocc__sos_type.rst", "autodir_options_c/dfocc__triples_iabc_type.rst", "autodir_options_c/dfocc__wfn_type.rst", "autodir_options_c/dlpno__df_basis_mp2.rst", "autodir_options_c/dlpno__dlpno_algorithm.rst", "autodir_options_c/dlpno__dlpno_local_orbitals.rst", "autodir_options_c/dlpno__dlpno_maxiter.rst", "autodir_options_c/dlpno__doi_basis_tolerance.rst", "autodir_options_c/dlpno__doi_pruning_scheme.rst", "autodir_options_c/dlpno__doi_radial_points.rst", "autodir_options_c/dlpno__doi_spherical_points.rst", "autodir_options_c/dlpno__e_convergence.rst", "autodir_options_c/dlpno__f_cut.rst", "autodir_options_c/dlpno__local_convergence.rst", "autodir_options_c/dlpno__local_maxiter.rst", "autodir_options_c/dlpno__pno_convergence.rst", "autodir_options_c/dlpno__r_convergence.rst", "autodir_options_c/dlpno__s_cut.rst", "autodir_options_c/dlpno__t_cut_clmo.rst", "autodir_options_c/dlpno__t_cut_cpao.rst", "autodir_options_c/dlpno__t_cut_do.rst", "autodir_options_c/dlpno__t_cut_do_ij.rst", "autodir_options_c/dlpno__t_cut_do_pre.rst", "autodir_options_c/dlpno__t_cut_mkn.rst", "autodir_options_c/dlpno__t_cut_pno.rst", "autodir_options_c/dlpno__t_cut_pre.rst", "autodir_options_c/dmrg__dmrg_caspt2_calc.rst", "autodir_options_c/dmrg__dmrg_caspt2_imag.rst", "autodir_options_c/dmrg__dmrg_caspt2_ipea.rst", "autodir_options_c/dmrg__dmrg_caspt2_orbs.rst", "autodir_options_c/dmrg__dmrg_diis.rst", "autodir_options_c/dmrg__dmrg_diis_write.rst", "autodir_options_c/dmrg__dmrg_excitation.rst", "autodir_options_c/dmrg__dmrg_irrep.rst", "autodir_options_c/dmrg__dmrg_local_init.rst", "autodir_options_c/dmrg__dmrg_molden_write.rst", "autodir_options_c/dmrg__dmrg_mps_write.rst", "autodir_options_c/dmrg__dmrg_multiplicity.rst", "autodir_options_c/dmrg__dmrg_opdm_ao_print.rst", "autodir_options_c/dmrg__dmrg_print_corr.rst", "autodir_options_c/dmrg__dmrg_scf_active_space.rst", "autodir_options_c/dmrg__dmrg_scf_diis_thr.rst", "autodir_options_c/dmrg__dmrg_scf_grad_thr.rst", "autodir_options_c/dmrg__dmrg_scf_max_iter.rst", "autodir_options_c/dmrg__dmrg_scf_state_avg.rst", "autodir_options_c/dmrg__dmrg_sweep_dvdson_rtol.rst", "autodir_options_c/dmrg__dmrg_sweep_energy_conv.rst", "autodir_options_c/dmrg__dmrg_sweep_max_sweeps.rst", "autodir_options_c/dmrg__dmrg_sweep_noise_prefac.rst", "autodir_options_c/dmrg__dmrg_sweep_states.rst", "autodir_options_c/dmrg__dmrg_unitary_write.rst", "autodir_options_c/efp__dertype.rst", "autodir_options_c/efp__efp_disp.rst", "autodir_options_c/efp__efp_disp_damping.rst", "autodir_options_c/efp__efp_elst.rst", "autodir_options_c/efp__efp_elst_damping.rst", "autodir_options_c/efp__efp_exch.rst", "autodir_options_c/efp__efp_ind.rst", "autodir_options_c/efp__efp_ind_damping.rst", "autodir_options_c/efp__efp_qm_elst.rst", "autodir_options_c/efp__efp_qm_ind.rst", "autodir_options_c/efp__print.rst", "autodir_options_c/efp__qmefp.rst", "autodir_options_c/findif__disp_size.rst", "autodir_options_c/findif__fd_project.rst", "autodir_options_c/findif__gradient_write.rst", "autodir_options_c/findif__hessian_write.rst", "autodir_options_c/findif__normal_modes_write.rst", "autodir_options_c/findif__points.rst", "autodir_options_c/fisapt__cphf_r_convergence.rst", "autodir_options_c/fisapt__cubic_basis_tolerance.rst", "autodir_options_c/fisapt__cubic_block_max_points.rst", "autodir_options_c/fisapt__cubic_grid_overage.rst", "autodir_options_c/fisapt__cubic_grid_spacing.rst", "autodir_options_c/fisapt__fisapt_charge_completeness.rst", "autodir_options_c/fisapt__fisapt_cube_densmat.rst", "autodir_options_c/fisapt__fisapt_cube_linkibos.rst", "autodir_options_c/fisapt__fisapt_cube_linkihos.rst", "autodir_options_c/fisapt__fisapt_do_fsapt.rst", "autodir_options_c/fisapt__fisapt_do_fsapt_disp.rst", "autodir_options_c/fisapt__fisapt_do_plot.rst", "autodir_options_c/fisapt__fisapt_exch_parperp.rst", "autodir_options_c/fisapt__fisapt_fsapt_exch_scale.rst", "autodir_options_c/fisapt__fisapt_fsapt_filepath.rst", "autodir_options_c/fisapt__fisapt_fsapt_ind_response.rst", "autodir_options_c/fisapt__fisapt_fsapt_ind_scale.rst", "autodir_options_c/fisapt__fisapt_fssapt_filepath.rst", "autodir_options_c/fisapt__fisapt_link_assignment.rst", "autodir_options_c/fisapt__fisapt_link_ortho.rst", "autodir_options_c/fisapt__fisapt_link_selection.rst", "autodir_options_c/fisapt__fisapt_manual_links.rst", "autodir_options_c/fisapt__fisapt_mem_safety_factor.rst", "autodir_options_c/fisapt__fisapt_plot_filepath.rst", "autodir_options_c/fisapt__ints_tolerance.rst", "autodir_options_c/fisapt__local_convergence.rst", "autodir_options_c/fisapt__local_ibo_condition.rst", "autodir_options_c/fisapt__local_ibo_power.rst", "autodir_options_c/fisapt__local_ibo_stars.rst", "autodir_options_c/fisapt__local_ibo_stars_completeness.rst", "autodir_options_c/fisapt__local_ibo_use_stars.rst", "autodir_options_c/fisapt__local_maxiter.rst", "autodir_options_c/fisapt__local_use_ghosts.rst", "autodir_options_c/fisapt__maxiter.rst", "autodir_options_c/fisapt__minao_basis.rst", "autodir_options_c/fisapt__ssapt0_scale.rst", "autodir_options_c/fnocc__active_nat_orbs.rst", "autodir_options_c/fnocc__brueckner_maxiter.rst", "autodir_options_c/fnocc__cc_scale_os.rst", "autodir_options_c/fnocc__cc_scale_ss.rst", "autodir_options_c/fnocc__cc_timings.rst", "autodir_options_c/fnocc__cepa_level.rst", "autodir_options_c/fnocc__cepa_no_singles.rst", "autodir_options_c/fnocc__cholesky_tolerance.rst", "autodir_options_c/fnocc__compute_mp4_triples.rst", "autodir_options_c/fnocc__compute_triples.rst", "autodir_options_c/fnocc__df_basis_cc.rst", "autodir_options_c/fnocc__dfcc.rst", "autodir_options_c/fnocc__diis_max_vecs.rst", "autodir_options_c/fnocc__dipmom.rst", "autodir_options_c/fnocc__e_convergence.rst", "autodir_options_c/fnocc__maxiter.rst", "autodir_options_c/fnocc__mp2_scale_os.rst", "autodir_options_c/fnocc__mp2_scale_ss.rst", "autodir_options_c/fnocc__nat_orbs.rst", "autodir_options_c/fnocc__occ_percentage.rst", "autodir_options_c/fnocc__occ_tolerance.rst", "autodir_options_c/fnocc__r_convergence.rst", "autodir_options_c/fnocc__run_ccsd.rst", "autodir_options_c/fnocc__run_cepa.rst", "autodir_options_c/fnocc__run_mp2.rst", "autodir_options_c/fnocc__run_mp3.rst", "autodir_options_c/fnocc__run_mp4.rst", "autodir_options_c/fnocc__scs_ccsd.rst", "autodir_options_c/fnocc__scs_cepa.rst", "autodir_options_c/fnocc__scs_mp2.rst", "autodir_options_c/fnocc__triples_low_memory.rst", "autodir_options_c/fnocc__use_df_ints.rst", "autodir_options_c/gdma__gdma_limit.rst", "autodir_options_c/gdma__gdma_multipole_units.rst", "autodir_options_c/gdma__gdma_origin.rst", "autodir_options_c/gdma__gdma_radius.rst", "autodir_options_c/gdma__gdma_switch.rst", "autodir_options_c/globals__active.rst", "autodir_options_c/globals__basis_relativistic.rst", "autodir_options_c/globals__bench.rst", "autodir_options_c/globals__brianqc_enable.rst", "autodir_options_c/globals__cc_type.rst", "autodir_options_c/globals__ci_type.rst", "autodir_options_c/globals__cubeprop_basis_functions.rst", "autodir_options_c/globals__cubeprop_filepath.rst", "autodir_options_c/globals__cubeprop_isocontour_threshold.rst", "autodir_options_c/globals__cubeprop_orbitals.rst", "autodir_options_c/globals__cubeprop_tasks.rst", "autodir_options_c/globals__cubic_basis_tolerance.rst", "autodir_options_c/globals__cubic_block_max_points.rst", "autodir_options_c/globals__cubic_grid_overage.rst", "autodir_options_c/globals__cubic_grid_spacing.rst", "autodir_options_c/globals__ddx.rst", "autodir_options_c/globals__debug.rst", "autodir_options_c/globals__dertype.rst", "autodir_options_c/globals__df_basis_cc.rst", "autodir_options_c/globals__die_if_not_converged.rst", "autodir_options_c/globals__dkh_order.rst", "autodir_options_c/globals__docc.rst", "autodir_options_c/globals__external_potential_symmetry.rst", "autodir_options_c/globals__freeze_core.rst", "autodir_options_c/globals__freeze_core_policy.rst", "autodir_options_c/globals__frozen_docc.rst", "autodir_options_c/globals__frozen_uocc.rst", "autodir_options_c/globals__integral_package.rst", "autodir_options_c/globals__literal_cfour.rst", "autodir_options_c/globals__ls_thc_basis_tolerance.rst", "autodir_options_c/globals__ls_thc_df.rst", "autodir_options_c/globals__ls_thc_pruning_scheme.rst", "autodir_options_c/globals__ls_thc_radial_points.rst", "autodir_options_c/globals__ls_thc_s_epsilon.rst", "autodir_options_c/globals__ls_thc_spherical_points.rst", "autodir_options_c/globals__ls_thc_weights_tolerance.rst", "autodir_options_c/globals__mat_num_column_print.rst", "autodir_options_c/globals__max_radial_moment.rst", "autodir_options_c/globals__mbis_d_convergence.rst", "autodir_options_c/globals__mbis_maxiter.rst", "autodir_options_c/globals__mbis_pruning_scheme.rst", "autodir_options_c/globals__mbis_radial_points.rst", "autodir_options_c/globals__mbis_spherical_points.rst", "autodir_options_c/globals__molden_with_virtual.rst", "autodir_options_c/globals__mp2_type.rst", "autodir_options_c/globals__mp_type.rst", "autodir_options_c/globals__num_frozen_docc.rst", "autodir_options_c/globals__num_frozen_uocc.rst", "autodir_options_c/globals__parent_symmetry.rst", "autodir_options_c/globals__pcm.rst", "autodir_options_c/globals__pe.rst", "autodir_options_c/globals__print.rst", "autodir_options_c/globals__print_noons.rst", "autodir_options_c/globals__properties.rst", "autodir_options_c/globals__properties_origin.rst", "autodir_options_c/globals__puream.rst", "autodir_options_c/globals__qc_module.rst", "autodir_options_c/globals__ras1.rst", "autodir_options_c/globals__ras2.rst", "autodir_options_c/globals__ras3.rst", "autodir_options_c/globals__ras4.rst", "autodir_options_c/globals__relativistic.rst", "autodir_options_c/globals__restricted_docc.rst", "autodir_options_c/globals__restricted_uocc.rst", "autodir_options_c/globals__scf_type.rst", "autodir_options_c/globals__screening.rst", "autodir_options_c/globals__socc.rst", "autodir_options_c/globals__wfn.rst", "autodir_options_c/globals__writer_file_label.rst", "autodir_options_c/mcscf__canonicalize_active_favg.rst", "autodir_options_c/mcscf__canonicalize_inactive_favg.rst", "autodir_options_c/mcscf__ci_diis.rst", "autodir_options_c/mcscf__d_convergence.rst", "autodir_options_c/mcscf__diis.rst", "autodir_options_c/mcscf__diis_max_vecs.rst", "autodir_options_c/mcscf__docc.rst", "autodir_options_c/mcscf__e_convergence.rst", "autodir_options_c/mcscf__favg.rst", "autodir_options_c/mcscf__favg_start.rst", "autodir_options_c/mcscf__follow_root.rst", "autodir_options_c/mcscf__force_twocon.rst", "autodir_options_c/mcscf__internal_rotations.rst", "autodir_options_c/mcscf__level_shift.rst", "autodir_options_c/mcscf__maxiter.rst", "autodir_options_c/mcscf__mo_read.rst", "autodir_options_c/mcscf__reference.rst", "autodir_options_c/mcscf__rotate_mo_angle.rst", "autodir_options_c/mcscf__rotate_mo_irrep.rst", "autodir_options_c/mcscf__rotate_mo_p.rst", "autodir_options_c/mcscf__rotate_mo_q.rst", "autodir_options_c/mcscf__socc.rst", "autodir_options_c/mcscf__turn_on_actv.rst", "autodir_options_c/mcscf__wfn_sym.rst", "autodir_options_c/mints__basis.rst", "autodir_options_c/mints__omega_erf.rst", "autodir_options_c/module__adc.rst", "autodir_options_c/module__ccdensity.rst", "autodir_options_c/module__ccenergy.rst", "autodir_options_c/module__cceom.rst", "autodir_options_c/module__cchbar.rst", "autodir_options_c/module__cclambda.rst", "autodir_options_c/module__ccresponse.rst", "autodir_options_c/module__cctransort.rst", "autodir_options_c/module__cctriples.rst", "autodir_options_c/module__cfour.rst", "autodir_options_c/module__cphf.rst", "autodir_options_c/module__dct.rst", "autodir_options_c/module__ddx.rst", "autodir_options_c/module__detci.rst", "autodir_options_c/module__dfep2.rst", "autodir_options_c/module__dfmp2.rst", "autodir_options_c/module__dfocc.rst", "autodir_options_c/module__dlpno.rst", "autodir_options_c/module__dmrg.rst", "autodir_options_c/module__efp.rst", "autodir_options_c/module__findif.rst", "autodir_options_c/module__fisapt.rst", "autodir_options_c/module__fnocc.rst", "autodir_options_c/module__gdma.rst", "autodir_options_c/module__globals.rst", "autodir_options_c/module__mcscf.rst", "autodir_options_c/module__mints.rst", "autodir_options_c/module__mrcc.rst", "autodir_options_c/module__occ.rst", "autodir_options_c/module__optking.rst", "autodir_options_c/module__pcm.rst", "autodir_options_c/module__pe.rst", "autodir_options_c/module__psimrcc.rst", "autodir_options_c/module__sapt.rst", "autodir_options_c/module__scf.rst", "autodir_options_c/module__thermo.rst", "autodir_options_c/mrcc__e_convergence.rst", "autodir_options_c/mrcc__ints_tolerance.rst", "autodir_options_c/mrcc__mrcc_level.rst", "autodir_options_c/mrcc__mrcc_method.rst", "autodir_options_c/mrcc__mrcc_num_doublet_roots.rst", "autodir_options_c/mrcc__mrcc_num_singlet_roots.rst", "autodir_options_c/mrcc__mrcc_num_triplet_roots.rst", "autodir_options_c/mrcc__mrcc_omp_num_threads.rst", "autodir_options_c/mrcc__mrcc_restart.rst", "autodir_options_c/occ__cachelevel.rst", "autodir_options_c/occ__cc_maxiter.rst", "autodir_options_c/occ__ccl_energy.rst", "autodir_options_c/occ__cepa_os_scale.rst", "autodir_options_c/occ__cepa_sos_scale.rst", "autodir_options_c/occ__cepa_ss_scale.rst", "autodir_options_c/occ__cepa_type.rst", "autodir_options_c/occ__cutoff.rst", "autodir_options_c/occ__diis_max_vecs.rst", "autodir_options_c/occ__diis_min_vecs.rst", "autodir_options_c/occ__do_diis.rst", "autodir_options_c/occ__do_level_shift.rst", "autodir_options_c/occ__do_scs.rst", "autodir_options_c/occ__do_sos.rst", "autodir_options_c/occ__e3_scale.rst", "autodir_options_c/occ__e_convergence.rst", "autodir_options_c/occ__ea_poles.rst", "autodir_options_c/occ__ekt_ea.rst", "autodir_options_c/occ__ekt_ip.rst", "autodir_options_c/occ__ep_ea_poles.rst", "autodir_options_c/occ__ep_ip_poles.rst", "autodir_options_c/occ__ep_maxiter.rst", "autodir_options_c/occ__ip_poles.rst", "autodir_options_c/occ__level_shift.rst", "autodir_options_c/occ__max_mograd_convergence.rst", "autodir_options_c/occ__mo_maxiter.rst", "autodir_options_c/occ__mo_read.rst", "autodir_options_c/occ__mo_step_max.rst", "autodir_options_c/occ__mo_write.rst", "autodir_options_c/occ__mograd_damping.rst", "autodir_options_c/occ__mp2_os_scale.rst", "autodir_options_c/occ__mp2_sos_scale.rst", "autodir_options_c/occ__mp2_sos_scale2.rst", "autodir_options_c/occ__mp2_ss_scale.rst", "autodir_options_c/occ__nat_orbs.rst", "autodir_options_c/occ__occ_orbs_print.rst", "autodir_options_c/occ__oeprop.rst", "autodir_options_c/occ__opt_method.rst", "autodir_options_c/occ__orb_opt.rst", "autodir_options_c/occ__orb_resp_solver.rst", "autodir_options_c/occ__orth_type.rst", "autodir_options_c/occ__os_scale.rst", "autodir_options_c/occ__pcg_beta_type.rst", "autodir_options_c/occ__pcg_convergence.rst", "autodir_options_c/occ__pcg_maxiter.rst", "autodir_options_c/occ__r_convergence.rst", "autodir_options_c/occ__relaxed.rst", "autodir_options_c/occ__remp_a.rst", "autodir_options_c/occ__rms_mograd_convergence.rst", "autodir_options_c/occ__scs_type.rst", "autodir_options_c/occ__sos_type.rst", "autodir_options_c/occ__spin_scale_type.rst", "autodir_options_c/occ__ss_scale.rst", "autodir_options_c/occ__symmetrize.rst", "autodir_options_c/occ__tpdm_abcd_type.rst", "autodir_options_c/occ__wfn_type.rst", "autodir_options_c/optking__add_auxiliary_bonds.rst", "autodir_options_c/optking__auxiliary_bond_factor.rst", "autodir_options_c/optking__cart_hess_read.rst", "autodir_options_c/optking__cartesian_sym_tolerance.rst", "autodir_options_c/optking__consecutive_backsteps.rst", "autodir_options_c/optking__covalent_connect.rst", "autodir_options_c/optking__custom_coords.rst", "autodir_options_c/optking__dynamic_level.rst", "autodir_options_c/optking__ensure_bt_convergence.rst", "autodir_options_c/optking__ext_force_bend.rst", "autodir_options_c/optking__ext_force_cartesian.rst", "autodir_options_c/optking__ext_force_dihedral.rst", "autodir_options_c/optking__ext_force_distance.rst", "autodir_options_c/optking__ext_force_oofp.rst", "autodir_options_c/optking__flexible_g_convergence.rst", "autodir_options_c/optking__frag_mode.rst", "autodir_options_c/optking__frag_ref_atoms.rst", "autodir_options_c/optking__freeze_all_dihedrals.rst", "autodir_options_c/optking__freeze_interfrag.rst", "autodir_options_c/optking__freeze_intrafrag.rst", "autodir_options_c/optking__frozen_bend.rst", "autodir_options_c/optking__frozen_cartesian.rst", "autodir_options_c/optking__frozen_dihedral.rst", "autodir_options_c/optking__frozen_distance.rst", "autodir_options_c/optking__frozen_oofp.rst", "autodir_options_c/optking__full_hess_every.rst", "autodir_options_c/optking__g_convergence.rst", "autodir_options_c/optking__geom_maxiter.rst", "autodir_options_c/optking__h_bond_connect.rst", "autodir_options_c/optking__h_guess_every.rst", "autodir_options_c/optking__h_update_den_tol.rst", "autodir_options_c/optking__hess_update.rst", "autodir_options_c/optking__hess_update_limit.rst", "autodir_options_c/optking__hess_update_limit_max.rst", "autodir_options_c/optking__hess_update_limit_scale.rst", "autodir_options_c/optking__hess_update_use_last.rst", "autodir_options_c/optking__intcos_generate_exit.rst", "autodir_options_c/optking__interfrag_collinear_tol.rst", "autodir_options_c/optking__interfrag_coords.rst", "autodir_options_c/optking__interfrag_dist_inv.rst", "autodir_options_c/optking__interfrag_hess.rst", "autodir_options_c/optking__interfrag_mode.rst", "autodir_options_c/optking__interfrag_step_limit.rst", "autodir_options_c/optking__interfragment_connect.rst", "autodir_options_c/optking__intrafrag_hess.rst", "autodir_options_c/optking__intrafrag_step_limit.rst", "autodir_options_c/optking__intrafrag_step_limit_max.rst", "autodir_options_c/optking__intrafrag_step_limit_min.rst", "autodir_options_c/optking__irc_direction.rst", "autodir_options_c/optking__irc_points.rst", "autodir_options_c/optking__irc_step_size.rst", "autodir_options_c/optking__max_disp_g_convergence.rst", "autodir_options_c/optking__max_energy_g_convergence.rst", "autodir_options_c/optking__max_force_g_convergence.rst", "autodir_options_c/optking__opt_coordinates.rst", "autodir_options_c/optking__opt_restart.rst", "autodir_options_c/optking__opt_type.rst", "autodir_options_c/optking__print_opt_params.rst", "autodir_options_c/optking__print_trajectory_xyz_file.rst", "autodir_options_c/optking__ranged_bend.rst", "autodir_options_c/optking__ranged_dihedral.rst", "autodir_options_c/optking__ranged_distance.rst", "autodir_options_c/optking__ranged_oofp.rst", "autodir_options_c/optking__rfo_follow_root.rst", "autodir_options_c/optking__rfo_normalization_max.rst", "autodir_options_c/optking__rfo_root.rst", "autodir_options_c/optking__rms_disp_g_convergence.rst", "autodir_options_c/optking__rms_force_g_convergence.rst", "autodir_options_c/optking__rsrfo_alpha_max.rst", "autodir_options_c/optking__save_optimization.rst", "autodir_options_c/optking__step_type.rst", "autodir_options_c/optking__test_b.rst", "autodir_options_c/optking__test_derivative_b.rst", "autodir_options_c/optking__unfreeze_dihedrals.rst", "autodir_options_c/optking__write_opt_history.rst", "autodir_options_c/optking__write_opt_result.rst", "autodir_options_c/optking__write_trajectory.rst", "autodir_options_c/pcm__pcm_cc_type.rst", "autodir_options_c/pcm__pcm_scf_type.rst", "autodir_options_c/pcm__pcmsolver_parsed_fname.rst", "autodir_options_c/pe__border.rst", "autodir_options_c/pe__border_n_redist.rst", "autodir_options_c/pe__border_redist_order.rst", "autodir_options_c/pe__border_redist_pol.rst", "autodir_options_c/pe__border_rmin.rst", "autodir_options_c/pe__border_rmin_unit.rst", "autodir_options_c/pe__border_type.rst", "autodir_options_c/pe__damp_induced.rst", "autodir_options_c/pe__damp_multipole.rst", "autodir_options_c/pe__damping_factor_induced.rst", "autodir_options_c/pe__damping_factor_multipole.rst", "autodir_options_c/pe__induced_convergence.rst", "autodir_options_c/pe__isotropic_pol.rst", "autodir_options_c/pe__maxiter.rst", "autodir_options_c/pe__pe_ecp.rst", "autodir_options_c/pe__potfile.rst", "autodir_options_c/pe__summation_fields.rst", "autodir_options_c/pe__tree_expansion_order.rst", "autodir_options_c/pe__tree_theta.rst", "autodir_options_c/psimrcc__cc_num_threads.rst", "autodir_options_c/psimrcc__corr_ansatz.rst", "autodir_options_c/psimrcc__corr_ccsd_t.rst", "autodir_options_c/psimrcc__corr_charge.rst", "autodir_options_c/psimrcc__corr_multp.rst", "autodir_options_c/psimrcc__corr_wfn.rst", "autodir_options_c/psimrcc__coupling.rst", "autodir_options_c/psimrcc__coupling_terms.rst", "autodir_options_c/psimrcc__damping_percentage.rst", "autodir_options_c/psimrcc__diagonal_ccsd_t.rst", "autodir_options_c/psimrcc__diagonalize_heff.rst", "autodir_options_c/psimrcc__diis_max_vecs.rst", "autodir_options_c/psimrcc__diis_start.rst", "autodir_options_c/psimrcc__e_convergence.rst", "autodir_options_c/psimrcc__favg_ccsd_t.rst", "autodir_options_c/psimrcc__follow_root.rst", "autodir_options_c/psimrcc__heff4.rst", "autodir_options_c/psimrcc__heff_print.rst", "autodir_options_c/psimrcc__lock_singlet.rst", "autodir_options_c/psimrcc__maxiter.rst", "autodir_options_c/psimrcc__mp2_ccsd_method.rst", "autodir_options_c/psimrcc__mp2_guess.rst", "autodir_options_c/psimrcc__no_singles.rst", "autodir_options_c/psimrcc__offdiagonal_ccsd_t.rst", "autodir_options_c/psimrcc__perturb_cbs.rst", "autodir_options_c/psimrcc__perturb_cbs_coupling.rst", "autodir_options_c/psimrcc__pt_energy.rst", "autodir_options_c/psimrcc__r_convergence.rst", "autodir_options_c/psimrcc__small_cutoff.rst", "autodir_options_c/psimrcc__tikhonow_max.rst", "autodir_options_c/psimrcc__tikhonow_omega.rst", "autodir_options_c/psimrcc__tikhonow_triples.rst", "autodir_options_c/psimrcc__triples_algorithm.rst", "autodir_options_c/psimrcc__triples_diis.rst", "autodir_options_c/psimrcc__use_spin_sym.rst", "autodir_options_c/psimrcc__use_spin_symmetry.rst", "autodir_options_c/psimrcc__wfn_sym.rst", "autodir_options_c/psimrcc__zero_internal_amps.rst", "autodir_options_c/sapt__aio_cphf.rst", "autodir_options_c/sapt__aio_df_ints.rst", "autodir_options_c/sapt__basis.rst", "autodir_options_c/sapt__ccd_e_convergence.rst", "autodir_options_c/sapt__ccd_maxiter.rst", "autodir_options_c/sapt__ccd_t_convergence.rst", "autodir_options_c/sapt__coupled_induction.rst", "autodir_options_c/sapt__cphf_r_convergence.rst", "autodir_options_c/sapt__denominator_algorithm.rst", "autodir_options_c/sapt__denominator_delta.rst", "autodir_options_c/sapt__df_basis_elst.rst", "autodir_options_c/sapt__df_basis_sapt.rst", "autodir_options_c/sapt__do_ccd_disp.rst", "autodir_options_c/sapt__do_disp_exch_sinf.rst", "autodir_options_c/sapt__do_ind30_exch_sinf.rst", "autodir_options_c/sapt__do_ind_exch_sinf.rst", "autodir_options_c/sapt__do_mbpt_disp.rst", "autodir_options_c/sapt__do_third_order.rst", "autodir_options_c/sapt__exch_scale_alpha.rst", "autodir_options_c/sapt__freeze_core.rst", "autodir_options_c/sapt__ints_tolerance.rst", "autodir_options_c/sapt__max_ccd_diisvecs.rst", "autodir_options_c/sapt__maxiter.rst", "autodir_options_c/sapt__min_ccd_diisvecs.rst", "autodir_options_c/sapt__nat_orbs_t2.rst", "autodir_options_c/sapt__nat_orbs_t3.rst", "autodir_options_c/sapt__nat_orbs_v4.rst", "autodir_options_c/sapt__occ_tolerance.rst", "autodir_options_c/sapt__print.rst", "autodir_options_c/sapt__sapt0_e10.rst", "autodir_options_c/sapt__sapt0_e20disp.rst", "autodir_options_c/sapt__sapt0_e20ind.rst", "autodir_options_c/sapt__sapt_dft_do_dhf.rst", "autodir_options_c/sapt__sapt_dft_do_hybrid.rst", "autodir_options_c/sapt__sapt_dft_exch_disp_fixed_scale.rst", "autodir_options_c/sapt__sapt_dft_exch_disp_scale_scheme.rst", "autodir_options_c/sapt__sapt_dft_functional.rst", "autodir_options_c/sapt__sapt_dft_grac_determination.rst", "autodir_options_c/sapt__sapt_dft_grac_shift_a.rst", "autodir_options_c/sapt__sapt_dft_grac_shift_b.rst", "autodir_options_c/sapt__sapt_dft_mp2_disp_alg.rst", "autodir_options_c/sapt__sapt_fdds_disp_leg_lambda.rst", "autodir_options_c/sapt__sapt_fdds_disp_num_points.rst", "autodir_options_c/sapt__sapt_fdds_v2_rho_cutoff.rst", "autodir_options_c/sapt__sapt_level.rst", "autodir_options_c/sapt__sapt_mem_check.rst", "autodir_options_c/sapt__sapt_mem_factor.rst", "autodir_options_c/sapt__sapt_mem_safety.rst", "autodir_options_c/sapt__sapt_quiet.rst", "autodir_options_c/scf__basis.rst", "autodir_options_c/scf__basis_guess.rst", "autodir_options_c/scf__cholesky_tolerance.rst", "autodir_options_c/scf__cosx_basis_tolerance.rst", "autodir_options_c/scf__cosx_density_tolerance.rst", "autodir_options_c/scf__cosx_ints_tolerance.rst", "autodir_options_c/scf__cosx_maxiter_final.rst", "autodir_options_c/scf__cosx_overlap_fitting.rst", "autodir_options_c/scf__cosx_pruning_scheme.rst", "autodir_options_c/scf__cosx_radial_points_final.rst", "autodir_options_c/scf__cosx_radial_points_initial.rst", "autodir_options_c/scf__cosx_spherical_points_final.rst", "autodir_options_c/scf__cosx_spherical_points_initial.rst", "autodir_options_c/scf__d_convergence.rst", "autodir_options_c/scf__damping_convergence.rst", "autodir_options_c/scf__damping_percentage.rst", "autodir_options_c/scf__df_basis_guess.rst", "autodir_options_c/scf__df_basis_sad.rst", "autodir_options_c/scf__df_basis_scf.rst", "autodir_options_c/scf__df_bump_r0.rst", "autodir_options_c/scf__df_bump_r1.rst", "autodir_options_c/scf__df_domains.rst", "autodir_options_c/scf__df_fitting_condition.rst", "autodir_options_c/scf__df_ints_io.rst", "autodir_options_c/scf__df_ints_num_threads.rst", "autodir_options_c/scf__df_metric.rst", "autodir_options_c/scf__df_scf_guess.rst", "autodir_options_c/scf__df_theta.rst", "autodir_options_c/scf__dft_alpha.rst", "autodir_options_c/scf__dft_alpha_c.rst", "autodir_options_c/scf__dft_basis_tolerance.rst", "autodir_options_c/scf__dft_block_max_points.rst", "autodir_options_c/scf__dft_block_max_radius.rst", "autodir_options_c/scf__dft_block_min_points.rst", "autodir_options_c/scf__dft_block_scheme.rst", "autodir_options_c/scf__dft_bs_radius_alpha.rst", "autodir_options_c/scf__dft_density_tolerance.rst", "autodir_options_c/scf__dft_dispersion_parameters.rst", "autodir_options_c/scf__dft_grac_alpha.rst", "autodir_options_c/scf__dft_grac_beta.rst", "autodir_options_c/scf__dft_grac_c_func.rst", "autodir_options_c/scf__dft_grac_shift.rst", "autodir_options_c/scf__dft_grac_x_func.rst", "autodir_options_c/scf__dft_grid_name.rst", "autodir_options_c/scf__dft_nuclear_scheme.rst", "autodir_options_c/scf__dft_omega.rst", "autodir_options_c/scf__dft_omega_c.rst", "autodir_options_c/scf__dft_pruning_alpha.rst", "autodir_options_c/scf__dft_pruning_scheme.rst", "autodir_options_c/scf__dft_radial_points.rst", "autodir_options_c/scf__dft_radial_scheme.rst", "autodir_options_c/scf__dft_remove_distant_points.rst", "autodir_options_c/scf__dft_spherical_points.rst", "autodir_options_c/scf__dft_spherical_scheme.rst", "autodir_options_c/scf__dft_v2_rho_cutoff.rst", "autodir_options_c/scf__dft_vv10_b.rst", "autodir_options_c/scf__dft_vv10_c.rst", "autodir_options_c/scf__dft_vv10_postscf.rst", "autodir_options_c/scf__dft_vv10_radial_points.rst", "autodir_options_c/scf__dft_vv10_rho_cutoff.rst", "autodir_options_c/scf__dft_vv10_spherical_points.rst", "autodir_options_c/scf__dft_weights_tolerance.rst", "autodir_options_c/scf__diis.rst", "autodir_options_c/scf__diis_max_vecs.rst", "autodir_options_c/scf__diis_min_vecs.rst", "autodir_options_c/scf__diis_rms_error.rst", "autodir_options_c/scf__diis_start.rst", "autodir_options_c/scf__distributed_matrix.rst", "autodir_options_c/scf__e_convergence.rst", "autodir_options_c/scf__extern.rst", "autodir_options_c/scf__fail_on_maxiter.rst", "autodir_options_c/scf__follow_step_increment.rst", "autodir_options_c/scf__follow_step_scale.rst", "autodir_options_c/scf__frac_diis.rst", "autodir_options_c/scf__frac_load.rst", "autodir_options_c/scf__frac_occ.rst", "autodir_options_c/scf__frac_renormalize.rst", "autodir_options_c/scf__frac_start.rst", "autodir_options_c/scf__frac_val.rst", "autodir_options_c/scf__guess.rst", "autodir_options_c/scf__guess_mix.rst", "autodir_options_c/scf__guess_persist.rst", "autodir_options_c/scf__incfock.rst", "autodir_options_c/scf__incfock_convergence.rst", "autodir_options_c/scf__incfock_full_fock_every.rst", "autodir_options_c/scf__ints_tolerance.rst", "autodir_options_c/scf__level_shift.rst", "autodir_options_c/scf__level_shift_cutoff.rst", "autodir_options_c/scf__link_ints_tolerance.rst", "autodir_options_c/scf__local_convergence.rst", "autodir_options_c/scf__local_maxiter.rst", "autodir_options_c/scf__max_attempts.rst", "autodir_options_c/scf__max_mem_buf.rst", "autodir_options_c/scf__maxiter.rst", "autodir_options_c/scf__molden_write.rst", "autodir_options_c/scf__mom_occ.rst", "autodir_options_c/scf__mom_start.rst", "autodir_options_c/scf__mom_vir.rst", "autodir_options_c/scf__nl_dispersion_parameters.rst", "autodir_options_c/scf__onepot_grid_read.rst", "autodir_options_c/scf__orbitals_write.rst", "autodir_options_c/scf__parallel.rst", "autodir_options_c/scf__perturb_dipole.rst", "autodir_options_c/scf__perturb_h.rst", "autodir_options_c/scf__perturb_magnitude.rst", "autodir_options_c/scf__perturb_with.rst", "autodir_options_c/scf__phi_points.rst", "autodir_options_c/scf__pk_all_nonsym.rst", "autodir_options_c/scf__pk_max_buckets.rst", "autodir_options_c/scf__print_basis.rst", "autodir_options_c/scf__print_mos.rst", "autodir_options_c/scf__process_grid.rst", "autodir_options_c/scf__qchf.rst", "autodir_options_c/scf__r_points.rst", "autodir_options_c/scf__radius.rst", "autodir_options_c/scf__reference.rst", "autodir_options_c/scf__s_cholesky_tolerance.rst", "autodir_options_c/scf__s_orthogonalization.rst", "autodir_options_c/scf__s_tolerance.rst", "autodir_options_c/scf__sad_chol_tolerance.rst", "autodir_options_c/scf__sad_d_convergence.rst", "autodir_options_c/scf__sad_e_convergence.rst", "autodir_options_c/scf__sad_frac_occ.rst", "autodir_options_c/scf__sad_maxiter.rst", "autodir_options_c/scf__sad_print.rst", "autodir_options_c/scf__sad_scf_type.rst", "autodir_options_c/scf__sad_spin_average.rst", "autodir_options_c/scf__sapgau_basis.rst", "autodir_options_c/scf__sapt.rst", "autodir_options_c/scf__save_jk.rst", "autodir_options_c/scf__save_uhf_nos.rst", "autodir_options_c/scf__scf_initial_accelerator.rst", "autodir_options_c/scf__scf_initial_finish_diis_transition.rst", "autodir_options_c/scf__scf_initial_start_diis_transition.rst", "autodir_options_c/scf__scf_mem_safety_factor.rst", "autodir_options_c/scf__scf_properties.rst", "autodir_options_c/scf__scf_subtype.rst", "autodir_options_c/scf__snlink_basis_tolerance.rst", "autodir_options_c/scf__snlink_density_tolerance.rst", "autodir_options_c/scf__snlink_force_cartesian.rst", "autodir_options_c/scf__snlink_gpu_mem.rst", "autodir_options_c/scf__snlink_grid_batch_size.rst", "autodir_options_c/scf__snlink_integrator_kernel.rst", "autodir_options_c/scf__snlink_ints_tolerance.rst", "autodir_options_c/scf__snlink_load_balancer_kernel.rst", "autodir_options_c/scf__snlink_lwd_kernel.rst", "autodir_options_c/scf__snlink_mol_weights_kernel.rst", "autodir_options_c/scf__snlink_pruning_scheme.rst", "autodir_options_c/scf__snlink_radial_points.rst", "autodir_options_c/scf__snlink_radial_scheme.rst", "autodir_options_c/scf__snlink_reduction_kernel.rst", "autodir_options_c/scf__snlink_spherical_points.rst", "autodir_options_c/scf__snlink_use_debug_grid.rst", "autodir_options_c/scf__snlink_use_gpu.rst", "autodir_options_c/scf__solver_convergence.rst", "autodir_options_c/scf__solver_maxiter.rst", "autodir_options_c/scf__solver_n_guess.rst", "autodir_options_c/scf__solver_n_root.rst", "autodir_options_c/scf__solver_roots_per_irrep.rst", "autodir_options_c/scf__soscf.rst", "autodir_options_c/scf__soscf_conv.rst", "autodir_options_c/scf__soscf_max_iter.rst", "autodir_options_c/scf__soscf_min_iter.rst", "autodir_options_c/scf__soscf_print.rst", "autodir_options_c/scf__soscf_start_convergence.rst", "autodir_options_c/scf__stability_analysis.rst", "autodir_options_c/scf__tdscf_coeff_cutoff.rst", "autodir_options_c/scf__tdscf_guess.rst", "autodir_options_c/scf__tdscf_maxiter.rst", "autodir_options_c/scf__tdscf_print.rst", "autodir_options_c/scf__tdscf_r_convergence.rst", "autodir_options_c/scf__tdscf_states.rst", "autodir_options_c/scf__tdscf_tda.rst", "autodir_options_c/scf__tdscf_tdm_print.rst", "autodir_options_c/scf__tdscf_triplets.rst", "autodir_options_c/scf__theta_points.rst", "autodir_options_c/scf__thickness.rst", "autodir_options_c/scf__tile_sz.rst", "autodir_options_c/scf__uhf_noons.rst", "autodir_options_c/scf__wcombine.rst", "autodir_options_c/scf__wfn.rst", "autodir_options_c/thermo__p.rst", "autodir_options_c/thermo__rotational_symmetry_number.rst", "autodir_options_c/thermo__t.rst", "autodir_psivariables/module__adc.rst", "autodir_psivariables/module__ccenergy.rst", "autodir_psivariables/module__cfour.rst", "autodir_psivariables/module__dct.rst", "autodir_psivariables/module__ddx.rst", "autodir_psivariables/module__detci.rst", "autodir_psivariables/module__dfmp2.rst", "autodir_psivariables/module__dfocc.rst", "autodir_psivariables/module__dlpno.rst", "autodir_psivariables/module__dmrg.rst", "autodir_psivariables/module__efp.rst", "autodir_psivariables/module__fisapt.rst", "autodir_psivariables/module__fnocc.rst", "autodir_psivariables/module__gdma.rst", "autodir_psivariables/module__mcscf.rst", "autodir_psivariables/module__mrcc.rst", "autodir_psivariables/module__occ.rst", "autodir_psivariables/module__oeprop.rst", "autodir_psivariables/module__pcm.rst", "autodir_psivariables/module__pe.rst", "autodir_psivariables/module__psimrcc.rst", "autodir_psivariables/module__sapt.rst", "autodir_psivariables/module__scf.rst", "autodir_psivariables/module__thermo.rst", "autodoc_available_databases.rst", "autodoc_available_efpfrag.rst", "autodoc_basissets_byfamily.rst", "autodoc_dft_all.rst", "autodoc_dft_dhybrid.rst", "autodoc_dft_disp.rst", "autodoc_dft_energy.rst", "autodoc_dft_gga.rst", "autodoc_dft_hybrid.rst", "autodoc_dft_lrc.rst", "autodoc_dft_meta.rst", "autodoc_dft_opt.rst", "autodoc_glossary_options_c.rst", "autodoc_options_c_bymodule.rst", "autodoc_physconst.rst", "autodoc_psi4bases.rst", "autodoc_psifiles.rst", "autodoc_psivariables_bymodule.rst", "autodoc_testsuite_brianqc.rst", "autodoc_testsuite_cfour.rst", "autodoc_testsuite_chemps2.rst", "autodoc_testsuite_cookbook.rst", "autodoc_testsuite_corepsi4.rst", "autodoc_testsuite_dftd3.rst", "autodoc_testsuite_dftd4.rst", "autodoc_testsuite_dkh.rst", "autodoc_testsuite_gcp.rst", "autodoc_testsuite_gdma.rst", "autodoc_testsuite_gpu_dfcc.rst", "autodoc_testsuite_json.rst", "autodoc_testsuite_libefp.rst", "autodoc_testsuite_mrcc.rst", "autodoc_testsuite_pcmsolver.rst", "autodoc_testsuite_psi4numpy.rst", "autodoc_testsuite_python.rst", "autodoc_testsuite_simint.rst", "autodoc_testsuite_snsmp2.rst", "autodoc_testsuite_v2rdm_casscf.rst", "basissets.rst", "basissets_byelement.rst", "basissets_byfamily.rst", "basissets_tables.rst", "bibliography.rst", "brianqc.rst", "build_faq.rst", "build_obtaining.rst", "build_planning.rst", "capabilities.rst", "cbs.rst", "cbs_eqn.rst", "cc.rst", "cfour.rst", "cfour_table_energy.rst", "cfour_table_grad.rst", "chemps2.rst", "code_style.rst", "conda.rst", "cppe.rst", "cubeprop.rst", "customizing.rst", "db.rst", "dct.rst", "ddx.rst", "detci.rst", "dfmp2.rst", "dft.rst", "dft_byfunctional.rst", "dftd3.rst", "dftnl.rst", "diatomic.rst", "dkh.rst", "dlpnomp2.rst", "documentation.rst", "ecpint.rst", "energy.rst", "external.rst", "external_apis.rst", "fchk.rst", "fisapt.rst", "fnocc.rst", "freq.rst", "gau2grid.rst", "gcp.rst", "gdma.rst", "glossary_psivariables.rst", "index.rst", "index_tutorials.rst", "intercalls.rst", "interfacing.rst", "introduction.rst", "libefp.rst", "libint.rst", "libxc.rst", "manage_addon.rst", "manage_git.rst", "manage_index.rst", "manage_release.rst", "mcscf.rst", "methods.rst", "molden.rst", "mrcc.rst", "mrcc_table_energy.rst", "nbody.rst", "notes_c.rst", "notes_py.rst", "numpy.rst", "occ.rst", "oeprop.rst", "opt.rst", "optionshandling.rst", "optking.rst", "pcmsolver.rst", "pep0001.rst", "plugin_psi4fockci.rst", "plugin_snsmp2.rst", "plugin_v2rdm_casscf.rst", "plugins.rst", "proc_py.rst", "prog_blas.rst", "prog_conduct.rst", "prog_corelibs.rst", "prog_debug_profile.rst", "prog_faq.rst", "prog_full_integration.rst", "prog_help.rst", "prog_integrals.rst", "prog_intro.rst", "prog_newcode.rst", "prog_setup.rst", "prog_style_c.rst", "prog_style_py.rst", "prog_tour.rst", "prog_ways_to_add.rst", "prog_welcome.rst", "prop.rst", "psi4api.rst", "psiapi.ipynb", "psimrcc.rst", "psipep.rst", "psithonfunc.rst", "psithoninput.rst", "psithonmol.rst", "quickaddalias.rst", "quickadddatabase.rst", "relativistic.rst", "sapt.rst", "scf.rst", "simint.rst", "sowreap.rst", "tdscf.rst", "testsuite.rst", "thermo.rst", "tutorial.rst"], "indexentries": {"(at) correction energy": [[1776, "psivar-AT-CORRECTION-ENERGY", false]], "(t) correction energy": [[1776, "psivar-0", false]], "--append": [[1767, "cmdoption-psi4-a", false]], "--help": [[1767, "cmdoption-psi4-h", false]], "--inplace": [[1767, "cmdoption-psi4-inplace", false]], "--input": [[1767, "cmdoption-psi4-i", false]], "--loglevel": [[1767, "cmdoption-psi4-loglevel", false]], "--memory": [[1767, "cmdoption-psi4-memory", false]], "--messy": [[1767, "cmdoption-psi4-m", false]], "--module": [[1767, "cmdoption-psi4-module", false]], "--nthread": [[1767, "cmdoption-psi4-n", false]], "--output": [[1767, "cmdoption-psi4-o", false]], "--psiapi-path": [[1767, "cmdoption-psi4-psiapi-path", false]], "--psidatadir": [[1767, "cmdoption-psi4-l", false]], "--qcschema": [[1767, "cmdoption-psi4-qcschema", false]], "--schema": [[1767, "cmdoption-psi4-qcschema", false]], "--scratch": [[1767, "cmdoption-psi4-s", false]], "--skip-preprocessor": [[1767, "cmdoption-psi4-k", false]], "--test": [[1767, "cmdoption-psi4-t", false]], "--verbose": [[1767, "cmdoption-psi4-v", false]], "--version": [[1767, "cmdoption-psi4-V", false]], "-a": [[1767, "cmdoption-psi4-a", false]], "-h": [[1767, "cmdoption-psi4-h", false]], "-i": [[1767, "cmdoption-psi4-i", false]], "-k": [[1767, "cmdoption-psi4-k", false]], "-l": [[1767, "cmdoption-psi4-l", false]], "-m": [[1767, "cmdoption-psi4-m", false]], "-n": [[1767, "cmdoption-psi4-n", false]], "-o": [[1767, "cmdoption-psi4-o", false]], "-s": [[1767, "cmdoption-psi4-s", false]], "-t": [[1767, "cmdoption-psi4-t", false]], "-v": [[1767, "cmdoption-psi4-V", false], [1767, "cmdoption-psi4-v", false]], "2-body pairwise dispersion correction analysis": [[1776, "psivar-2-BODY-PAIRWISE-DISPERSION-CORRECTION-ANALYSIS", false]], "[t] correction energy": [[1776, "psivar-T-CORRECTION-ENERGY", false]], "_get_default_xtpl() (in module psi4.driver.driver_cbs)": [[1740, "psi4.driver.driver_cbs._get_default_xtpl", false]], "_to_array() (in module psi4.driver.p4util.numpy_helper)": [[1797, "psi4.driver.p4util.numpy_helper._to_array", false]], "a-(t) correction energy": [[1776, "psivar-A-T-CORRECTION-ENERGY", false]], "a-ccsd(t) correlation energy": [[1776, "psivar-A-CCSD-T-CORRELATION-ENERGY", false]], "a-ccsd(t) total energy": [[1776, "psivar-A-CCSD-T-TOTAL-ENERGY", false]], "a1() (psi4.core.dispersion method)": [[68, "psi4.core.Dispersion.a1", false]], "a2() (psi4.core.dispersion method)": [[68, "psi4.core.Dispersion.a2", false]], "a_ras3_max (detci)": [[1704, "term-A_RAS3_MAX-DETCI", true]], "aaa (t) correction energy": [[1776, "psivar-AAA-T-CORRECTION-ENERGY", false]], "aab (t) correction energy": [[1776, "psivar-AAB-T-CORRECTION-ENERGY", false]], "ab initio polarization propagator": [[0, "index-1", false]], "abb (t) correction energy": [[1776, "psivar-ABB-T-CORRECTION-ENERGY", false]], "abcd (ccenergy)": [[1704, "term-ABCD-CCENERGY", true]], "abcd (cceom)": [[1704, "term-ABCD-CCEOM", true]], "abcd (cclambda)": [[1704, "term-ABCD-CCLAMBDA", true]], "abcd (ccresponse)": [[1704, "term-ABCD-CCRESPONSE", true]], "absent (psi4.core.fragmenttype attribute)": [[79, "psi4.core.FragmentType.Absent", false]], "absmax() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.absmax", false]], "accumulate_product() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.accumulate_product", false]], "acpf correlation energy": [[1776, "psivar-ACPF-CORRELATION-ENERGY", false]], "acpf dipole": [[1776, "psivar-ACPF-DIPOLE", false]], "acpf doubles energy": [[1776, "psivar-ACPF-DOUBLES-ENERGY", false]], "acpf opposite-spin correlation energy": [[1776, "psivar-ACPF-OPPOSITE-SPIN-CORRELATION-ENERGY", false]], "acpf quadrupole": [[1776, "psivar-ACPF-QUADRUPOLE", false]], "acpf same-spin correlation energy": [[1776, "psivar-ACPF-SAME-SPIN-CORRELATION-ENERGY", false]], "acpf singles energy": [[1776, "psivar-ACPF-SINGLES-ENERGY", false]], "acpf total energy": [[1776, "psivar-ACPF-TOTAL-ENERGY", false]], "activate() (in module psi4.driver)": [[281, "psi4.driver.activate", false]], "activate_all_fragments() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.activate_all_fragments", false]], "active (globals)": [[1704, "term-ACTIVE-GLOBALS", true]], "active_nat_orbs (fnocc)": [[1704, "term-ACTIVE_NAT_ORBS-FNOCC", true]], "adc": [[0, "index-0", false], [0, "index-2", false], [1, "index-0", false]], "adc iterations": [[1776, "psivar-ADC-ITERATIONS", false]], "adc root 0 (h) -> root n (i) electric transition dipole moment (len)": [[1776, "psivar-ADC-ROOT-0-h-ROOT-n-i-ELECTRIC-TRANSITION-DIPOLE-MOMENT-LEN", false]], "adc root 0 (h) -> root n (i) excitation energy": [[1776, "psivar-ADC-ROOT-0-h-ROOT-n-i-EXCITATION-ENERGY", false]], "adc root 0 (h) -> root n (i) oscillator strength (len)": [[1776, "psivar-ADC-ROOT-0-h-ROOT-n-i-OSCILLATOR-STRENGTH-LEN", false]], "adc root 0 (h) -> root n (i) oscillator strength (vel)": [[1776, "psivar-ADC-ROOT-0-h-ROOT-n-i-OSCILLATOR-STRENGTH-VEL", false]], "adc root 0 (h) -> root n (i) rotatory strength (vel)": [[1776, "psivar-ADC-ROOT-0-h-ROOT-n-i-ROTATORY-STRENGTH-VEL", false]], "adc root 0 (in h) -> root n (in i) electric transition dipole moment (len)": [[1776, "psivar-ADC-ROOT-0-IN-h-ROOT-n-IN-i-ELECTRIC-TRANSITION-DIPOLE-MOMENT-LEN", false]], "adc root 0 (in h) -> root n (in i) excitation energy": [[1776, "psivar-ADC-ROOT-0-IN-h-ROOT-n-IN-i-EXCITATION-ENERGY", false]], "adc root 0 (in h) -> root n (in i) oscillator strength (len)": [[1776, "psivar-ADC-ROOT-0-IN-h-ROOT-n-IN-i-OSCILLATOR-STRENGTH-LEN", false]], "adc root 0 (in h) -> root n (in i) oscillator strength (vel)": [[1776, "psivar-ADC-ROOT-0-IN-h-ROOT-n-IN-i-OSCILLATOR-STRENGTH-VEL", false]], "adc root 0 (in h) -> root n (in i) rotatory strength (vel)": [[1776, "psivar-ADC-ROOT-0-IN-h-ROOT-n-IN-i-ROTATORY-STRENGTH-VEL", false]], "adc root 0 -> root n electric transition dipole moment (len)": [[1776, "psivar-ADC-ROOT-0-ROOT-n-ELECTRIC-TRANSITION-DIPOLE-MOMENT-LEN", false]], "adc root 0 -> root n electric transition dipole moment (len) - h transition": [[1776, "psivar-ADC-ROOT-0-ROOT-n-ELECTRIC-TRANSITION-DIPOLE-MOMENT-LEN-h-TRANSITION", false]], "adc root 0 -> root n excitation energy": [[1776, "psivar-ADC-ROOT-0-ROOT-n-EXCITATION-ENERGY", false]], "adc root 0 -> root n excitation energy - h transition": [[1776, "psivar-ADC-ROOT-0-ROOT-n-EXCITATION-ENERGY-h-TRANSITION", false]], "adc root 0 -> root n oscillator strength (len)": [[1776, "psivar-ADC-ROOT-0-ROOT-n-OSCILLATOR-STRENGTH-LEN", false]], "adc root 0 -> root n oscillator strength (len) - h transition": [[1776, "psivar-ADC-ROOT-0-ROOT-n-OSCILLATOR-STRENGTH-LEN-h-TRANSITION", false]], "adc root 0 -> root n oscillator strength (vel)": [[1776, "psivar-ADC-ROOT-0-ROOT-n-OSCILLATOR-STRENGTH-VEL", false]], "adc root 0 -> root n oscillator strength (vel) - h transition": [[1776, "psivar-ADC-ROOT-0-ROOT-n-OSCILLATOR-STRENGTH-VEL-h-TRANSITION", false]], "adc root 0 -> root n rotatory strength (vel)": [[1776, "psivar-ADC-ROOT-0-ROOT-n-ROTATORY-STRENGTH-VEL", false]], "adc root 0 -> root n rotatory strength (vel) - h transition": [[1776, "psivar-ADC-ROOT-0-ROOT-n-ROTATORY-STRENGTH-VEL-h-TRANSITION", false]], "adcc": [[1, "index-0", false]], "add() (psi4.core.intvector method)": [[88, "psi4.core.IntVector.add", false]], "add() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.add", false]], "add() (psi4.core.oeprop method)": [[111, "psi4.core.OEProp.add", false]], "add() (psi4.core.vector method)": [[148, "psi4.core.Vector.add", false]], "add() (psi4.driver.p4util.diis method)": [[321, "psi4.driver.p4util.DIIS.add", false]], "add_and_orthogonalize_row() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.add_and_orthogonalize_row", false]], "add_array() (psi4.core.options method)": [[114, "psi4.core.Options.add_array", false]], "add_atom() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.add_atom", false]], "add_auxiliary_bonds (optking)": [[1704, "term-ADD_AUXILIARY_BONDS-OPTKING", true]], "add_bool() (psi4.core.options method)": [[114, "psi4.core.Options.add_bool", false]], "add_c_functional() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.add_c_functional", false]], "add_int() (psi4.core.options method)": [[114, "psi4.core.Options.add_int", false]], "add_option() (psi4.driver.p4util.optionsstate method)": [[327, "psi4.driver.p4util.OptionsState.add_option", false]], "add_space() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.add_space", false]], "add_str() (psi4.core.options method)": [[114, "psi4.core.Options.add_str", false]], "add_str_i() (psi4.core.options method)": [[114, "psi4.core.Options.add_str_i", false]], "add_transformation() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.add_transformation", false]], "add_x_functional() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.add_x_functional", false]], "addbasis() (psi4.core.externalpotential method)": [[73, "psi4.core.ExternalPotential.addBasis", false]], "addcharge() (psi4.core.externalpotential method)": [[73, "psi4.core.ExternalPotential.addCharge", false]], "addchargeangstrom() (psi4.driver.qmmmbohr method)": [[275, "psi4.driver.QMMMbohr.addChargeAngstrom", false]], "addchargebohr() (psi4.driver.qmmmbohr method)": [[275, "psi4.driver.QMMMbohr.addChargeBohr", false]], "adddiffuse() (psi4.driver.qmmmbohr method)": [[275, "psi4.driver.QMMMbohr.addDiffuse", false]], "adding new": [[1730, "index-3", false], [1782, "index-1", false], [1834, "index-0", false], [1835, "index-0", false]], "advanced-keywords": [[1771, "index-3", false]], "aindex() (psi4.core.mospace method)": [[98, "psi4.core.MOSpace.aIndex", false]], "aio_cphf (sapt)": [[1704, "term-AIO_CPHF-SAPT", true]], "aio_df_ints (sapt)": [[1704, "term-AIO_DF_INTS-SAPT", true]], "algorithm (dct)": [[1704, "term-ALGORITHM-DCT", true]], "all() (psi4.core.mospace static method)": [[98, "psi4.core.MOSpace.all", false]], "all_casings() (in module psi4.driver.p4util)": [[330, "psi4.driver.p4util.all_casings", false]], "allen_focal_point() (in module psi4.driver.aliases)": [[1740, "psi4.driver.aliases.allen_focal_point", false]], "allocate() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.allocate", false]], "alpha() (psi4.core.functional method)": [[80, "psi4.core.Functional.alpha", false]], "alpha_corr_to_pitzer() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.alpha_corr_to_pitzer", false]], "alpha_orbital_space() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.alpha_orbital_space", false]], "am (psi4.core.gaussianshell attribute)": [[81, "psi4.core.GaussianShell.am", false]], "amchar (psi4.core.gaussianshell attribute)": [[81, "psi4.core.GaussianShell.AMCHAR", false], [81, "psi4.core.GaussianShell.amchar", false]], "analyze (ccenergy)": [[1704, "term-ANALYZE-CCENERGY", true]], "analyze (ccresponse)": [[1704, "term-ANALYZE-CCRESPONSE", true]], "angstrom (psi4.core.geometryunits attribute)": [[83, "psi4.core.GeometryUnits.Angstrom", false]], "angularmomentumint (class in psi4.core)": [[4, "psi4.core.AngularMomentumInt", false]], "anharmonicity()": [[1761, "index-0", false]], "anharmonicity() (in module psi4.driver.diatomic)": [[1761, "psi4.driver.diatomic.anharmonicity", false]], "ansatz() (psi4.core.pointfunctions method)": [[119, "psi4.core.PointFunctions.ansatz", false]], "ansatz() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.ansatz", false]], "ao_3center_deriv1() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_3center_deriv1", false]], "ao_3coverlap() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_3coverlap", false]], "ao_angular_momentum() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.ao_angular_momentum", false]], "ao_angular_momentum() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_angular_momentum", false]], "ao_basis (ccdensity)": [[1704, "term-AO_BASIS-CCDENSITY", true]], "ao_basis (ccenergy)": [[1704, "term-AO_BASIS-CCENERGY", true]], "ao_basis (cclambda)": [[1704, "term-AO_BASIS-CCLAMBDA", true]], "ao_basis (cctransort)": [[1704, "term-AO_BASIS-CCTRANSORT", true]], "ao_basis (dct)": [[1704, "term-AO_BASIS-DCT", true]], "ao_dipole() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.ao_dipole", false]], "ao_dipole() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_dipole", false]], "ao_dkh() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_dkh", false]], "ao_efp_multipole_potential() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_efp_multipole_potential", false]], "ao_elec_dip_deriv1() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_elec_dip_deriv1", false]], "ao_erf_eri() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_erf_eri", false]], "ao_eri() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_eri", false]], "ao_eri_shell() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_eri_shell", false]], "ao_f12() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_f12", false]], "ao_f12_double_commutator() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_f12_double_commutator", false]], "ao_f12_squared() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_f12_squared", false]], "ao_f12g12() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_f12g12", false]], "ao_kinetic() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.ao_kinetic", false]], "ao_kinetic() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_kinetic", false]], "ao_metric_deriv1() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_metric_deriv1", false]], "ao_multipole_potential() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.ao_multipole_potential", false]], "ao_multipole_potential() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_multipole_potential", false]], "ao_multipoles() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.ao_multipoles", false]], "ao_multipoles() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_multipoles", false]], "ao_nabla() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.ao_nabla", false]], "ao_nabla() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_nabla", false]], "ao_oei_deriv1() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_oei_deriv1", false]], "ao_oei_deriv2() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_oei_deriv2", false]], "ao_overlap() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.ao_overlap", false]], "ao_overlap() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_overlap", false]], "ao_overlap_half_deriv1() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_overlap_half_deriv1", false]], "ao_potential() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.ao_potential", false]], "ao_potential() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_potential", false]], "ao_potential_erf() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_potential_erf", false]], "ao_potential_erf_complement() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_potential_erf_complement", false]], "ao_pvp() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_pvp", false]], "ao_quadrupole() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.ao_quadrupole", false]], "ao_quadrupole() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_quadrupole", false]], "ao_tei_deriv1() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_tei_deriv1", false]], "ao_tei_deriv2() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_tei_deriv2", false]], "ao_to_shell() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.ao_to_shell", false]], "ao_traceless_quadrupole() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.ao_traceless_quadrupole", false]], "ao_traceless_quadrupole() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_traceless_quadrupole", false]], "aorbs() (psi4.core.mospace method)": [[98, "psi4.core.MOSpace.aOrbs", false]], "aoshellcombinationsiterator (class in psi4.core)": [[3, "psi4.core.AOShellCombinationsIterator", false]], "aotoso() (psi4.core.petitelist method)": [[118, "psi4.core.PetiteList.aotoso", false]], "aotoso() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.aotoso", false]], "append() (psi4.core.bsvec method)": [[5, "psi4.core.BSVec.append", false]], "appendcharges() (psi4.core.externalpotential method)": [[73, "psi4.core.ExternalPotential.appendCharges", false]], "apply_denominator() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.apply_denominator", false]], "approx_solve() (psi4.core.somcscf method)": [[133, "psi4.core.SOMCSCF.approx_solve", false]], "aqcc correlation energy": [[1776, "psivar-AQCC-CORRELATION-ENERGY", false]], "aqcc dipole": [[1776, "psivar-AQCC-DIPOLE", false]], "aqcc doubles energy": [[1776, "psivar-AQCC-DOUBLES-ENERGY", false]], "aqcc opposite-spin correlation energy": [[1776, "psivar-AQCC-OPPOSITE-SPIN-CORRELATION-ENERGY", false]], "aqcc quadrupole": [[1776, "psivar-AQCC-QUADRUPOLE", false]], "aqcc same-spin correlation energy": [[1776, "psivar-AQCC-SAME-SPIN-CORRELATION-ENERGY", false]], "aqcc singles energy": [[1776, "psivar-AQCC-SINGLES-ENERGY", false]], "aqcc total energy": [[1776, "psivar-AQCC-TOTAL-ENERGY", false]], "arbitrary-order coupled-cluster theory": [[1755, "index-5", false]], "arbitrary-order perturbation theory": [[1755, "index-4", false]], "architectures": [[1781, "index-0", false]], "array_interface() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.array_interface", false]], "array_interface() (psi4.core.vector method)": [[148, "psi4.core.Vector.array_interface", false]], "array_to_matrix() (in module psi4.driver.p4util)": [[331, "psi4.driver.p4util.array_to_matrix", false]], "array_to_matrix() (in module psi4.driver.p4util.numpy_helper)": [[1797, "psi4.driver.p4util.numpy_helper.array_to_matrix", false]], "array_variable() (in module psi4.core)": [[151, "psi4.core.array_variable", false]], "array_variable() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.array_variable", false]], "array_variables() (in module psi4.core)": [[152, "psi4.core.array_variables", false]], "array_variables() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.array_variables", false]], "arrays() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.arrays", false]], "ascending (psi4.core.diagonalizeorder attribute)": [[63, "psi4.core.DiagonalizeOrder.Ascending", false]], "atom (psi4.core.salccomponent attribute)": [[134, "psi4.core.SalcComponent.atom", false]], "atom_at_position() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.atom_at_position", false]], "atomic_blocks() (psi4.core.moleculargrid method)": [[105, "psi4.core.MolecularGrid.atomic_blocks", false]], "atomic_point_charges() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.atomic_point_charges", false]], "atoms (psi4.driver.p4util.inpsight attribute)": [[323, "psi4.driver.p4util.InPsight.atoms", false]], "attempt_number_ (psi4.core.hf attribute)": [[84, "psi4.core.HF.attempt_number_", false]], "auto_fragments() (in module psi4.driver.wrapper_autofrag)": [[1768, "psi4.driver.wrapper_autofrag.auto_fragments", false]], "aux_overlap() (psi4.core.fdds_dispersion method)": [[75, "psi4.core.FDDS_Dispersion.aux_overlap", false]], "auxiliary": [[1730, "index-2", false]], "auxiliary_bond_factor (optking)": [[1704, "term-AUXILIARY_BOND_FACTOR-OPTKING", true]], "available": [[1752, "index-4", false]], "available by element": [[1731, "index-0", false]], "available by family": [[1730, "index-0", false], [1733, "index-0", false]], "available functionals": [[1758, "index-0", false]], "avg_states (detci)": [[1704, "term-AVG_STATES-DETCI", true]], "avg_weights (detci)": [[1704, "term-AVG_WEIGHTS-DETCI", true]], "axpby() (psi4.core.vector method)": [[148, "psi4.core.Vector.axpby", false]], "axpy() (psi4.core.civector method)": [[12, "psi4.core.CIVector.axpy", false]], "axpy() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.axpy", false]], "axpy() (psi4.core.vector method)": [[148, "psi4.core.Vector.axpy", false]], "axpy_matrix() (psi4.core.dpdbuf4 method)": [[183, "psi4.core.dpdbuf4.axpy_matrix", false]], "axpy_matrix() (psi4.core.dpdfile2 method)": [[184, "psi4.core.dpdfile2.axpy_matrix", false]], "azimuth (psi4.driver.p4util.inpsight attribute)": [[323, "psi4.driver.p4util.InPsight.azimuth", false]], "b787() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.B787", false]], "b_ras3_max (detci)": [[1704, "term-B_RAS3_MAX-DETCI", true]], "back_transform() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.back_transform", false]], "backtransform_density() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.backtransform_density", false]], "backtransform_tpdm_restricted() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.backtransform_tpdm_restricted", false]], "backtransform_tpdm_unrestricted() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.backtransform_tpdm_unrestricted", false]], "banner() (in module psi4.driver)": [[282, "psi4.driver.banner", false]], "banner() (in module psi4.driver.p4util)": [[332, "psi4.driver.p4util.banner", false]], "basic-keywords": [[1755, "index-2", false], [1771, "index-2", false]], "basis (dfmp2)": [[1704, "term-BASIS-DFMP2", true]], "basis (mints)": [[1704, "term-BASIS-MINTS", true]], "basis (psi4.core.onebodyaoint attribute)": [[112, "psi4.core.OneBodyAOInt.basis", false]], "basis (psi4.core.onebodysoint attribute)": [[113, "psi4.core.OneBodySOInt.basis", false]], "basis (psi4.driver.atomiccomputer attribute)": [[265, "psi4.driver.AtomicComputer.basis", false]], "basis (psi4.driver.driver_cbs.compositecomputer attribute)": [[1740, "psi4.driver.driver_cbs.CompositeComputer.basis", false]], "basis (psi4.driver.driver_nbody.manybodycomputer attribute)": [[1794, "psi4.driver.driver_nbody.ManyBodyComputer.basis", false]], "basis (sapt)": [[1704, "term-BASIS-SAPT", true]], "basis (scf)": [[1704, "term-BASIS-SCF", true]], "basis set": [[1730, "index-0", false], [1730, "index-1", false], [1730, "index-2", false], [1730, "index-3", false], [1731, "index-0", false], [1732, "index-0", false], [1733, "index-0", false], [1740, "index-0", false], [1740, "index-3", false]], "basis() (psi4.core.basisextents method)": [[6, "psi4.core.BasisExtents.basis", false]], "basis() (psi4.core.vbase method)": [[147, "psi4.core.VBase.basis", false]], "basis1 (psi4.core.onebodyaoint attribute)": [[112, "psi4.core.OneBodyAOInt.basis1", false]], "basis1 (psi4.core.onebodysoint attribute)": [[113, "psi4.core.OneBodySOInt.basis1", false]], "basis2 (psi4.core.onebodyaoint attribute)": [[112, "psi4.core.OneBodyAOInt.basis2", false]], "basis2 (psi4.core.onebodysoint attribute)": [[113, "psi4.core.OneBodySOInt.basis2", false]], "basis_guess (scf)": [[1704, "term-BASIS_GUESS-SCF", true]], "basis_helper() (in module psi4.driver)": [[283, "psi4.driver.basis_helper", false]], "basis_helper() (in module psi4.driver.p4util)": [[333, "psi4.driver.p4util.basis_helper", false]], "basis_on_atom() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.basis_on_atom", false]], "basis_projection() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.basis_projection", false]], "basis_relativistic (globals)": [[1704, "term-BASIS_RELATIVISTIC-GLOBALS", true]], "basis_values() (psi4.core.basisfunctions method)": [[7, "psi4.core.BasisFunctions.basis_values", false]], "basisextents (class in psi4.core)": [[6, "psi4.core.BasisExtents", false]], "basisfunctions (class in psi4.core)": [[7, "psi4.core.BasisFunctions", false]], "basisset (class in psi4.core)": [[8, "psi4.core.BasisSet", false]], "basisset() (psi4.core.cubeproperties method)": [[21, "psi4.core.CubeProperties.basisset", false]], "basisset() (psi4.core.jk method)": [[92, "psi4.core.JK.basisset", false]], "basisset() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.basisset", false]], "basisset() (psi4.core.orbitalspace method)": [[115, "psi4.core.OrbitalSpace.basisset", false]], "basisset() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.basisset", false]], "bbb (t) correction energy": [[1776, "psivar-BBB-T-CORRECTION-ENERGY", false]], "bccd_maxiter (ccenergy)": [[1704, "term-BCCD_MAXITER-CCENERGY", true]], "be_quiet() (in module psi4.core)": [[153, "psi4.core.be_quiet", false]], "begin() (psi4.core.slice method)": [[137, "psi4.core.Slice.begin", false]], "bench (globals)": [[1704, "term-BENCH-GLOBALS", true]], "benchmark_blas1() (in module psi4.core)": [[154, "psi4.core.benchmark_blas1", false]], "benchmark_blas2() (in module psi4.core)": [[155, "psi4.core.benchmark_blas2", false]], "benchmark_blas3() (in module psi4.core)": [[156, "psi4.core.benchmark_blas3", false]], "benchmark_disk() (in module psi4.core)": [[157, "psi4.core.benchmark_disk", false]], "benchmark_integrals() (in module psi4.core)": [[158, "psi4.core.benchmark_integrals", false]], "benchmark_math() (in module psi4.core)": [[159, "psi4.core.benchmark_math", false]], "bendazzoli (detci)": [[1704, "term-BENDAZZOLI-DETCI", true]], "beta_corr_to_pitzer() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.beta_corr_to_pitzer", false]], "beta_orbital_space() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.beta_orbital_space", false]], "bfs() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.BFS", false]], "bibtex() (psi4.core.dispersion method)": [[68, "psi4.core.Dispersion.bibtex", false]], "bindex() (psi4.core.mospace method)": [[98, "psi4.core.MOSpace.bIndex", false]], "bits() (psi4.core.pointgroup method)": [[120, "psi4.core.PointGroup.bits", false]], "blank() (psi4.core.superfunctional static method)": [[138, "psi4.core.SuperFunctional.blank", false]], "blend() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.blend", false]], "block_diagonal_array() (in module psi4.driver.p4util)": [[334, "psi4.driver.p4util.block_diagonal_array", false]], "blockopoints (class in psi4.core)": [[9, "psi4.core.BlockOPoints", false]], "blocks() (psi4.core.moleculargrid method)": [[105, "psi4.core.MolecularGrid.blocks", false]], "bohr (psi4.core.geometryunits attribute)": [[83, "psi4.core.GeometryUnits.Bohr", false]], "bohr_per_ang (psi4.driver.p4util.inpsight attribute)": [[323, "psi4.driver.p4util.InPsight.bohr_per_ang", false]], "bond_width (psi4.driver.p4util.inpsight attribute)": [[323, "psi4.driver.p4util.InPsight.bond_width", false]], "bonding_alpha (psi4.driver.p4util.inpsight attribute)": [[323, "psi4.driver.p4util.InPsight.bonding_alpha", false]], "bonds (psi4.driver.p4util.inpsight attribute)": [[323, "psi4.driver.p4util.InPsight.bonds", false]], "borbs() (psi4.core.mospace method)": [[98, "psi4.core.MOSpace.bOrbs", false]], "border (pe)": [[1704, "term-BORDER-PE", true]], "border_n_redist (pe)": [[1704, "term-BORDER_N_REDIST-PE", true]], "border_redist_order (pe)": [[1704, "term-BORDER_REDIST_ORDER-PE", true]], "border_redist_pol (pe)": [[1704, "term-BORDER_REDIST_POL-PE", true]], "border_rmin (pe)": [[1704, "term-BORDER_RMIN-PE", true]], "border_rmin_unit (pe)": [[1704, "term-BORDER_RMIN_UNIT-PE", true]], "border_type (pe)": [[1704, "term-BORDER_TYPE-PE", true]], "boyslocalizer (class in psi4.core)": [[10, "psi4.core.BoysLocalizer", false]], "brianqc": [[1735, "index-0", false]], "brianqc_enable": [[1735, "envvar-BRIANQC_ENABLE", false], [1735, "index-4", false]], "brianqc_enable (globals)": [[1704, "term-BRIANQC_ENABLE-GLOBALS", true]], "brianqc_install_path": [[1735, "envvar-BRIANQC_INSTALL_PATH", false], [1735, "index-2", false], [1735, "index-3", false]], "brianqc_sdk_install": [[1735, "envvar-BRIANQC_SDK_INSTALL", false], [1735, "index-1", false]], "brueckner converged": [[1776, "psivar-BRUECKNER-CONVERGED", false]], "brueckner_maxiter (fnocc)": [[1704, "term-BRUECKNER_MAXITER-FNOCC", true]], "brueckner_orbs_r_convergence (ccenergy)": [[1704, "term-BRUECKNER_ORBS_R_CONVERGENCE-CCENERGY", true]], "bsse": [[1794, "index-0", false]], "bsse_type (psi4.driver.driver_nbody.manybodycomputer attribute)": [[1794, "psi4.driver.driver_nbody.ManyBodyComputer.bsse_type", false]], "bsseenum (class in psi4.driver.driver_nbody)": [[1794, "psi4.driver.driver_nbody.BsseEnum", false]], "bsvec (class in psi4.core)": [[5, "psi4.core.BSVec", false]], "bugs": [[1781, "index-3", false]], "build() (psi4.core.basisset static method)": [[8, "psi4.core.BasisSet.build", false]], "build() (psi4.core.dftgrid static method)": [[29, "psi4.core.DFTGrid.build", false]], "build() (psi4.core.dispersion static method)": [[68, "psi4.core.Dispersion.build", false]], "build() (psi4.core.jk static method)": [[92, "psi4.core.JK.build", false]], "build() (psi4.core.localizer static method)": [[97, "psi4.core.Localizer.build", false]], "build() (psi4.core.vbase static method)": [[147, "psi4.core.VBase.build", false]], "build() (psi4.core.wavefunction static method)": [[150, "psi4.core.Wavefunction.build", false]], "build_base() (psi4.core.functional static method)": [[80, "psi4.core.Functional.build_base", false]], "build_cabs_space() (psi4.core.orbitalspace static method)": [[115, "psi4.core.OrbitalSpace.build_cabs_space", false]], "build_collocation_cache() (psi4.core.vbase method)": [[147, "psi4.core.VBase.build_collocation_cache", false]], "build_jk() (psi4.core.jk static method)": [[92, "psi4.core.JK.build_JK", false]], "build_ri_space() (psi4.core.orbitalspace static method)": [[115, "psi4.core.OrbitalSpace.build_ri_space", false]], "build_sad() (psi4.core.sadguess static method)": [[131, "psi4.core.SADGuess.build_SAD", false]], "build_tasks() (psi4.driver.driver_cbs.compositecomputer method)": [[1740, "psi4.driver.driver_cbs.CompositeComputer.build_tasks", false]], "build_tasks() (psi4.driver.driver_findif.finitedifferencecomputer method)": [[1772, "psi4.driver.driver_findif.FiniteDifferenceComputer.build_tasks", false]], "build_tasks() (psi4.driver.driver_nbody.manybodycomputer method)": [[1794, "psi4.driver.driver_nbody.ManyBodyComputer.build_tasks", false]], "c() (psi4.core.orbitalspace method)": [[115, "psi4.core.OrbitalSpace.C", false]], "c1_deep_copy() (psi4.core.cuhf method)": [[14, "psi4.core.CUHF.c1_deep_copy", false]], "c1_deep_copy() (psi4.core.rhf method)": [[128, "psi4.core.RHF.c1_deep_copy", false]], "c1_deep_copy() (psi4.core.rohf method)": [[130, "psi4.core.ROHF.c1_deep_copy", false]], "c1_deep_copy() (psi4.core.uhf method)": [[145, "psi4.core.UHF.c1_deep_copy", false]], "c1_deep_copy() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.c1_deep_copy", false]], "c2_x() (psi4.core.symmetryoperation method)": [[139, "psi4.core.SymmetryOperation.c2_x", false]], "c2_y() (psi4.core.symmetryoperation method)": [[139, "psi4.core.SymmetryOperation.c2_y", false]], "c2_z() (psi4.core.symmetryoperation method)": [[139, "psi4.core.SymmetryOperation.c2_z", false]], "c_add() (psi4.core.jk method)": [[92, "psi4.core.JK.C_add", false]], "c_alpha() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.c_alpha", false]], "c_clear() (psi4.core.jk method)": [[92, "psi4.core.JK.C_clear", false]], "c_functional() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.c_functional", false]], "c_functionals() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.c_functionals", false]], "c_left_add() (psi4.core.jk method)": [[92, "psi4.core.JK.C_left_add", false]], "c_omega() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.c_omega", false]], "c_os_alpha() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.c_os_alpha", false]], "c_right_add() (psi4.core.jk method)": [[92, "psi4.core.JK.C_right_add", false]], "c_ss_alpha() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.c_ss_alpha", false]], "ca() (psi4.core.sadguess method)": [[131, "psi4.core.SADGuess.Ca", false]], "ca() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.Ca", false]], "ca_subset() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.Ca_subset", false]], "cachelevel (ccdensity)": [[1704, "term-CACHELEVEL-CCDENSITY", true]], "cachelevel (ccenergy)": [[1704, "term-CACHELEVEL-CCENERGY", true]], "cachelevel (cceom)": [[1704, "term-CACHELEVEL-CCEOM", true]], "cachelevel (cchbar)": [[1704, "term-CACHELEVEL-CCHBAR", true]], "cachelevel (cclambda)": [[1704, "term-CACHELEVEL-CCLAMBDA", true]], "cachelevel (ccresponse)": [[1704, "term-CACHELEVEL-CCRESPONSE", true]], "cachelevel (cctransort)": [[1704, "term-CACHELEVEL-CCTRANSORT", true]], "cachelevel (dct)": [[1704, "term-CACHELEVEL-DCT", true]], "cachelevel (occ)": [[1704, "term-CACHELEVEL-OCC", true]], "cachetype (ccenergy)": [[1704, "term-CACHETYPE-CCENERGY", true]], "cachetype (cceom)": [[1704, "term-CACHETYPE-CCEOM", true]], "calc_s_squared (detci)": [[1704, "term-CALC_S_SQUARED-DETCI", true]], "canonicalize_active_favg (mcscf)": [[1704, "term-CANONICALIZE_ACTIVE_FAVG-MCSCF", true]], "canonicalize_inactive_favg (mcscf)": [[1704, "term-CANONICALIZE_INACTIVE_FAVG-MCSCF", true]], "cart_hess_read (optking)": [[1704, "term-CART_HESS_READ-OPTKING", true]], "cartesian (psi4.core.gaussiantype attribute)": [[82, "psi4.core.GaussianType.Cartesian", false]], "cartesian_sym_tolerance (optking)": [[1704, "term-CARTESIAN_SYM_TOLERANCE-OPTKING", true]], "cb() (psi4.core.sadguess method)": [[131, "psi4.core.SADGuess.Cb", false]], "cb() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.Cb", false]], "cb_subset() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.Cb_subset", false]], "cbs correlation energy": [[1776, "psivar-CBS-CORRELATION-ENERGY", false]], "cbs number": [[1776, "psivar-CBS-NUMBER", false]], "cbs reference energy": [[1776, "psivar-CBS-REFERENCE-ENERGY", false]], "cbs total energy": [[1776, "psivar-CBS-TOTAL-ENERGY", false]], "cbs()": [[284, "index-0", false], [1740, "index-0", false], [1740, "index-1", false], [1740, "index-2", false], [1740, "index-3", false], [1741, "index-0", false]], "cbs() (in module psi4.driver)": [[284, "psi4.driver.cbs", false]], "cbsrec (psi4.driver.driver_cbs.compositecomputer attribute)": [[1740, "psi4.driver.driver_cbs.CompositeComputer.cbsrec", false]], "cc": [[1742, "index-0", false]], "cc (detci)": [[1704, "term-CC-DETCI", true]], "cc alpha-alpha pair energies": [[1776, "psivar-CC-ALPHA-ALPHA-PAIR-ENERGIES", false]], "cc alpha-beta pair energies": [[1776, "psivar-CC-ALPHA-BETA-PAIR-ENERGIES", false]], "cc correlation energy": [[1776, "psivar-CC-CORRELATION-ENERGY", false]], "cc correlation kinetic energy": [[1776, "psivar-CC-CORRELATION-KINETIC-ENERGY", false]], "cc correlation potential energy": [[1776, "psivar-CC-CORRELATION-POTENTIAL-ENERGY", false]], "cc correlation virial ratio": [[1776, "psivar-CC-CORRELATION-VIRIAL-RATIO", false]], "cc d1 diagnostic": [[1776, "psivar-CC-D1-DIAGNOSTIC", false]], "cc d2 diagnostic": [[1776, "psivar-CC-D2-DIAGNOSTIC", false]], "cc dipole": [[1776, "psivar-CC-DIPOLE", false]], "cc new d1 diagnostic": [[1776, "psivar-CC-NEW-D1-DIAGNOSTIC", false]], "cc singlet pair energies": [[1776, "psivar-CC-SINGLET-PAIR-ENERGIES", false]], "cc t1 diagnostic": [[1776, "psivar-CC-T1-DIAGNOSTIC", false]], "cc total energy": [[1776, "psivar-CC-TOTAL-ENERGY", false]], "cc triplet pair energies": [[1776, "psivar-CC-TRIPLET-PAIR-ENERGIES", false]], "cc virial ratio": [[1776, "psivar-CC-VIRIAL-RATIO", false]], "cc(n-1)(n) correlation energy": [[1776, "psivar-CC-n-1-n-CORRELATION-ENERGY", false]], "cc(n-1)(n) total energy": [[1776, "psivar-CC-n-1-n-TOTAL-ENERGY", false]], "cc(n-1)(n)_l correlation energy": [[1776, "psivar-CC-n-1-n-_L-CORRELATION-ENERGY", false]], "cc(n-1)(n)_l total energy": [[1776, "psivar-CC-n-1-n-_L-TOTAL-ENERGY", false]], "cc, coupled cluster": [[1742, "index-0", false]], "cc2 alpha-alpha pair energies": [[1776, "psivar-CC2-ALPHA-ALPHA-PAIR-ENERGIES", false]], "cc2 alpha-beta pair energies": [[1776, "psivar-CC2-ALPHA-BETA-PAIR-ENERGIES", false]], "cc2 correlation energy": [[1776, "psivar-CC2-CORRELATION-ENERGY", false]], "cc2 dipole polarizability @ xnm": [[1776, "psivar-CC2-DIPOLE-POLARIZABILITY-xNM", false]], "cc2 dipole polarizability tensor @ xnm": [[1776, "psivar-CC2-DIPOLE-POLARIZABILITY-TENSOR-xNM", false]], "cc2 quadrupole polarizability @ xnm": [[1776, "psivar-CC2-QUADRUPOLE-POLARIZABILITY-xNM", false]], "cc2 quadrupole polarizability tensor @ xnm": [[1776, "psivar-CC2-QUADRUPOLE-POLARIZABILITY-TENSOR-xNM", false]], "cc2 rotation (len) origin-dependence @ xnm": [[1776, "psivar-CC2-ROTATION-LEN-ORIGIN-DEPENDENCE-xNM", false]], "cc2 singlet pair energies": [[1776, "psivar-CC2-SINGLET-PAIR-ENERGIES", false]], "cc2 specific rotation (len) @ xnm": [[1776, "psivar-CC2-SPECIFIC-ROTATION-LEN-xNM", false]], "cc2 specific rotation (mvg) @ xnm": [[1776, "psivar-CC2-SPECIFIC-ROTATION-MVG-xNM", false]], "cc2 specific rotation (vel) @ xnm": [[1776, "psivar-CC2-SPECIFIC-ROTATION-VEL-xNM", false]], "cc2 total energy": [[1776, "psivar-CC2-TOTAL-ENERGY", false]], "cc2 triplet pair energies": [[1776, "psivar-CC2-TRIPLET-PAIR-ENERGIES", false]], "cc3 alpha-alpha pair energies": [[1776, "psivar-CC3-ALPHA-ALPHA-PAIR-ENERGIES", false]], "cc3 alpha-beta pair energies": [[1776, "psivar-CC3-ALPHA-BETA-PAIR-ENERGIES", false]], "cc3 correlation energy": [[1776, "psivar-CC3-CORRELATION-ENERGY", false]], "cc3 singlet pair energies": [[1776, "psivar-CC3-SINGLET-PAIR-ENERGIES", false]], "cc3 total energy": [[1776, "psivar-CC3-TOTAL-ENERGY", false]], "cc3 triplet pair energies": [[1776, "psivar-CC3-TRIPLET-PAIR-ENERGIES", false]], "cc3_follow_root (cceom)": [[1704, "term-CC3_FOLLOW_ROOT-CCEOM", true]], "cc4 correlation energy": [[1776, "psivar-CC4-CORRELATION-ENERGY", false]], "cc4 total energy": [[1776, "psivar-CC4-TOTAL-ENERGY", false]], "cc_a_ras3_max (detci)": [[1704, "term-CC_A_RAS3_MAX-DETCI", true]], "cc_b_ras3_max (detci)": [[1704, "term-CC_B_RAS3_MAX-DETCI", true]], "cc_diis_max_vecs (dfocc)": [[1704, "term-CC_DIIS_MAX_VECS-DFOCC", true]], "cc_diis_min_vecs (dfocc)": [[1704, "term-CC_DIIS_MIN_VECS-DFOCC", true]], "cc_ex_level (detci)": [[1704, "term-CC_EX_LEVEL-DETCI", true]], "cc_fix_external (detci)": [[1704, "term-CC_FIX_EXTERNAL-DETCI", true]], "cc_fix_external_min (detci)": [[1704, "term-CC_FIX_EXTERNAL_MIN-DETCI", true]], "cc_lambda (dfocc)": [[1704, "term-CC_LAMBDA-DFOCC", true]], "cc_macro (detci)": [[1704, "term-CC_MACRO-DETCI", true]], "cc_maxiter (dfocc)": [[1704, "term-CC_MAXITER-DFOCC", true]], "cc_maxiter (occ)": [[1704, "term-CC_MAXITER-OCC", true]], "cc_mixed (detci)": [[1704, "term-CC_MIXED-DETCI", true]], "cc_num_threads (ccenergy)": [[1704, "term-CC_NUM_THREADS-CCENERGY", true]], "cc_num_threads (cceom)": [[1704, "term-CC_NUM_THREADS-CCEOM", true]], "cc_num_threads (cctriples)": [[1704, "term-CC_NUM_THREADS-CCTRIPLES", true]], "cc_num_threads (psimrcc)": [[1704, "term-CC_NUM_THREADS-PSIMRCC", true]], "cc_os_scale (ccenergy)": [[1704, "term-CC_OS_SCALE-CCENERGY", true]], "cc_ras34_max (detci)": [[1704, "term-CC_RAS34_MAX-DETCI", true]], "cc_ras3_max (detci)": [[1704, "term-CC_RAS3_MAX-DETCI", true]], "cc_ras4_max (detci)": [[1704, "term-CC_RAS4_MAX-DETCI", true]], "cc_scale_os (fnocc)": [[1704, "term-CC_SCALE_OS-FNOCC", true]], "cc_scale_ss (fnocc)": [[1704, "term-CC_SCALE_SS-FNOCC", true]], "cc_ss_scale (ccenergy)": [[1704, "term-CC_SS_SCALE-CCENERGY", true]], "cc_timings (fnocc)": [[1704, "term-CC_TIMINGS-FNOCC", true]], "cc_type (globals)": [[1704, "term-CC_TYPE-GLOBALS", true]], "cc_update_eps (detci)": [[1704, "term-CC_UPDATE_EPS-DETCI", true]], "cc_val_ex_level (detci)": [[1704, "term-CC_VAL_EX_LEVEL-DETCI", true]], "cc_variational (detci)": [[1704, "term-CC_VARIATIONAL-DETCI", true]], "cc_vecs_read (detci)": [[1704, "term-CC_VECS_READ-DETCI", true]], "cc_vecs_write (detci)": [[1704, "term-CC_VECS_WRITE-DETCI", true]], "ccd correlation energy": [[1776, "psivar-CCD-CORRELATION-ENERGY", false]], "ccd doubles energy": [[1776, "psivar-CCD-DOUBLES-ENERGY", false]], "ccd opposite-spin correlation energy": [[1776, "psivar-CCD-OPPOSITE-SPIN-CORRELATION-ENERGY", false]], "ccd same-spin correlation energy": [[1776, "psivar-CCD-SAME-SPIN-CORRELATION-ENERGY", false]], "ccd singles energy": [[1776, "psivar-CCD-SINGLES-ENERGY", false]], "ccd total energy": [[1776, "psivar-CCD-TOTAL-ENERGY", false]], "ccd_e_convergence (sapt)": [[1704, "term-CCD_E_CONVERGENCE-SAPT", true]], "ccd_maxiter (sapt)": [[1704, "term-CCD_MAXITER-SAPT", true]], "ccd_t_convergence (sapt)": [[1704, "term-CCD_T_CONVERGENCE-SAPT", true]], "ccdensity() (in module psi4.core)": [[160, "psi4.core.ccdensity", false]], "ccenergy() (in module psi4.core)": [[161, "psi4.core.ccenergy", false]], "cceom() (in module psi4.core)": [[162, "psi4.core.cceom", false]], "cchbar() (in module psi4.core)": [[163, "psi4.core.cchbar", false]], "ccl_energy (occ)": [[1704, "term-CCL_ENERGY-OCC", true]], "cclambda() (in module psi4.core)": [[164, "psi4.core.cclambda", false]], "ccn correlation energy": [[1776, "psivar-CCn-CORRELATION-ENERGY", false]], "ccn total energy": [[1776, "psivar-CCn-TOTAL-ENERGY", false]], "ccn-1a correlation energy": [[1776, "psivar-CCn-1a-CORRELATION-ENERGY", false]], "ccn-1a total energy": [[1776, "psivar-CCn-1a-TOTAL-ENERGY", false]], "ccn-1b correlation energy": [[1776, "psivar-CCn-1b-CORRELATION-ENERGY", false]], "ccn-1b total energy": [[1776, "psivar-CCn-1b-TOTAL-ENERGY", false]], "ccn-3 correlation energy": [[1776, "psivar-CCn-3-CORRELATION-ENERGY", false]], "ccn-3 total energy": [[1776, "psivar-CCn-3-TOTAL-ENERGY", false]], "ccname root m (h) -> root n (i) einstein a (len)": [[1776, "psivar-CCname-ROOT-m-h-ROOT-n-i-EINSTEIN-A-LEN", false]], "ccname root m (h) -> root n (i) einstein b (len)": [[1776, "psivar-CCname-ROOT-m-h-ROOT-n-i-EINSTEIN-B-LEN", false]], "ccname root m (h) -> root n (i) oscillator strength (len)": [[1776, "psivar-CCname-ROOT-m-h-ROOT-n-i-OSCILLATOR-STRENGTH-LEN", false]], "ccname root m (h) -> root n (i) rotatory strength (len)": [[1776, "psivar-CCname-ROOT-m-h-ROOT-n-i-ROTATORY-STRENGTH-LEN", false]], "ccname root m (h) -> root n (i) rotatory strength (vel)": [[1776, "psivar-CCname-ROOT-m-h-ROOT-n-i-ROTATORY-STRENGTH-VEL", false]], "ccname root m (in h) -> root n (in i) einstein a (len)": [[1776, "psivar-CCname-ROOT-m-IN-h-ROOT-n-IN-i-EINSTEIN-A-LEN", false]], "ccname root m (in h) -> root n (in i) einstein b (len)": [[1776, "psivar-CCname-ROOT-m-IN-h-ROOT-n-IN-i-EINSTEIN-B-LEN", false]], "ccname root m (in h) -> root n (in i) oscillator strength (len)": [[1776, "psivar-CCname-ROOT-m-IN-h-ROOT-n-IN-i-OSCILLATOR-STRENGTH-LEN", false]], "ccname root m (in h) -> root n (in i) rotatory strength (len)": [[1776, "psivar-CCname-ROOT-m-IN-h-ROOT-n-IN-i-ROTATORY-STRENGTH-LEN", false]], "ccname root m (in h) -> root n (in i) rotatory strength (vel)": [[1776, "psivar-CCname-ROOT-m-IN-h-ROOT-n-IN-i-ROTATORY-STRENGTH-VEL", false]], "ccname root m -> root n einstein a (len)": [[1776, "psivar-CCname-ROOT-m-ROOT-n-EINSTEIN-A-LEN", false]], "ccname root m -> root n einstein a (len) - h transition": [[1776, "psivar-CCname-ROOT-m-ROOT-n-EINSTEIN-A-LEN-h-TRANSITION", false]], "ccname root m -> root n einstein b (len)": [[1776, "psivar-CCname-ROOT-m-ROOT-n-EINSTEIN-B-LEN", false]], "ccname root m -> root n einstein b (len) - h transition": [[1776, "psivar-CCname-ROOT-m-ROOT-n-EINSTEIN-B-LEN-h-TRANSITION", false]], "ccname root m -> root n oscillator strength (len)": [[1776, "psivar-CCname-ROOT-m-ROOT-n-OSCILLATOR-STRENGTH-LEN", false]], "ccname root m -> root n oscillator strength (len) - h transition": [[1776, "psivar-CCname-ROOT-m-ROOT-n-OSCILLATOR-STRENGTH-LEN-h-TRANSITION", false]], "ccname root m -> root n rotatory strength (len)": [[1776, "psivar-CCname-ROOT-m-ROOT-n-ROTATORY-STRENGTH-LEN", false]], "ccname root m -> root n rotatory strength (len) - h transition": [[1776, "psivar-CCname-ROOT-m-ROOT-n-ROTATORY-STRENGTH-LEN-h-TRANSITION", false]], "ccname root m -> root n rotatory strength (vel)": [[1776, "psivar-CCname-ROOT-m-ROOT-n-ROTATORY-STRENGTH-VEL", false]], "ccname root m -> root n rotatory strength (vel) - h transition": [[1776, "psivar-CCname-ROOT-m-ROOT-n-ROTATORY-STRENGTH-VEL-h-TRANSITION", false]], "ccname root n (h) correlation energy": [[1776, "psivar-CCname-ROOT-n-h-CORRELATION-ENERGY", false]], "ccname root n (h) dipole": [[1776, "psivar-CCname-ROOT-n-h-DIPOLE", false]], "ccname root n (h) quadrupole": [[1776, "psivar-CCname-ROOT-n-h-QUADRUPOLE", false]], "ccname root n (h) total energy": [[1776, "psivar-CCname-ROOT-n-h-TOTAL-ENERGY", false]], "ccname root n (in h) correlation energy": [[1776, "psivar-CCname-ROOT-n-IN-h-CORRELATION-ENERGY", false]], "ccname root n (in h) dipole": [[1776, "psivar-CCname-ROOT-n-IN-h-DIPOLE", false]], "ccname root n (in h) quadrupole": [[1776, "psivar-CCname-ROOT-n-IN-h-QUADRUPOLE", false]], "ccname root n (in h) total energy": [[1776, "psivar-CCname-ROOT-n-IN-h-TOTAL-ENERGY", false]], "ccname root n correlation energy": [[1776, "psivar-CCname-ROOT-n-CORRELATION-ENERGY", false]], "ccname root n correlation energy - h transition": [[1776, "psivar-CCname-ROOT-n-CORRELATION-ENERGY-h-TRANSITION", false]], "ccname root n dipole": [[1776, "psivar-CCname-ROOT-n-DIPOLE", false]], "ccname root n dipole - h transition": [[1776, "psivar-CCname-ROOT-n-DIPOLE-h-TRANSITION", false]], "ccname root n quadrupole": [[1776, "psivar-CCname-ROOT-n-QUADRUPOLE", false]], "ccname root n quadrupole - h transition": [[1776, "psivar-CCname-ROOT-n-QUADRUPOLE-h-TRANSITION", false]], "ccname root n total energy": [[1776, "psivar-CCname-ROOT-n-TOTAL-ENERGY", false]], "ccname root n total energy - h transition": [[1776, "psivar-CCname-ROOT-n-TOTAL-ENERGY-h-TRANSITION", false]], "ccnn correlation energy": [[1776, "psivar-CCnn-CORRELATION-ENERGY", false]], "ccnn total energy": [[1776, "psivar-CCnn-TOTAL-ENERGY", false]], "ccresponse() (in module psi4.core)": [[165, "psi4.core.ccresponse", false]], "ccsd alpha-alpha pair energies": [[1776, "psivar-CCSD-ALPHA-ALPHA-PAIR-ENERGIES", false]], "ccsd alpha-beta pair energies": [[1776, "psivar-CCSD-ALPHA-BETA-PAIR-ENERGIES", false]], "ccsd correlation energy": [[1776, "psivar-CCSD-CORRELATION-ENERGY", false]], "ccsd dipole polarizability @ xnm": [[1776, "psivar-CCSD-DIPOLE-POLARIZABILITY-xNM", false]], "ccsd dipole polarizability tensor @ xnm": [[1776, "psivar-CCSD-DIPOLE-POLARIZABILITY-TENSOR-xNM", false]], "ccsd doubles energy": [[1776, "psivar-CCSD-DOUBLES-ENERGY", false]], "ccsd iterations": [[1776, "psivar-CCSD-ITERATIONS", false]], "ccsd opposite-spin correlation energy": [[1776, "psivar-CCSD-OPPOSITE-SPIN-CORRELATION-ENERGY", false]], "ccsd quadrupole polarizability @ xnm": [[1776, "psivar-CCSD-QUADRUPOLE-POLARIZABILITY-xNM", false]], "ccsd quadrupole polarizability tensor @ xnm": [[1776, "psivar-CCSD-QUADRUPOLE-POLARIZABILITY-TENSOR-xNM", false]], "ccsd rotation (len) origin-dependence @ xnm": [[1776, "psivar-CCSD-ROTATION-LEN-ORIGIN-DEPENDENCE-xNM", false]], "ccsd same-spin correlation energy": [[1776, "psivar-CCSD-SAME-SPIN-CORRELATION-ENERGY", false]], "ccsd singles energy": [[1776, "psivar-CCSD-SINGLES-ENERGY", false]], "ccsd singlet pair energies": [[1776, "psivar-CCSD-SINGLET-PAIR-ENERGIES", false]], "ccsd specific rotation (len) @ xnm": [[1776, "psivar-CCSD-SPECIFIC-ROTATION-LEN-xNM", false]], "ccsd specific rotation (mvg) @ xnm": [[1776, "psivar-CCSD-SPECIFIC-ROTATION-MVG-xNM", false]], "ccsd specific rotation (vel) @ xnm": [[1776, "psivar-CCSD-SPECIFIC-ROTATION-VEL-xNM", false]], "ccsd total energy": [[1776, "psivar-CCSD-TOTAL-ENERGY", false]], "ccsd triplet pair energies": [[1776, "psivar-CCSD-TRIPLET-PAIR-ENERGIES", false]], "ccsd(at) correlation energy": [[1776, "psivar-CCSD-AT-CORRELATION-ENERGY", false]], "ccsd(at) total energy": [[1776, "psivar-CCSD-AT-TOTAL-ENERGY", false]], "ccsd(t)": [[1771, "index-1", false]], "ccsd(t) correlation energy": [[1776, "psivar-CCSD-T-CORRELATION-ENERGY", false]], "ccsd(t) total energy": [[1776, "psivar-CCSD-T-TOTAL-ENERGY", false]], "ccsd(t)_l correlation energy": [[1776, "psivar-CCSD-T-_L-CORRELATION-ENERGY", false]], "ccsd(t)_l total energy": [[1776, "psivar-CCSD-T-_L-TOTAL-ENERGY", false]], "ccsdt correlation energy": [[1776, "psivar-CCSDT-CORRELATION-ENERGY", false]], "ccsdt total energy": [[1776, "psivar-CCSDT-TOTAL-ENERGY", false]], "ccsdt(q) correlation energy": [[1776, "psivar-CCSDT-Q-CORRELATION-ENERGY", false]], "ccsdt(q) total energy": [[1776, "psivar-CCSDT-Q-TOTAL-ENERGY", false]], "ccsdt(q)/a correlation energy": [[1776, "psivar-CCSDT-Q-A-CORRELATION-ENERGY", false]], "ccsdt(q)/a total energy": [[1776, "psivar-CCSDT-Q-A-TOTAL-ENERGY", false]], "ccsdt(q)/b correlation energy": [[1776, "psivar-CCSDT-Q-B-CORRELATION-ENERGY", false]], "ccsdt(q)/b total energy": [[1776, "psivar-CCSDT-Q-B-TOTAL-ENERGY", false]], "ccsdt(q)_l correlation energy": [[1776, "psivar-CCSDT-Q-_L-CORRELATION-ENERGY", false]], "ccsdt(q)_l total energy": [[1776, "psivar-CCSDT-Q-_L-TOTAL-ENERGY", false]], "ccsdt-1a correlation energy": [[1776, "psivar-CCSDT-1a-CORRELATION-ENERGY", false]], "ccsdt-1a total energy": [[1776, "psivar-CCSDT-1a-TOTAL-ENERGY", false]], "ccsdt-1b correlation energy": [[1776, "psivar-CCSDT-1b-CORRELATION-ENERGY", false]], "ccsdt-1b total energy": [[1776, "psivar-CCSDT-1b-TOTAL-ENERGY", false]], "ccsdt-3 correlation energy": [[1776, "psivar-CCSDT-3-CORRELATION-ENERGY", false]], "ccsdt-3 total energy": [[1776, "psivar-CCSDT-3-TOTAL-ENERGY", false]], "ccsdtq correlation energy": [[1776, "psivar-CCSDTQ-CORRELATION-ENERGY", false]], "ccsdtq total energy": [[1776, "psivar-CCSDTQ-TOTAL-ENERGY", false]], "ccsdtq-1a correlation energy": [[1776, "psivar-CCSDTQ-1a-CORRELATION-ENERGY", false]], "ccsdtq-1a total energy": [[1776, "psivar-CCSDTQ-1a-TOTAL-ENERGY", false]], "ccsdtq-1b correlation energy": [[1776, "psivar-CCSDTQ-1b-CORRELATION-ENERGY", false]], "ccsdtq-1b total energy": [[1776, "psivar-CCSDTQ-1b-TOTAL-ENERGY", false]], "ccsdtq-3 correlation energy": [[1776, "psivar-CCSDTQ-3-CORRELATION-ENERGY", false]], "ccsdtq-3 total energy": [[1776, "psivar-CCSDTQ-3-TOTAL-ENERGY", false]], "cctransort() (in module psi4.core)": [[166, "psi4.core.cctransort", false]], "cctriples() (in module psi4.core)": [[167, "psi4.core.cctriples", false]], "ccwavefunction (class in psi4.core)": [[11, "psi4.core.CCWavefunction", false]], "cdsalc (class in psi4.core)": [[15, "psi4.core.CdSalc", false]], "cdsalclist (class in psi4.core)": [[16, "psi4.core.CdSalcList", false]], "cdsalcs() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.cdsalcs", false]], "center_of_mass() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.center_of_mass", false]], "cepa": [[1771, "index-1", false]], "cepa(0) correlation energy": [[1776, "psivar-CEPA-0-CORRELATION-ENERGY", false]], "cepa(0) dipole": [[1776, "psivar-CEPA-0-DIPOLE", false]], "cepa(0) doubles energy": [[1776, "psivar-CEPA-0-DOUBLES-ENERGY", false]], "cepa(0) opposite-spin correlation energy": [[1776, "psivar-CEPA-0-OPPOSITE-SPIN-CORRELATION-ENERGY", false]], "cepa(0) quadrupole": [[1776, "psivar-CEPA-0-QUADRUPOLE", false]], "cepa(0) same-spin correlation energy": [[1776, "psivar-CEPA-0-SAME-SPIN-CORRELATION-ENERGY", false]], "cepa(0) singles energy": [[1776, "psivar-CEPA-0-SINGLES-ENERGY", false]], "cepa(0) total energy": [[1776, "psivar-CEPA-0-TOTAL-ENERGY", false]], "cepa(1) correlation energy": [[1776, "psivar-CEPA-1-CORRELATION-ENERGY", false]], "cepa(1) doubles energy": [[1776, "psivar-CEPA-1-DOUBLES-ENERGY", false]], "cepa(1) opposite-spin correlation energy": [[1776, "psivar-CEPA-1-OPPOSITE-SPIN-CORRELATION-ENERGY", false]], "cepa(1) same-spin correlation energy": [[1776, "psivar-CEPA-1-SAME-SPIN-CORRELATION-ENERGY", false]], "cepa(1) singles energy": [[1776, "psivar-CEPA-1-SINGLES-ENERGY", false]], "cepa(1) total energy": [[1776, "psivar-CEPA-1-TOTAL-ENERGY", false]], "cepa(2) correlation energy": [[1776, "psivar-CEPA-2-CORRELATION-ENERGY", false]], "cepa(2) doubles energy": [[1776, "psivar-CEPA-2-DOUBLES-ENERGY", false]], "cepa(2) opposite-spin correlation energy": [[1776, "psivar-CEPA-2-OPPOSITE-SPIN-CORRELATION-ENERGY", false]], "cepa(2) same-spin correlation energy": [[1776, "psivar-CEPA-2-SAME-SPIN-CORRELATION-ENERGY", false]], "cepa(2) singles energy": [[1776, "psivar-CEPA-2-SINGLES-ENERGY", false]], "cepa(2) total energy": [[1776, "psivar-CEPA-2-TOTAL-ENERGY", false]], "cepa(3) correlation energy": [[1776, "psivar-CEPA-3-CORRELATION-ENERGY", false]], "cepa(3) doubles energy": [[1776, "psivar-CEPA-3-DOUBLES-ENERGY", false]], "cepa(3) opposite-spin correlation energy": [[1776, "psivar-CEPA-3-OPPOSITE-SPIN-CORRELATION-ENERGY", false]], "cepa(3) same-spin correlation energy": [[1776, "psivar-CEPA-3-SAME-SPIN-CORRELATION-ENERGY", false]], "cepa(3) singles energy": [[1776, "psivar-CEPA-3-SINGLES-ENERGY", false]], "cepa(3) total energy": [[1776, "psivar-CEPA-3-TOTAL-ENERGY", false]], "cepa_level (fnocc)": [[1704, "term-CEPA_LEVEL-FNOCC", true]], "cepa_no_singles (fnocc)": [[1704, "term-CEPA_NO_SINGLES-FNOCC", true]], "cepa_os_scale (occ)": [[1704, "term-CEPA_OS_SCALE-OCC", true]], "cepa_sos_scale (occ)": [[1704, "term-CEPA_SOS_SCALE-OCC", true]], "cepa_ss_scale (occ)": [[1704, "term-CEPA_SS_SCALE-OCC", true]], "cepa_type (occ)": [[1704, "term-CEPA_TYPE-OCC", true]], "cfour": [[1743, "index-0", false]], "cfour error code": [[1776, "psivar-CFOUR-ERROR-CODE", false]], "cfour_abcdtype (cfour)": [[1704, "term-CFOUR_ABCDTYPE-CFOUR", true]], "cfour_active_orbi (cfour)": [[1704, "term-CFOUR_ACTIVE_ORBI-CFOUR", true]], "cfour_anh_algorithm (cfour)": [[1704, "term-CFOUR_ANH_ALGORITHM-CFOUR", true]], "cfour_anh_derivatives (cfour)": [[1704, "term-CFOUR_ANH_DERIVATIVES-CFOUR", true]], "cfour_anh_stepsize (cfour)": [[1704, "term-CFOUR_ANH_STEPSIZE-CFOUR", true]], "cfour_anh_symmetry (cfour)": [[1704, "term-CFOUR_ANH_SYMMETRY-CFOUR", true]], "cfour_anharmonic (cfour)": [[1704, "term-CFOUR_ANHARMONIC-CFOUR", true]], "cfour_ao_ladders (cfour)": [[1704, "term-CFOUR_AO_LADDERS-CFOUR", true]], "cfour_av_scf (cfour)": [[1704, "term-CFOUR_AV_SCF-CFOUR", true]], "cfour_basis (cfour)": [[1704, "term-CFOUR_BASIS-CFOUR", true]], "cfour_bruck_conv (cfour)": [[1704, "term-CFOUR_BRUCK_CONV-CFOUR", true]], "cfour_brueckner (cfour)": [[1704, "term-CFOUR_BRUECKNER-CFOUR", true]], "cfour_cache_recs (cfour)": [[1704, "term-CFOUR_CACHE_RECS-CFOUR", true]], "cfour_calc_level (cfour)": [[1704, "term-CFOUR_CALC_LEVEL-CFOUR", true]], "cfour_cc_conv (cfour)": [[1704, "term-CFOUR_CC_CONV-CFOUR", true]], "cfour_cc_exporder (cfour)": [[1704, "term-CFOUR_CC_EXPORDER-CFOUR", true]], "cfour_cc_extrapolation (cfour)": [[1704, "term-CFOUR_CC_EXTRAPOLATION-CFOUR", true]], "cfour_cc_maxcyc (cfour)": [[1704, "term-CFOUR_CC_MAXCYC-CFOUR", true]], "cfour_cc_program (cfour)": [[1704, "term-CFOUR_CC_PROGRAM-CFOUR", true]], "cfour_charge (cfour)": [[1704, "term-CFOUR_CHARGE-CFOUR", true]], "cfour_cis_conv (cfour)": [[1704, "term-CFOUR_CIS_CONV-CFOUR", true]], "cfour_continuum (cfour)": [[1704, "term-CFOUR_CONTINUUM-CFOUR", true]], "cfour_contraction (cfour)": [[1704, "term-CFOUR_CONTRACTION-CFOUR", true]], "cfour_convergence (cfour)": [[1704, "term-CFOUR_CONVERGENCE-CFOUR", true]], "cfour_coordinates (cfour)": [[1704, "term-CFOUR_COORDINATES-CFOUR", true]], "cfour_core_orbitals (cfour)": [[1704, "term-CFOUR_CORE_ORBITALS-CFOUR", true]], "cfour_cphf_conver (cfour)": [[1704, "term-CFOUR_CPHF_CONVER-CFOUR", true]], "cfour_cphf_maxcyc (cfour)": [[1704, "term-CFOUR_CPHF_MAXCYC-CFOUR", true]], "cfour_curvilinear (cfour)": [[1704, "term-CFOUR_CURVILINEAR-CFOUR", true]], "cfour_dboc (cfour)": [[1704, "term-CFOUR_DBOC-CFOUR", true]], "cfour_dct (cfour)": [[1704, "term-CFOUR_DCT-CFOUR", true]], "cfour_deriv_level (cfour)": [[1704, "term-CFOUR_DERIV_LEVEL-CFOUR", true]], "cfour_diff_type (cfour)": [[1704, "term-CFOUR_DIFF_TYPE-CFOUR", true]], "cfour_dropmo (cfour)": [[1704, "term-CFOUR_DROPMO-CFOUR", true]], "cfour_ecp (cfour)": [[1704, "term-CFOUR_ECP-CFOUR", true]], "cfour_eigenvector (cfour)": [[1704, "term-CFOUR_EIGENVECTOR-CFOUR", true]], "cfour_el_anharm (cfour)": [[1704, "term-CFOUR_EL_ANHARM-CFOUR", true]], "cfour_eom_nonit (cfour)": [[1704, "term-CFOUR_EOM_NONIT-CFOUR", true]], "cfour_estate_conv (cfour)": [[1704, "term-CFOUR_ESTATE_CONV-CFOUR", true]], "cfour_estate_maxcyc (cfour)": [[1704, "term-CFOUR_ESTATE_MAXCYC-CFOUR", true]], "cfour_estate_prop (cfour)": [[1704, "term-CFOUR_ESTATE_PROP-CFOUR", true]], "cfour_estate_sym (cfour)": [[1704, "term-CFOUR_ESTATE_SYM-CFOUR", true]], "cfour_estate_trans (cfour)": [[1704, "term-CFOUR_ESTATE_TRANS-CFOUR", true]], "cfour_eval_hess (cfour)": [[1704, "term-CFOUR_EVAL_HESS-CFOUR", true]], "cfour_excitation (cfour)": [[1704, "term-CFOUR_EXCITATION-CFOUR", true]], "cfour_excite (cfour)": [[1704, "term-CFOUR_EXCITE-CFOUR", true]], "cfour_fc_field (cfour)": [[1704, "term-CFOUR_FC_FIELD-CFOUR", true]], "cfour_fd_calctype (cfour)": [[1704, "term-CFOUR_FD_CALCTYPE-CFOUR", true]], "cfour_fd_irreps (cfour)": [[1704, "term-CFOUR_FD_IRREPS-CFOUR", true]], "cfour_fd_project (cfour)": [[1704, "term-CFOUR_FD_PROJECT-CFOUR", true]], "cfour_fd_stepsize (cfour)": [[1704, "term-CFOUR_FD_STEPSIZE-CFOUR", true]], "cfour_fd_usegroup (cfour)": [[1704, "term-CFOUR_FD_USEGROUP-CFOUR", true]], "cfour_file_recsiz (cfour)": [[1704, "term-CFOUR_FILE_RECSIZ-CFOUR", true]], "cfour_file_stripe (cfour)": [[1704, "term-CFOUR_FILE_STRIPE-CFOUR", true]], "cfour_finite_perturbation (cfour)": [[1704, "term-CFOUR_FINITE_PERTURBATION-CFOUR", true]], "cfour_fock (cfour)": [[1704, "term-CFOUR_FOCK-CFOUR", true]], "cfour_freq_algorithm (cfour)": [[1704, "term-CFOUR_FREQ_ALGORITHM-CFOUR", true]], "cfour_frozen_core (cfour)": [[1704, "term-CFOUR_FROZEN_CORE-CFOUR", true]], "cfour_frozen_virt (cfour)": [[1704, "term-CFOUR_FROZEN_VIRT-CFOUR", true]], "cfour_gamma_abcd (cfour)": [[1704, "term-CFOUR_GAMMA_ABCD-CFOUR", true]], "cfour_genbas_1 (cfour)": [[1704, "term-CFOUR_GENBAS_1-CFOUR", true]], "cfour_genbas_2 (cfour)": [[1704, "term-CFOUR_GENBAS_2-CFOUR", true]], "cfour_genbas_3 (cfour)": [[1704, "term-CFOUR_GENBAS_3-CFOUR", true]], "cfour_genbas_4 (cfour)": [[1704, "term-CFOUR_GENBAS_4-CFOUR", true]], "cfour_geo_conv (cfour)": [[1704, "term-CFOUR_GEO_CONV-CFOUR", true]], "cfour_geo_maxcyc (cfour)": [[1704, "term-CFOUR_GEO_MAXCYC-CFOUR", true]], "cfour_geo_maxstep (cfour)": [[1704, "term-CFOUR_GEO_MAXSTEP-CFOUR", true]], "cfour_geo_method (cfour)": [[1704, "term-CFOUR_GEO_METHOD-CFOUR", true]], "cfour_giao (cfour)": [[1704, "term-CFOUR_GIAO-CFOUR", true]], "cfour_grid (cfour)": [[1704, "term-CFOUR_GRID-CFOUR", true]], "cfour_guess (cfour)": [[1704, "term-CFOUR_GUESS-CFOUR", true]], "cfour_hbar (cfour)": [[1704, "term-CFOUR_HBAR-CFOUR", true]], "cfour_hfstability (cfour)": [[1704, "term-CFOUR_HFSTABILITY-CFOUR", true]], "cfour_incore (cfour)": [[1704, "term-CFOUR_INCORE-CFOUR", true]], "cfour_input_mrcc (cfour)": [[1704, "term-CFOUR_INPUT_MRCC-CFOUR", true]], "cfour_integrals (cfour)": [[1704, "term-CFOUR_INTEGRALS-CFOUR", true]], "cfour_joda_print (cfour)": [[1704, "term-CFOUR_JODA_PRINT-CFOUR", true]], "cfour_lineq_conv (cfour)": [[1704, "term-CFOUR_LINEQ_CONV-CFOUR", true]], "cfour_lineq_maxcy (cfour)": [[1704, "term-CFOUR_LINEQ_MAXCY-CFOUR", true]], "cfour_lineq_type (cfour)": [[1704, "term-CFOUR_LINEQ_TYPE-CFOUR", true]], "cfour_lock_orbocc (cfour)": [[1704, "term-CFOUR_LOCK_ORBOCC-CFOUR", true]], "cfour_maxstep (cfour)": [[1704, "term-CFOUR_MAXSTEP-CFOUR", true]], "cfour_mem_unit (cfour)": [[1704, "term-CFOUR_MEM_UNIT-CFOUR", true]], "cfour_memory_size (cfour)": [[1704, "term-CFOUR_MEMORY_SIZE-CFOUR", true]], "cfour_method (cfour)": [[1704, "term-CFOUR_METHOD-CFOUR", true]], "cfour_mrcc (cfour)": [[1704, "term-CFOUR_MRCC-CFOUR", true]], "cfour_multiplicity (cfour)": [[1704, "term-CFOUR_MULTIPLICITY-CFOUR", true]], "cfour_nacoupling (cfour)": [[1704, "term-CFOUR_NACOUPLING-CFOUR", true]], "cfour_negeval (cfour)": [[1704, "term-CFOUR_NEGEVAL-CFOUR", true]], "cfour_newnorm (cfour)": [[1704, "term-CFOUR_NEWNORM-CFOUR", true]], "cfour_nonhf (cfour)": [[1704, "term-CFOUR_NONHF-CFOUR", true]], "cfour_ntop_tamp (cfour)": [[1704, "term-CFOUR_NTOP_TAMP-CFOUR", true]], "cfour_occupation (cfour)": [[1704, "term-CFOUR_OCCUPATION-CFOUR", true]], "cfour_omp_num_threads (cfour)": [[1704, "term-CFOUR_OMP_NUM_THREADS-CFOUR", true]], "cfour_open-shell (cfour)": [[1704, "term-CFOUR_OPEN-SHELL-CFOUR", true]], "cfour_opt_maxcyc (cfour)": [[1704, "term-CFOUR_OPT_MAXCYC-CFOUR", true]], "cfour_orbitals (cfour)": [[1704, "term-CFOUR_ORBITALS-CFOUR", true]], "cfour_pert_orb (cfour)": [[1704, "term-CFOUR_PERT_ORB-CFOUR", true]], "cfour_points (cfour)": [[1704, "term-CFOUR_POINTS-CFOUR", true]], "cfour_print (cfour)": [[1704, "term-CFOUR_PRINT-CFOUR", true]], "cfour_prop_integral (cfour)": [[1704, "term-CFOUR_PROP_INTEGRAL-CFOUR", true]], "cfour_props (cfour)": [[1704, "term-CFOUR_PROPS-CFOUR", true]], "cfour_qrhf_general (cfour)": [[1704, "term-CFOUR_QRHF_GENERAL-CFOUR", true]], "cfour_qrhf_orbital (cfour)": [[1704, "term-CFOUR_QRHF_ORBITAL-CFOUR", true]], "cfour_qrhfgues (cfour)": [[1704, "term-CFOUR_QRHFGUES-CFOUR", true]], "cfour_raman_int (cfour)": [[1704, "term-CFOUR_RAMAN_INT-CFOUR", true]], "cfour_raman_orb (cfour)": [[1704, "term-CFOUR_RAMAN_ORB-CFOUR", true]], "cfour_rdo (cfour)": [[1704, "term-CFOUR_RDO-CFOUR", true]], "cfour_reference (cfour)": [[1704, "term-CFOUR_REFERENCE-CFOUR", true]], "cfour_relativistic (cfour)": [[1704, "term-CFOUR_RELATIVISTIC-CFOUR", true]], "cfour_relax_dens (cfour)": [[1704, "term-CFOUR_RELAX_DENS-CFOUR", true]], "cfour_res_raman (cfour)": [[1704, "term-CFOUR_RES_RAMAN-CFOUR", true]], "cfour_restart_cc (cfour)": [[1704, "term-CFOUR_RESTART_CC-CFOUR", true]], "cfour_rot_evec (cfour)": [[1704, "term-CFOUR_ROT_EVEC-CFOUR", true]], "cfour_save_ints (cfour)": [[1704, "term-CFOUR_SAVE_INTS-CFOUR", true]], "cfour_scale_on (cfour)": [[1704, "term-CFOUR_SCALE_ON-CFOUR", true]], "cfour_scf_conv (cfour)": [[1704, "term-CFOUR_SCF_CONV-CFOUR", true]], "cfour_scf_damping (cfour)": [[1704, "term-CFOUR_SCF_DAMPING-CFOUR", true]], "cfour_scf_exporder (cfour)": [[1704, "term-CFOUR_SCF_EXPORDER-CFOUR", true]], "cfour_scf_expstart (cfour)": [[1704, "term-CFOUR_SCF_EXPSTART-CFOUR", true]], "cfour_scf_extrapolation (cfour)": [[1704, "term-CFOUR_SCF_EXTRAPOLATION-CFOUR", true]], "cfour_scf_maxcyc (cfour)": [[1704, "term-CFOUR_SCF_MAXCYC-CFOUR", true]], "cfour_sd_field (cfour)": [[1704, "term-CFOUR_SD_FIELD-CFOUR", true]], "cfour_spherical (cfour)": [[1704, "term-CFOUR_SPHERICAL-CFOUR", true]], "cfour_spin_flip (cfour)": [[1704, "term-CFOUR_SPIN_FLIP-CFOUR", true]], "cfour_spin_orbit (cfour)": [[1704, "term-CFOUR_SPIN_ORBIT-CFOUR", true]], "cfour_spin_scal (cfour)": [[1704, "term-CFOUR_SPIN_SCAL-CFOUR", true]], "cfour_spinrotation (cfour)": [[1704, "term-CFOUR_SPINROTATION-CFOUR", true]], "cfour_subgroup (cfour)": [[1704, "term-CFOUR_SUBGROUP-CFOUR", true]], "cfour_sym_check (cfour)": [[1704, "term-CFOUR_SYM_CHECK-CFOUR", true]], "cfour_symmetry (cfour)": [[1704, "term-CFOUR_SYMMETRY-CFOUR", true]], "cfour_t3_extrapol (cfour)": [[1704, "term-CFOUR_T3_EXTRAPOL-CFOUR", true]], "cfour_tamp_sum (cfour)": [[1704, "term-CFOUR_TAMP_SUM-CFOUR", true]], "cfour_thermochemistry (cfour)": [[1704, "term-CFOUR_THERMOCHEMISTRY-CFOUR", true]], "cfour_trans_inv (cfour)": [[1704, "term-CFOUR_TRANS_INV-CFOUR", true]], "cfour_treat_pert (cfour)": [[1704, "term-CFOUR_TREAT_PERT-CFOUR", true]], "cfour_uij_threshold (cfour)": [[1704, "term-CFOUR_UIJ_THRESHOLD-CFOUR", true]], "cfour_units (cfour)": [[1704, "term-CFOUR_UNITS-CFOUR", true]], "cfour_update_hessian (cfour)": [[1704, "term-CFOUR_UPDATE_HESSIAN-CFOUR", true]], "cfour_vibration (cfour)": [[1704, "term-CFOUR_VIBRATION-CFOUR", true]], "cfour_vtran (cfour)": [[1704, "term-CFOUR_VTRAN-CFOUR", true]], "cfour_xfield (cfour)": [[1704, "term-CFOUR_XFIELD-CFOUR", true]], "cfour_xform_tol (cfour)": [[1704, "term-CFOUR_XFORM_TOL-CFOUR", true]], "cfour_yfield (cfour)": [[1704, "term-CFOUR_YFIELD-CFOUR", true]], "cfour_zfield (cfour)": [[1704, "term-CFOUR_ZFIELD-CFOUR", true]], "cg_solver() (in module psi4.driver.p4util)": [[335, "psi4.driver.p4util.cg_solver", false]], "chain_dot() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.chain_dot", false]], "change_file_namespace() (psi4.core.io static method)": [[86, "psi4.core.IO.change_file_namespace", false]], "char_table() (psi4.core.pointgroup method)": [[120, "psi4.core.PointGroup.char_table", false]], "character() (psi4.core.irreduciblerepresentation method)": [[91, "psi4.core.IrreducibleRepresentation.character", false]], "charactertable (class in psi4.core)": [[17, "psi4.core.CharacterTable", false]], "charge": [[1833, "index-2", false]], "charge() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.charge", false]], "charge-transfer": [[1837, "index-4", false]], "check_phases() (psi4.core.hf method)": [[84, "psi4.core.HF.check_phases", false]], "chemps2": [[1746, "index-0", false]], "cholesky (dfocc)": [[1704, "term-CHOLESKY-DFOCC", true]], "cholesky_factorize() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.cholesky_factorize", false]], "cholesky_tolerance (dfocc)": [[1704, "term-CHOLESKY_TOLERANCE-DFOCC", true]], "cholesky_tolerance (fnocc)": [[1704, "term-CHOLESKY_TOLERANCE-FNOCC", true]], "cholesky_tolerance (scf)": [[1704, "term-CHOLESKY_TOLERANCE-SCF", true]], "ci": [[1755, "index-0", false], [1755, "index-1", false], [1755, "index-2", false], [1755, "index-3", false], [1755, "index-4", false], [1755, "index-5", false], [1789, "index-2", false]], "ci correlation energy": [[1776, "psivar-CI-CORRELATION-ENERGY", false]], "ci dipole": [[1776, "psivar-CI-DIPOLE", false]], "ci quadrupole": [[1776, "psivar-CI-QUADRUPOLE", false]], "ci root n -> root m dipole": [[1776, "psivar-CI-ROOT-n-ROOT-m-DIPOLE", false]], "ci root n -> root m quadrupole": [[1776, "psivar-CI-ROOT-n-ROOT-m-QUADRUPOLE", false]], "ci root n correlation energy": [[1776, "psivar-CI-ROOT-n-CORRELATION-ENERGY", false]], "ci root n dipole": [[1776, "psivar-CI-ROOT-n-DIPOLE", false]], "ci root n quadrupole": [[1776, "psivar-CI-ROOT-n-QUADRUPOLE", false]], "ci root n total energy": [[1776, "psivar-CI-ROOT-n-TOTAL-ENERGY", false]], "ci state-averaged correlation energy": [[1776, "psivar-CI-STATE-AVERAGED-CORRELATION-ENERGY", false]], "ci state-averaged total energy": [[1776, "psivar-CI-STATE-AVERAGED-TOTAL-ENERGY", false]], "ci total energy": [[1776, "psivar-CI-TOTAL-ENERGY", false]], "ci_diis (mcscf)": [[1704, "term-CI_DIIS-MCSCF", true]], "ci_file_start (detci)": [[1704, "term-CI_FILE_START-DETCI", true]], "ci_maxiter (detci)": [[1704, "term-CI_MAXITER-DETCI", true]], "ci_nat_orbs() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.ci_nat_orbs", false]], "ci_num_threads (detci)": [[1704, "term-CI_NUM_THREADS-DETCI", true]], "ci_type (globals)": [[1704, "term-CI_TYPE-GLOBALS", true]], "ciblks_print (detci)": [[1704, "term-CIBLKS_PRINT-DETCI", true]], "cin correlation energy": [[1776, "psivar-CIn-CORRELATION-ENERGY", false]], "cin total energy": [[1776, "psivar-CIn-TOTAL-ENERGY", false]], "cisd correlation energy": [[1776, "psivar-CISD-CORRELATION-ENERGY", false]], "cisd dipole": [[1776, "psivar-CISD-DIPOLE", false]], "cisd doubles energy": [[1776, "psivar-CISD-DOUBLES-ENERGY", false]], "cisd opposite-spin correlation energy": [[1776, "psivar-CISD-OPPOSITE-SPIN-CORRELATION-ENERGY", false]], "cisd quadrupole": [[1776, "psivar-CISD-QUADRUPOLE", false]], "cisd same-spin correlation energy": [[1776, "psivar-CISD-SAME-SPIN-CORRELATION-ENERGY", false]], "cisd singles energy": [[1776, "psivar-CISD-SINGLES-ENERGY", false]], "cisd total energy": [[1776, "psivar-CISD-TOTAL-ENERGY", false]], "cisdt correlation energy": [[1776, "psivar-CISDT-CORRELATION-ENERGY", false]], "cisdt total energy": [[1776, "psivar-CISDT-TOTAL-ENERGY", false]], "cisdtq correlation energy": [[1776, "psivar-CISDTQ-CORRELATION-ENERGY", false]], "cisdtq total energy": [[1776, "psivar-CISDTQ-TOTAL-ENERGY", false]], "citation() (psi4.core.dispersion method)": [[68, "psi4.core.Dispersion.citation", false]], "citation() (psi4.core.functional method)": [[80, "psi4.core.Functional.citation", false]], "citation() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.citation", false]], "civector (class in psi4.core)": [[12, "psi4.core.CIVector", false]], "ciwavefunction (class in psi4.core)": [[13, "psi4.core.CIWavefunction", false]], "ck() (psi4.core.somcscf method)": [[133, "psi4.core.SOMCSCF.Ck", false]], "clean() (in module psi4.core)": [[168, "psi4.core.clean", false]], "clean_options() (in module psi4.core)": [[169, "psi4.core.clean_options", false]], "clean_timers() (in module psi4.core)": [[170, "psi4.core.clean_timers", false]], "clean_variables() (in module psi4.core)": [[171, "psi4.core.clean_variables", false]], "cleanup_ci() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.cleanup_ci", false]], "cleanup_dpd() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.cleanup_dpd", false]], "clear() (psi4.core.bsvec method)": [[5, "psi4.core.BSVec.clear", false]], "clear() (psi4.core.externalpotential method)": [[73, "psi4.core.ExternalPotential.clear", false]], "clear() (psi4.core.oeprop method)": [[111, "psi4.core.OEProp.clear", false]], "clear_all() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.clear_all", false]], "clear_collocation_cache() (psi4.core.vbase method)": [[147, "psi4.core.VBase.clear_collocation_cache", false]], "clear_d_prev() (psi4.core.compositejk method)": [[18, "psi4.core.CompositeJK.clear_D_prev", false]], "clear_external_cpscf_perturbations() (psi4.core.hf method)": [[84, "psi4.core.HF.clear_external_cpscf_perturbations", false]], "clear_external_potentials() (psi4.core.hf method)": [[84, "psi4.core.HF.clear_external_potentials", false]], "clear_spaces() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.clear_spaces", false]], "clone() (psi4.core.intvector method)": [[88, "psi4.core.IntVector.clone", false]], "clone() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.clone", false]], "clone() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.clone", false]], "clone() (psi4.core.vector method)": [[148, "psi4.core.Vector.clone", false]], "close() (psi4.core.io method)": [[86, "psi4.core.IO.close", false]], "close_io_files() (psi4.core.civector method)": [[12, "psi4.core.CIVector.close_io_files", false]], "close_outfile() (in module psi4.core)": [[172, "psi4.core.close_outfile", false]], "coef (psi4.core.salccomponent attribute)": [[134, "psi4.core.SalcComponent.coef", false]], "coef() (psi4.core.gaussianshell method)": [[81, "psi4.core.GaussianShell.coef", false]], "coldim() (psi4.core.dpdbuf4 method)": [[183, "psi4.core.dpdbuf4.coldim", false]], "coldim() (psi4.core.dpdfile2 method)": [[184, "psi4.core.dpdfile2.coldim", false]], "coldim() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.coldim", false]], "collapse_size (detci)": [[1704, "term-COLLAPSE_SIZE-DETCI", true]], "collapse_with_last (cceom)": [[1704, "term-COLLAPSE_WITH_LAST-CCEOM", true]], "collapse_with_last_cc3 (cceom)": [[1704, "term-COLLAPSE_WITH_LAST_CC3-CCEOM", true]], "collocation": [[1773, "index-0", false]], "collocation_size() (psi4.core.moleculargrid method)": [[105, "psi4.core.MolecularGrid.collocation_size", false]], "colors (psi4.driver.p4util.inpsight attribute)": [[323, "psi4.driver.p4util.InPsight.colors", false]], "cols() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.cols", false]], "com_fixed() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.com_fixed", false]], "comment() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.comment", false]], "compare() (in module psi4)": [[2, "psi4.compare", false]], "compare_cubes() (in module psi4)": [[2, "psi4.compare_cubes", false]], "compare_fchkfiles() (in module psi4)": [[2, "psi4.compare_fchkfiles", false]], "compare_fchkfiles() (in module psi4.driver)": [[285, "psi4.driver.compare_fchkfiles", false]], "compare_fchkfiles() (in module psi4.driver.p4util)": [[336, "psi4.driver.p4util.compare_fchkfiles", false]], "compare_fcidumps() (in module psi4)": [[2, "psi4.compare_fcidumps", false]], "compare_fcidumps() (in module psi4.driver)": [[286, "psi4.driver.compare_fcidumps", false]], "compare_fcidumps() (in module psi4.driver.p4util)": [[337, "psi4.driver.p4util.compare_fcidumps", false]], "compare_integers() (in module psi4)": [[2, "psi4.compare_integers", false]], "compare_matrices() (in module psi4)": [[2, "psi4.compare_matrices", false]], "compare_moldenfiles() (in module psi4)": [[2, "psi4.compare_moldenfiles", false]], "compare_moldenfiles() (in module psi4.driver)": [[287, "psi4.driver.compare_moldenfiles", false]], "compare_moldenfiles() (in module psi4.driver.p4util)": [[338, "psi4.driver.p4util.compare_moldenfiles", false]], "compare_molrecs() (in module psi4)": [[2, "psi4.compare_molrecs", false]], "compare_recursive() (in module psi4)": [[2, "psi4.compare_recursive", false]], "compare_values() (in module psi4)": [[2, "psi4.compare_values", false]], "compare_vectors() (in module psi4)": [[2, "psi4.compare_vectors", false]], "compare_vibinfos() (in module psi4.driver.qcdb.vib)": [[383, "psi4.driver.qcdb.vib.compare_vibinfos", false]], "compare_vibinfos() (in module qcdb)": [[2, "qcdb.compare_vibinfos", false]], "compare_wavefunctions() (in module psi4)": [[2, "psi4.compare_wavefunctions", false]], "compilers": [[1781, "index-1", false]], "compiling": [[1738, "index-0", false]], "complete_basis_set()": [[1740, "index-0", false]], "complex_tolerance (cceom)": [[1704, "term-COMPLEX_TOLERANCE-CCEOM", true]], "compositejk (class in psi4.core)": [[18, "psi4.core.CompositeJK", false]], "comput_s2 (dfocc)": [[1704, "term-COMPUT_S2-DFOCC", true]], "compute() (psi4.core.deriv method)": [[61, "psi4.core.Deriv.compute", false]], "compute() (psi4.core.dfep2wavefunction method)": [[26, "psi4.core.DFEP2Wavefunction.compute", false]], "compute() (psi4.core.jk method)": [[92, "psi4.core.JK.compute", false]], "compute() (psi4.core.oeprop method)": [[111, "psi4.core.OEProp.compute", false]], "compute() (psi4.core.onebodyaoint method)": [[112, "psi4.core.OneBodyAOInt.compute", false]], "compute() (psi4.driver.atomiccomputer method)": [[265, "psi4.driver.AtomicComputer.compute", false]], "compute() (psi4.driver.driver_cbs.compositecomputer method)": [[1740, "psi4.driver.driver_cbs.CompositeComputer.compute", false]], "compute() (psi4.driver.driver_findif.finitedifferencecomputer method)": [[1772, "psi4.driver.driver_findif.FiniteDifferenceComputer.compute", false]], "compute() (psi4.driver.driver_nbody.manybodycomputer method)": [[1794, "psi4.driver.driver_nbody.ManyBodyComputer.compute", false]], "compute() (psi4.driver.task_base.basecomputer method)": [[1768, "psi4.driver.task_base.BaseComputer.compute", false]], "compute_afock() (psi4.core.somcscf method)": [[133, "psi4.core.SOMCSCF.compute_AFock", false]], "compute_density() (psi4.core.cubeproperties method)": [[21, "psi4.core.CubeProperties.compute_density", false]], "compute_df() (psi4.core.deriv method)": [[61, "psi4.core.Deriv.compute_df", false]], "compute_e() (psi4.core.hf method)": [[84, "psi4.core.HF.compute_E", false]], "compute_energy() (psi4.core.dispersion method)": [[68, "psi4.core.Dispersion.compute_energy", false]], "compute_energy() (psi4.core.hf method)": [[84, "psi4.core.HF.compute_energy", false]], "compute_energy() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.compute_energy", false]], "compute_energy() (psi4.driver.empiricaldispersion method)": [[267, "psi4.driver.EmpiricalDispersion.compute_energy", false]], "compute_esp_over_grid_in_memory() (psi4.core.esppropcalc method)": [[70, "psi4.core.ESPPropCalc.compute_esp_over_grid_in_memory", false]], "compute_field_over_grid_in_memory() (psi4.core.esppropcalc method)": [[70, "psi4.core.ESPPropCalc.compute_field_over_grid_in_memory", false]], "compute_fock_like_matrices() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.compute_fock_like_matrices", false]], "compute_functional() (psi4.core.functional method)": [[80, "psi4.core.Functional.compute_functional", false]], "compute_functional() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.compute_functional", false]], "compute_functions() (psi4.core.basisfunctions method)": [[7, "psi4.core.BasisFunctions.compute_functions", false]], "compute_fvpi() (psi4.core.hf method)": [[84, "psi4.core.HF.compute_fvpi", false]], "compute_gradient() (psi4.core.dispersion method)": [[68, "psi4.core.Dispersion.compute_gradient", false]], "compute_gradient() (psi4.core.vbase method)": [[147, "psi4.core.VBase.compute_gradient", false]], "compute_gradient() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.compute_gradient", false]], "compute_gradient() (psi4.driver.empiricaldispersion method)": [[267, "psi4.driver.EmpiricalDispersion.compute_gradient", false]], "compute_guess() (psi4.core.sadguess method)": [[131, "psi4.core.SADGuess.compute_guess", false]], "compute_hessain() (psi4.core.vbase method)": [[147, "psi4.core.VBase.compute_hessain", false]], "compute_hessian() (psi4.core.dispersion method)": [[68, "psi4.core.Dispersion.compute_hessian", false]], "compute_hessian() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.compute_hessian", false]], "compute_hessian() (psi4.driver.empiricaldispersion method)": [[267, "psi4.driver.EmpiricalDispersion.compute_hessian", false]], "compute_hk() (psi4.core.somcscf method)": [[133, "psi4.core.SOMCSCF.compute_Hk", false]], "compute_initial_e() (psi4.core.hf method)": [[84, "psi4.core.HF.compute_initial_E", false]], "compute_list (psi4.driver.driver_cbs.compositecomputer attribute)": [[1740, "psi4.driver.driver_cbs.CompositeComputer.compute_list", false]], "compute_mp4_triples (fnocc)": [[1704, "term-COMPUTE_MP4_TRIPLES-FNOCC", true]], "compute_orbital_gradient() (psi4.core.cuhf method)": [[14, "psi4.core.CUHF.compute_orbital_gradient", false]], "compute_orbital_gradient() (psi4.core.hf method)": [[84, "psi4.core.HF.compute_orbital_gradient", false]], "compute_orbital_gradient() (psi4.core.rhf method)": [[128, "psi4.core.RHF.compute_orbital_gradient", false]], "compute_orbital_gradient() (psi4.core.rohf method)": [[130, "psi4.core.ROHF.compute_orbital_gradient", false]], "compute_orbital_gradient() (psi4.core.uhf method)": [[145, "psi4.core.UHF.compute_orbital_gradient", false]], "compute_orbitals() (psi4.core.cubeproperties method)": [[21, "psi4.core.CubeProperties.compute_orbitals", false]], "compute_phi() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.compute_phi", false]], "compute_points() (psi4.core.pointfunctions method)": [[119, "psi4.core.PointFunctions.compute_points", false]], "compute_products() (psi4.driver.p4util.solverengine method)": [[329, "psi4.driver.p4util.SolverEngine.compute_products", false]], "compute_properties() (psi4.core.cubeproperties method)": [[21, "psi4.core.CubeProperties.compute_properties", false]], "compute_q() (psi4.core.somcscf method)": [[133, "psi4.core.SOMCSCF.compute_Q", false]], "compute_qk() (psi4.core.somcscf method)": [[133, "psi4.core.SOMCSCF.compute_Qk", false]], "compute_shell() (psi4.core.onebodyaoint method)": [[112, "psi4.core.OneBodyAOInt.compute_shell", false]], "compute_shell() (psi4.core.threecenteroverlapint method)": [[141, "psi4.core.ThreeCenterOverlapInt.compute_shell", false]], "compute_shell() (psi4.core.twobodyaoint method)": [[143, "psi4.core.TwoBodyAOInt.compute_shell", false]], "compute_shell() (psi4.core.twoelectronint method)": [[144, "psi4.core.TwoElectronInt.compute_shell", false]], "compute_spin_contamination() (psi4.core.hf method)": [[84, "psi4.core.HF.compute_spin_contamination", false]], "compute_state_transfer() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.compute_state_transfer", false]], "compute_thc_factorization() (psi4.core.ls_thc_computer method)": [[94, "psi4.core.LS_THC_Computer.compute_thc_factorization", false]], "compute_triples (fnocc)": [[1704, "term-COMPUTE_TRIPLES-FNOCC", true]], "compute_v() (psi4.core.vbase method)": [[147, "psi4.core.VBase.compute_V", false]], "compute_vx() (psi4.core.vbase method)": [[147, "psi4.core.VBase.compute_Vx", false]], "computed (psi4.driver.atomiccomputer attribute)": [[265, "psi4.driver.AtomicComputer.computed", false]], "computed_shells_per_iter() (psi4.core.jk method)": [[92, "psi4.core.JK.computed_shells_per_iter", false]], "computeexternexterninteraction() (psi4.core.externalpotential method)": [[73, "psi4.core.ExternalPotential.computeExternExternInteraction", false]], "computenuclearenergy() (psi4.core.externalpotential method)": [[73, "psi4.core.ExternalPotential.computeNuclearEnergy", false]], "computepotentialmatrix() (psi4.core.externalpotential method)": [[73, "psi4.core.ExternalPotential.computePotentialMatrix", false]], "computer (psi4.driver.driver_findif.finitedifferencecomputer attribute)": [[1772, "psi4.driver.driver_findif.FiniteDifferenceComputer.computer", false]], "conda_prefix": [[1738, "index-20", false], [1738, "index-22", false], [1767, "envvar-CONDA_PREFIX", false]], "connectivity() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.connectivity", false]], "consecutive_backsteps (optking)": [[1704, "term-CONSECUTIVE_BACKSTEPS-OPTKING", true]], "constrained": [[1802, "index-2", false]], "construct_from_pydict() (psi4.core.basisset static method)": [[8, "psi4.core.BasisSet.construct_from_pydict", false]], "contact": [[1781, "index-3", false]], "continuum solvation": [[1754, "index-0", false], [1803, "index-0", false]], "converged (psi4.core.localizer attribute)": [[97, "psi4.core.Localizer.converged", false]], "convergence criteria": [[1802, "index-3", false]], "convergenceerror": [[266, "psi4.driver.ConvergenceError", false]], "coord() (psi4.core.gaussianshell method)": [[81, "psi4.core.GaussianShell.coord", false]], "copy() (psi4.core.civector method)": [[12, "psi4.core.CIVector.copy", false]], "copy() (psi4.core.intvector method)": [[88, "psi4.core.IntVector.copy", false]], "copy() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.copy", false]], "copy() (psi4.core.vector method)": [[148, "psi4.core.Vector.copy", false]], "copy_file_from_scratch() (in module psi4.driver)": [[288, "psi4.driver.copy_file_from_scratch", false]], "copy_file_from_scratch() (in module psi4.driver.p4util)": [[339, "psi4.driver.p4util.copy_file_from_scratch", false]], "copy_file_to_scratch() (in module psi4.driver)": [[289, "psi4.driver.copy_file_to_scratch", false]], "copy_file_to_scratch() (in module psi4.driver.p4util)": [[340, "psi4.driver.p4util.copy_file_to_scratch", false]], "copy_lower_to_upper() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.copy_lower_to_upper", false]], "copy_upper_to_lower() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.copy_upper_to_lower", false]], "core_hamiltonian_grad() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.core_hamiltonian_grad", false]], "corl_xtpl_helgaker_2() (in module psi4.driver.driver_cbs_helper)": [[1740, "psi4.driver.driver_cbs_helper.corl_xtpl_helgaker_2", false]], "corr_ansatz (psimrcc)": [[1704, "term-CORR_ANSATZ-PSIMRCC", true]], "corr_ccsd_t (psimrcc)": [[1704, "term-CORR_CCSD_T-PSIMRCC", true]], "corr_charge (psimrcc)": [[1704, "term-CORR_CHARGE-PSIMRCC", true]], "corr_multp (psimrcc)": [[1704, "term-CORR_MULTP-PSIMRCC", true]], "corr_wfn (psimrcc)": [[1704, "term-CORR_WFN-PSIMRCC", true]], "correlated (psi4.core.derivcalctype attribute)": [[62, "psi4.core.DerivCalcType.Correlated", false]], "correlationfactor (class in psi4.core)": [[19, "psi4.core.CorrelationFactor", false]], "correlationtable (class in psi4.core)": [[20, "psi4.core.CorrelationTable", false]], "cosmo": [[1754, "index-0", false]], "cosx_basis_tolerance (scf)": [[1704, "term-COSX_BASIS_TOLERANCE-SCF", true]], "cosx_density_tolerance (scf)": [[1704, "term-COSX_DENSITY_TOLERANCE-SCF", true]], "cosx_ints_tolerance (scf)": [[1704, "term-COSX_INTS_TOLERANCE-SCF", true]], "cosx_maxiter_final (scf)": [[1704, "term-COSX_MAXITER_FINAL-SCF", true]], "cosx_overlap_fitting (scf)": [[1704, "term-COSX_OVERLAP_FITTING-SCF", true]], "cosx_pruning_scheme (scf)": [[1704, "term-COSX_PRUNING_SCHEME-SCF", true]], "cosx_radial_points_final (scf)": [[1704, "term-COSX_RADIAL_POINTS_FINAL-SCF", true]], "cosx_radial_points_initial (scf)": [[1704, "term-COSX_RADIAL_POINTS_INITIAL-SCF", true]], "cosx_spherical_points_final (scf)": [[1704, "term-COSX_SPHERICAL_POINTS_FINAL-SCF", true]], "cosx_spherical_points_initial (scf)": [[1704, "term-COSX_SPHERICAL_POINTS_INITIAL-SCF", true]], "cotton-ordering": [[1833, "index-6", false]], "coulomb() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.coulomb", false]], "count() (psi4.core.bsvec method)": [[5, "psi4.core.BSVec.count", false]], "counterpoise correction": [[1794, "index-1", false]], "coupled_induction (sapt)": [[1704, "term-COUPLED_INDUCTION-SAPT", true]], "coupling (psimrcc)": [[1704, "term-COUPLING-PSIMRCC", true]], "coupling_terms (psimrcc)": [[1704, "term-COUPLING_TERMS-PSIMRCC", true]], "covalent_connect (optking)": [[1704, "term-COVALENT_CONNECT-OPTKING", true]], "cp": [[1794, "index-1", false]], "cp (psi4.driver.driver_nbody.bsseenum attribute)": [[1794, "psi4.driver.driver_nbody.BsseEnum.cp", false]], "cp-corrected 2-body interaction energy": [[1776, "psivar-CP-CORRECTED-2-BODY-INTERACTION-ENERGY", false]], "cphf_converged() (psi4.core.hf method)": [[84, "psi4.core.HF.cphf_converged", false]], "cphf_hx() (psi4.core.hf method)": [[84, "psi4.core.HF.cphf_Hx", false]], "cphf_mem_safety_factor (cphf)": [[1704, "term-CPHF_MEM_SAFETY_FACTOR-CPHF", true]], "cphf_r_convergence (fisapt)": [[1704, "term-CPHF_R_CONVERGENCE-FISAPT", true]], "cphf_r_convergence (sapt)": [[1704, "term-CPHF_R_CONVERGENCE-SAPT", true]], "cphf_solve() (psi4.core.hf method)": [[84, "psi4.core.HF.cphf_solve", false]], "cphf_tasks (cphf)": [[1704, "term-CPHF_TASKS-CPHF", true]], "cppe": [[1749, "index-0", false]], "crashclean() (psi4.core.iomanager method)": [[87, "psi4.core.IOManager.crashclean", false]], "cray_add_rpath": [[1738, "envvar-CRAY_ADD_RPATH", false]], "craype_link_type": [[1738, "envvar-CRAYPE_LINK_TYPE", false]], "create_matrices() (psi4.core.cdsalclist method)": [[16, "psi4.core.CdSalcList.create_matrices", false]], "create_matrices() (psi4.core.multipolesymmetry method)": [[108, "psi4.core.MultipoleSymmetry.create_matrices", false]], "create_matrix() (psi4.core.matrixfactory method)": [[101, "psi4.core.MatrixFactory.create_matrix", false]], "create_plugin() (in module psi4.driver)": [[290, "psi4.driver.create_plugin", false]], "create_psi4_string_from_molecule() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.create_psi4_string_from_molecule", false]], "cross() (psi4.core.vector3 method)": [[149, "psi4.core.Vector3.cross", false]], "ct() (psi4.core.rohf method)": [[130, "psi4.core.ROHF.Ct", false]], "cube": [[1750, "index-0", false]], "cubeprop": [[1750, "index-0", false]], "cubeprop() (in module psi4.driver)": [[291, "psi4.driver.cubeprop", false]], "cubeprop() (in module psi4.driver.p4util)": [[341, "psi4.driver.p4util.cubeprop", false]], "cubeprop_basis_functions (globals)": [[1704, "term-CUBEPROP_BASIS_FUNCTIONS-GLOBALS", true]], "cubeprop_filepath (globals)": [[1704, "term-CUBEPROP_FILEPATH-GLOBALS", true]], "cubeprop_isocontour_threshold (globals)": [[1704, "term-CUBEPROP_ISOCONTOUR_THRESHOLD-GLOBALS", true]], "cubeprop_orbitals (globals)": [[1704, "term-CUBEPROP_ORBITALS-GLOBALS", true]], "cubeprop_tasks (globals)": [[1704, "term-CUBEPROP_TASKS-GLOBALS", true]], "cubeproperties (class in psi4.core)": [[21, "psi4.core.CubeProperties", false]], "cubic_basis_tolerance (fisapt)": [[1704, "term-CUBIC_BASIS_TOLERANCE-FISAPT", true]], "cubic_basis_tolerance (globals)": [[1704, "term-CUBIC_BASIS_TOLERANCE-GLOBALS", true]], "cubic_block_max_points (fisapt)": [[1704, "term-CUBIC_BLOCK_MAX_POINTS-FISAPT", true]], "cubic_block_max_points (globals)": [[1704, "term-CUBIC_BLOCK_MAX_POINTS-GLOBALS", true]], "cubic_grid_overage (fisapt)": [[1704, "term-CUBIC_GRID_OVERAGE-FISAPT", true]], "cubic_grid_overage (globals)": [[1704, "term-CUBIC_GRID_OVERAGE-GLOBALS", true]], "cubic_grid_spacing (fisapt)": [[1704, "term-CUBIC_GRID_SPACING-FISAPT", true]], "cubic_grid_spacing (globals)": [[1704, "term-CUBIC_GRID_SPACING-GLOBALS", true]], "cuhf (class in psi4.core)": [[14, "psi4.core.CUHF", false]], "current correlation energy": [[1776, "psivar-CURRENT-CORRELATION-ENERGY", false]], "current dipole": [[1776, "psivar-CURRENT-DIPOLE", false]], "current dipole gradient": [[1776, "psivar-CURRENT-DIPOLE-GRADIENT", false]], "current energy": [[1776, "psivar-CURRENT-ENERGY", false]], "current gradient": [[1776, "psivar-CURRENT-GRADIENT", false]], "current hessian": [[1776, "psivar-CURRENT-HESSIAN", false]], "current reference energy": [[1776, "psivar-CURRENT-REFERENCE-ENERGY", false]], "current_afock() (psi4.core.somcscf method)": [[133, "psi4.core.SOMCSCF.current_AFock", false]], "current_ci_energy() (psi4.core.somcscf method)": [[133, "psi4.core.SOMCSCF.current_ci_energy", false]], "current_docc_energy() (psi4.core.somcscf method)": [[133, "psi4.core.SOMCSCF.current_docc_energy", false]], "current_ifock() (psi4.core.somcscf method)": [[133, "psi4.core.SOMCSCF.current_IFock", false]], "current_total_energy() (psi4.core.somcscf method)": [[133, "psi4.core.SOMCSCF.current_total_energy", false]], "custom scs-lccd correlation energy": [[1776, "psivar-CUSTOM-SCS-LCCD-CORRELATION-ENERGY", false]], "custom scs-lccd total energy": [[1776, "psivar-CUSTOM-SCS-LCCD-TOTAL-ENERGY", false]], "custom scs-mp2 correlation energy": [[1776, "psivar-CUSTOM-SCS-MP2-CORRELATION-ENERGY", false]], "custom scs-mp2 total energy": [[1776, "psivar-CUSTOM-SCS-MP2-TOTAL-ENERGY", false]], "custom scs-mp2.5 correlation energy": [[1776, "psivar-CUSTOM-SCS-MP2.5-CORRELATION-ENERGY", false]], "custom scs-mp2.5 total energy": [[1776, "psivar-CUSTOM-SCS-MP2.5-TOTAL-ENERGY", false]], "custom scs-mp3 correlation energy": [[1776, "psivar-CUSTOM-SCS-MP3-CORRELATION-ENERGY", false]], "custom scs-mp3 total energy": [[1776, "psivar-CUSTOM-SCS-MP3-TOTAL-ENERGY", false]], "custom scs-olccd correlation energy": [[1776, "psivar-CUSTOM-SCS-OLCCD-CORRELATION-ENERGY", false]], "custom scs-olccd total energy": [[1776, "psivar-CUSTOM-SCS-OLCCD-TOTAL-ENERGY", false]], "custom scs-omp2 correlation energy": [[1776, "psivar-CUSTOM-SCS-OMP2-CORRELATION-ENERGY", false]], "custom scs-omp2 total energy": [[1776, "psivar-CUSTOM-SCS-OMP2-TOTAL-ENERGY", false]], "custom scs-omp2.5 correlation energy": [[1776, "psivar-CUSTOM-SCS-OMP2.5-CORRELATION-ENERGY", false]], "custom scs-omp2.5 total energy": [[1776, "psivar-CUSTOM-SCS-OMP2.5-TOTAL-ENERGY", false]], "custom scs-omp3 correlation energy": [[1776, "psivar-CUSTOM-SCS-OMP3-CORRELATION-ENERGY", false]], "custom scs-omp3 total energy": [[1776, "psivar-CUSTOM-SCS-OMP3-TOTAL-ENERGY", false]], "custom scs-oremp2 correlation energy": [[1776, "psivar-CUSTOM-SCS-OREMP2-CORRELATION-ENERGY", false]], "custom scs-oremp2 total energy": [[1776, "psivar-CUSTOM-SCS-OREMP2-TOTAL-ENERGY", false]], "custom scs-remp2 correlation energy": [[1776, "psivar-CUSTOM-SCS-REMP2-CORRELATION-ENERGY", false]], "custom scs-remp2 total energy": [[1776, "psivar-CUSTOM-SCS-REMP2-TOTAL-ENERGY", false]], "custom_coords (optking)": [[1704, "term-CUSTOM_COORDS-OPTKING", true]], "cutoff (dfocc)": [[1704, "term-CUTOFF-DFOCC", true]], "cutoff (occ)": [[1704, "term-CUTOFF-OCC", true]], "cutoff_amps_print (adc)": [[1704, "term-CUTOFF_AMPS_PRINT-ADC", true]], "d() (psi4.core.dispersion method)": [[68, "psi4.core.Dispersion.d", false]], "d() (psi4.core.jk method)": [[92, "psi4.core.JK.D", false]], "d_conv (psi4.driver.scfconvergenceerror attribute)": [[276, "psi4.driver.SCFConvergenceError.d_conv", false]], "d_convergence (mcscf)": [[1704, "term-D_CONVERGENCE-MCSCF", true]], "d_convergence (scf)": [[1704, "term-D_CONVERGENCE-SCF", true]], "d_vector() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.D_vector", false]], "da() (psi4.core.sadguess method)": [[131, "psi4.core.SADGuess.Da", false]], "da() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.Da", false]], "da_subset() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.Da_subset", false]], "damp_induced (pe)": [[1704, "term-DAMP_INDUCED-PE", true]], "damp_multipole (pe)": [[1704, "term-DAMP_MULTIPOLE-PE", true]], "damping": [[1838, "index-2", false]], "damping_convergence (scf)": [[1704, "term-DAMPING_CONVERGENCE-SCF", true]], "damping_factor_induced (pe)": [[1704, "term-DAMPING_FACTOR_INDUCED-PE", true]], "damping_factor_multipole (pe)": [[1704, "term-DAMPING_FACTOR_MULTIPOLE-PE", true]], "damping_percentage (dct)": [[1704, "term-DAMPING_PERCENTAGE-DCT", true]], "damping_percentage (psimrcc)": [[1704, "term-DAMPING_PERCENTAGE-PSIMRCC", true]], "damping_percentage (scf)": [[1704, "term-DAMPING_PERCENTAGE-SCF", true]], "damping_update() (psi4.core.hf method)": [[84, "psi4.core.HF.damping_update", false]], "dao() (psi4.core.vbase method)": [[147, "psi4.core.VBase.Dao", false]], "dashcoeff_supplement (psi4.driver.empiricaldispersion attribute)": [[267, "psi4.driver.EmpiricalDispersion.dashcoeff_supplement", false]], "dashcoeff_supplement (psi4.driver.procrouting.empirical_dispersion.empiricaldispersion attribute)": [[1759, "psi4.driver.procrouting.empirical_dispersion.EmpiricalDispersion.dashcoeff_supplement", false]], "dashlevel (psi4.driver.empiricaldispersion attribute)": [[267, "psi4.driver.EmpiricalDispersion.dashlevel", false]], "dashlevel (psi4.driver.procrouting.empirical_dispersion.empiricaldispersion attribute)": [[1759, "psi4.driver.procrouting.empirical_dispersion.EmpiricalDispersion.dashlevel", false]], "dashlevel_citation (psi4.driver.empiricaldispersion attribute)": [[267, "psi4.driver.EmpiricalDispersion.dashlevel_citation", false]], "dashlevel_citation (psi4.driver.procrouting.empirical_dispersion.empiricaldispersion attribute)": [[1759, "psi4.driver.procrouting.empirical_dispersion.EmpiricalDispersion.dashlevel_citation", false]], "dashparams (psi4.driver.empiricaldispersion attribute)": [[267, "psi4.driver.EmpiricalDispersion.dashparams", false]], "dashparams (psi4.driver.procrouting.empirical_dispersion.empiricaldispersion attribute)": [[1759, "psi4.driver.procrouting.empirical_dispersion.EmpiricalDispersion.dashparams", false]], "dashparams_citation (psi4.driver.empiricaldispersion attribute)": [[267, "psi4.driver.EmpiricalDispersion.dashparams_citation", false]], "dashparams_citation (psi4.driver.procrouting.empirical_dispersion.empiricaldispersion attribute)": [[1759, "psi4.driver.procrouting.empirical_dispersion.EmpiricalDispersion.dashparams_citation", false]], "dasum() (in module psi4.core)": [[22, "psi4.core.DASUM", false]], "database()": [[1752, "index-0", false], [1752, "index-3", false], [1752, "index-4", false], [1835, "index-0", false]], "database() (in module psi4.driver.wrapper_database)": [[1752, "psi4.driver.wrapper_database.database", false]], "davidson_solver() (in module psi4.driver.p4util)": [[342, "psi4.driver.p4util.davidson_solver", false]], "daxpy() (in module psi4.core)": [[23, "psi4.core.DAXPY", false]], "db()": [[1752, "index-0", false]], "db() (psi4.core.sadguess method)": [[131, "psi4.core.SADGuess.Db", false]], "db() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.Db", false]], "db_name database mean absolute deviation": [[1776, "psivar-db_name-DATABASE-MEAN-ABSOLUTE-DEVIATION", false]], "db_name database mean signed deviation": [[1776, "psivar-db_name-DATABASE-MEAN-SIGNED-DEVIATION", false]], "db_name database root-mean-square deviation": [[1776, "psivar-db_name-DATABASE-ROOT-MEAN-SQUARE-DEVIATION", false]], "db_subset() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.Db_subset", false]], "dcalc() (psi4.core.civector method)": [[12, "psi4.core.CIVector.dcalc", false]], "dcopy() (in module psi4.core)": [[24, "psi4.core.DCOPY", false]], "dct": [[1753, "index-0", false]], "dct lambda energy": [[1776, "psivar-DCT-LAMBDA-ENERGY", false]], "dct scf energy": [[1776, "psivar-DCT-SCF-ENERGY", false]], "dct three-particle energy": [[1776, "psivar-DCT-THREE-PARTICLE-ENERGY", false]], "dct total energy": [[1776, "psivar-DCT-TOTAL-ENERGY", false]], "dct() (in module psi4.core)": [[173, "psi4.core.dct", false]], "dct_functional (dct)": [[1704, "term-DCT_FUNCTIONAL-DCT", true]], "dct_guess (dct)": [[1704, "term-DCT_GUESS-DCT", true]], "dct_type (dct)": [[1704, "term-DCT_TYPE-DCT", true]], "dd solvation energy": [[1776, "psivar-DD-SOLVATION-ENERGY", false]], "dd_density_integral() (psi4.core.numinthelper method)": [[110, "psi4.core.NumIntHelper.dd_density_integral", false]], "ddot() (in module psi4.core)": [[25, "psi4.core.DDOT", false]], "ddx": [[1754, "index-0", false]], "ddx (globals)": [[1704, "term-DDX-GLOBALS", true]], "ddx_diis_max_vecs (ddx)": [[1704, "term-DDX_DIIS_MAX_VECS-DDX", true]], "ddx_eta (ddx)": [[1704, "term-DDX_ETA-DDX", true]], "ddx_fmm (ddx)": [[1704, "term-DDX_FMM-DDX", true]], "ddx_fmm_local_lmax (ddx)": [[1704, "term-DDX_FMM_LOCAL_LMAX-DDX", true]], "ddx_fmm_multipole_lmax (ddx)": [[1704, "term-DDX_FMM_MULTIPOLE_LMAX-DDX", true]], "ddx_incore (ddx)": [[1704, "term-DDX_INCORE-DDX", true]], "ddx_lmax (ddx)": [[1704, "term-DDX_LMAX-DDX", true]], "ddx_logfile (ddx)": [[1704, "term-DDX_LOGFILE-DDX", true]], "ddx_maxiter (ddx)": [[1704, "term-DDX_MAXITER-DDX", true]], "ddx_model (ddx)": [[1704, "term-DDX_MODEL-DDX", true]], "ddx_n_lebedev (ddx)": [[1704, "term-DDX_N_LEBEDEV-DDX", true]], "ddx_radii (ddx)": [[1704, "term-DDX_RADII-DDX", true]], "ddx_radii_scaling (ddx)": [[1704, "term-DDX_RADII_SCALING-DDX", true]], "ddx_radii_set (ddx)": [[1704, "term-DDX_RADII_SET-DDX", true]], "ddx_shift (ddx)": [[1704, "term-DDX_SHIFT-DDX", true]], "ddx_solute_radial_points (ddx)": [[1704, "term-DDX_SOLUTE_RADIAL_POINTS-DDX", true]], "ddx_solute_spherical_points (ddx)": [[1704, "term-DDX_SOLUTE_SPHERICAL_POINTS-DDX", true]], "ddx_solvation_convergence (ddx)": [[1704, "term-DDX_SOLVATION_CONVERGENCE-DDX", true]], "ddx_solvent (ddx)": [[1704, "term-DDX_SOLVENT-DDX", true]], "ddx_solvent_epsilon (ddx)": [[1704, "term-DDX_SOLVENT_EPSILON-DDX", true]], "ddx_solvent_epsilon_optical (ddx)": [[1704, "term-DDX_SOLVENT_EPSILON_OPTICAL-DDX", true]], "ddx_solvent_kappa (ddx)": [[1704, "term-DDX_SOLVENT_KAPPA-DDX", true]], "deactivate_all_fragments() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.deactivate_all_fragments", false]], "debug (ccdensity)": [[1704, "term-DEBUG-CCDENSITY", true]], "debug (cphf)": [[1704, "term-DEBUG-CPHF", true]], "debug (globals)": [[1704, "term-DEBUG-GLOBALS", true]], "deep_copy() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.deep_copy", false]], "default (psi4.core.derivcalctype attribute)": [[62, "psi4.core.DerivCalcType.Default", false]], "default auxiliary": [[1732, "index-0", false]], "defines (psi4.driver.p4util.inpsight attribute)": [[323, "psi4.driver.p4util.InPsight.defines", false]], "degen() (psi4.core.correlationtable method)": [[20, "psi4.core.CorrelationTable.degen", false]], "del_array_variable() (in module psi4.core)": [[174, "psi4.core.del_array_variable", false]], "del_array_variable() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.del_array_variable", false]], "del_potential_variable() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.del_potential_variable", false]], "del_scalar_variable() (in module psi4.core)": [[175, "psi4.core.del_scalar_variable", false]], "del_scalar_variable() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.del_scalar_variable", false]], "del_variable() (in module psi4.core)": [[176, "psi4.core.del_variable", false]], "del_variable() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.del_variable", false]], "delete_tei (cctransort)": [[1704, "term-DELETE_TEI-CCTRANSORT", true]], "delta correction": [[1740, "index-0", false]], "delta() (psi4.core.basisextents method)": [[6, "psi4.core.BasisExtents.delta", false]], "denominator_algorithm (sapt)": [[1704, "term-DENOMINATOR_ALGORITHM-SAPT", true]], "denominator_delta (sapt)": [[1704, "term-DENOMINATOR_DELTA-SAPT", true]], "denominator_occ() (psi4.core.laplacedenominator method)": [[95, "psi4.core.LaplaceDenominator.denominator_occ", false]], "denominator_occ() (psi4.core.tlaplacedenominator method)": [[140, "psi4.core.TLaplaceDenominator.denominator_occ", false]], "denominator_vir() (psi4.core.laplacedenominator method)": [[95, "psi4.core.LaplaceDenominator.denominator_vir", false]], "denominator_vir() (psi4.core.tlaplacedenominator method)": [[140, "psi4.core.TLaplaceDenominator.denominator_vir", false]], "density-fitting": [[1756, "index-0", false], [1771, "index-1", false]], "density_cutoff() (psi4.core.functional method)": [[80, "psi4.core.Functional.density_cutoff", false]], "density_cutoff() (psi4.core.libxcfunctional method)": [[96, "psi4.core.LibXCFunctional.density_cutoff", false]], "density_integral() (psi4.core.numinthelper method)": [[110, "psi4.core.NumIntHelper.density_integral", false]], "density_tolerance() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.density_tolerance", false]], "deriv (class in psi4.core)": [[61, "psi4.core.Deriv", false]], "deriv() (psi4.core.basisfunctions method)": [[7, "psi4.core.BasisFunctions.deriv", false]], "deriv() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.deriv", false]], "derivcalctype (class in psi4.core)": [[62, "psi4.core.DerivCalcType", false]], "dertype (efp)": [[1704, "term-DERTYPE-EFP", true]], "dertype (globals)": [[1704, "term-DERTYPE-GLOBALS", true]], "descending (psi4.core.diagonalizeorder attribute)": [[63, "psi4.core.DiagonalizeOrder.Descending", false]], "description (psi4.driver.empiricaldispersion attribute)": [[267, "psi4.driver.EmpiricalDispersion.description", false]], "description (psi4.driver.procrouting.empirical_dispersion.empiricaldispersion attribute)": [[1759, "psi4.driver.procrouting.empirical_dispersion.EmpiricalDispersion.description", false]], "description() (psi4.core.dispersion method)": [[68, "psi4.core.Dispersion.description", false]], "description() (psi4.core.functional method)": [[80, "psi4.core.Functional.description", false]], "description() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.description", false]], "detci avg dvec norm": [[1776, "psivar-DETCI-AVG-DVEC-NORM", false]], "detci() (in module psi4.core)": [[177, "psi4.core.detci", false]], "detci_freeze_core (detci)": [[1704, "term-DETCI_FREEZE_CORE-DETCI", true]], "df-ccsd(t)": [[1771, "index-1", false]], "df-mp2": [[1756, "index-0", false], [1756, "index-1", false]], "df_basis_cc (fnocc)": [[1704, "term-DF_BASIS_CC-FNOCC", true]], "df_basis_cc (globals)": [[1704, "term-DF_BASIS_CC-GLOBALS", true]], "df_basis_dct (dct)": [[1704, "term-DF_BASIS_DCT-DCT", true]], "df_basis_elst (sapt)": [[1704, "term-DF_BASIS_ELST-SAPT", true]], "df_basis_ep2 (dfep2)": [[1704, "term-DF_BASIS_EP2-DFEP2", true]], "df_basis_guess (scf)": [[1704, "term-DF_BASIS_GUESS-SCF", true]], "df_basis_mcscf (detci)": [[1704, "term-DF_BASIS_MCSCF-DETCI", true]], "df_basis_mp2 (dfmp2)": [[1704, "term-DF_BASIS_MP2-DFMP2", true]], "df_basis_mp2 (dlpno)": [[1704, "term-DF_BASIS_MP2-DLPNO", true]], "df_basis_sad (scf)": [[1704, "term-DF_BASIS_SAD-SCF", true]], "df_basis_sapt (sapt)": [[1704, "term-DF_BASIS_SAPT-SAPT", true]], "df_basis_scf (cphf)": [[1704, "term-DF_BASIS_SCF-CPHF", true]], "df_basis_scf (scf)": [[1704, "term-DF_BASIS_SCF-SCF", true]], "df_bump_r0 (scf)": [[1704, "term-DF_BUMP_R0-SCF", true]], "df_bump_r1 (scf)": [[1704, "term-DF_BUMP_R1-SCF", true]], "df_domains (scf)": [[1704, "term-DF_DOMAINS-SCF", true]], "df_fitting_condition (scf)": [[1704, "term-DF_FITTING_CONDITION-SCF", true]], "df_ints_io (dfmp2)": [[1704, "term-DF_INTS_IO-DFMP2", true]], "df_ints_io (scf)": [[1704, "term-DF_INTS_IO-SCF", true]], "df_ints_num_threads (dfmp2)": [[1704, "term-DF_INTS_NUM_THREADS-DFMP2", true]], "df_ints_num_threads (scf)": [[1704, "term-DF_INTS_NUM_THREADS-SCF", true]], "df_metric (scf)": [[1704, "term-DF_METRIC-SCF", true]], "df_scf_guess (scf)": [[1704, "term-DF_SCF_GUESS-SCF", true]], "df_theta (scf)": [[1704, "term-DF_THETA-SCF", true]], "dfcc (fnocc)": [[1704, "term-DFCC-FNOCC", true]], "dfep2wavefunction (class in psi4.core)": [[26, "psi4.core.DFEP2Wavefunction", false]], "dfh() (psi4.core.memdfjk method)": [[102, "psi4.core.MemDFJK.dfh", false]], "dfhelper (class in psi4.core)": [[27, "psi4.core.DFHelper", false]], "dfmp2() (in module psi4.core)": [[178, "psi4.core.dfmp2", false]], "dfmp2_mem_factor (dfmp2)": [[1704, "term-DFMP2_MEM_FACTOR-DFMP2", true]], "dfmp2_p2_tolerance (dfmp2)": [[1704, "term-DFMP2_P2_TOLERANCE-DFMP2", true]], "dfmp2_p_tolerance (dfmp2)": [[1704, "term-DFMP2_P_TOLERANCE-DFMP2", true]], "dfocc() (in module psi4.core)": [[179, "psi4.core.dfocc", false]], "dfsomcscf (class in psi4.core)": [[28, "psi4.core.DFSOMCSCF", false]], "dft": [[1757, "index-0", false], [1758, "index-0", false], [1784, "index-0", false]], "dft dipole gradient": [[1776, "psivar-DFT-DIPOLE-GRADIENT", false]], "dft functional total energy": [[1776, "psivar-DFT-FUNCTIONAL-TOTAL-ENERGY", false]], "dft total energy": [[1776, "psivar-DFT-TOTAL-ENERGY", false]], "dft total gradient": [[1776, "psivar-DFT-TOTAL-GRADIENT", false]], "dft total hessian": [[1776, "psivar-DFT-TOTAL-HESSIAN", false]], "dft vv10 energy": [[1776, "psivar-DFT-VV10-ENERGY", false]], "dft xc energy": [[1776, "psivar-DFT-XC-ENERGY", false]], "dft_alpha (scf)": [[1704, "term-DFT_ALPHA-SCF", true]], "dft_alpha_c (scf)": [[1704, "term-DFT_ALPHA_C-SCF", true]], "dft_basis_tolerance (scf)": [[1704, "term-DFT_BASIS_TOLERANCE-SCF", true]], "dft_block_max_points (scf)": [[1704, "term-DFT_BLOCK_MAX_POINTS-SCF", true]], "dft_block_max_radius (scf)": [[1704, "term-DFT_BLOCK_MAX_RADIUS-SCF", true]], "dft_block_min_points (scf)": [[1704, "term-DFT_BLOCK_MIN_POINTS-SCF", true]], "dft_block_scheme (scf)": [[1704, "term-DFT_BLOCK_SCHEME-SCF", true]], "dft_bs_radius_alpha (scf)": [[1704, "term-DFT_BS_RADIUS_ALPHA-SCF", true]], "dft_density_tolerance (scf)": [[1704, "term-DFT_DENSITY_TOLERANCE-SCF", true]], "dft_dispersion_parameters (scf)": [[1704, "term-DFT_DISPERSION_PARAMETERS-SCF", true]], "dft_grac_alpha (scf)": [[1704, "term-DFT_GRAC_ALPHA-SCF", true]], "dft_grac_beta (scf)": [[1704, "term-DFT_GRAC_BETA-SCF", true]], "dft_grac_c_func (scf)": [[1704, "term-DFT_GRAC_C_FUNC-SCF", true]], "dft_grac_shift (scf)": [[1704, "term-DFT_GRAC_SHIFT-SCF", true]], "dft_grac_x_func (scf)": [[1704, "term-DFT_GRAC_X_FUNC-SCF", true]], "dft_grid_name (scf)": [[1704, "term-DFT_GRID_NAME-SCF", true]], "dft_nuclear_scheme (scf)": [[1704, "term-DFT_NUCLEAR_SCHEME-SCF", true]], "dft_omega (scf)": [[1704, "term-DFT_OMEGA-SCF", true]], "dft_omega_c (scf)": [[1704, "term-DFT_OMEGA_C-SCF", true]], "dft_pruning_alpha (scf)": [[1704, "term-DFT_PRUNING_ALPHA-SCF", true]], "dft_pruning_scheme (scf)": [[1704, "term-DFT_PRUNING_SCHEME-SCF", true]], "dft_radial_points (scf)": [[1704, "term-DFT_RADIAL_POINTS-SCF", true]], "dft_radial_scheme (scf)": [[1704, "term-DFT_RADIAL_SCHEME-SCF", true]], "dft_remove_distant_points (scf)": [[1704, "term-DFT_REMOVE_DISTANT_POINTS-SCF", true]], "dft_spherical_points (scf)": [[1704, "term-DFT_SPHERICAL_POINTS-SCF", true]], "dft_spherical_scheme (scf)": [[1704, "term-DFT_SPHERICAL_SCHEME-SCF", true]], "dft_v2_rho_cutoff (scf)": [[1704, "term-DFT_V2_RHO_CUTOFF-SCF", true]], "dft_vv10_b (scf)": [[1704, "term-DFT_VV10_B-SCF", true]], "dft_vv10_c (scf)": [[1704, "term-DFT_VV10_C-SCF", true]], "dft_vv10_postscf (scf)": [[1704, "term-DFT_VV10_POSTSCF-SCF", true]], "dft_vv10_radial_points (scf)": [[1704, "term-DFT_VV10_RADIAL_POINTS-SCF", true]], "dft_vv10_rho_cutoff (scf)": [[1704, "term-DFT_VV10_RHO_CUTOFF-SCF", true]], "dft_vv10_spherical_points (scf)": [[1704, "term-DFT_VV10_SPHERICAL_POINTS-SCF", true]], "dft_weights_tolerance (scf)": [[1704, "term-DFT_WEIGHTS_TOLERANCE-SCF", true]], "dftd3": [[1759, "index-0", false]], "dftd4": [[1759, "index-0", false]], "dftensor (class in psi4.core)": [[30, "psi4.core.DFTensor", false]], "dftgrid (class in psi4.core)": [[29, "psi4.core.DFTGrid", false]], "dftnl": [[1760, "index-0", false]], "dgbmv() (in module psi4.core)": [[31, "psi4.core.DGBMV", false]], "dgeev() (in module psi4.core)": [[32, "psi4.core.DGEEV", false]], "dgemm() (in module psi4.core)": [[33, "psi4.core.DGEMM", false]], "dgemv() (in module psi4.core)": [[34, "psi4.core.DGEMV", false]], "dger() (in module psi4.core)": [[35, "psi4.core.DGER", false]], "dgetrf() (in module psi4.core)": [[36, "psi4.core.DGETRF", false]], "dgetri() (in module psi4.core)": [[37, "psi4.core.DGETRI", false]], "dgetrs() (in module psi4.core)": [[38, "psi4.core.DGETRS", false]], "dhf() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.dHF", false]], "diag_h() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.diag_h", false]], "diag_method (detci)": [[1704, "term-DIAG_METHOD-DETCI", true]], "diagonal_ccsd_t (psimrcc)": [[1704, "term-DIAGONAL_CCSD_T-PSIMRCC", true]], "diagonalize() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.diagonalize", false]], "diagonalize_heff (psimrcc)": [[1704, "term-DIAGONALIZE_HEFF-PSIMRCC", true]], "diagonalizeorder (class in psi4.core)": [[63, "psi4.core.DiagonalizeOrder", false]], "die_if_not_converged (globals)": [[1704, "term-DIE_IF_NOT_CONVERGED-GLOBALS", true]], "diis": [[1838, "index-2", false]], "diis (ccenergy)": [[1704, "term-DIIS-CCENERGY", true]], "diis (cclambda)": [[1704, "term-DIIS-CCLAMBDA", true]], "diis (ccresponse)": [[1704, "term-DIIS-CCRESPONSE", true]], "diis (class in psi4.driver.p4util)": [[321, "psi4.driver.p4util.DIIS", false]], "diis (detci)": [[1704, "term-DIIS-DETCI", true]], "diis (mcscf)": [[1704, "term-DIIS-MCSCF", true]], "diis (scf)": [[1704, "term-DIIS-SCF", true]], "diis() (psi4.core.cuhf method)": [[14, "psi4.core.CUHF.diis", false]], "diis() (psi4.core.hf method)": [[84, "psi4.core.HF.diis", false]], "diis() (psi4.core.rhf method)": [[128, "psi4.core.RHF.diis", false]], "diis() (psi4.core.rohf method)": [[130, "psi4.core.ROHF.diis", false]], "diis() (psi4.core.uhf method)": [[145, "psi4.core.UHF.diis", false]], "diis_enabled_ (psi4.core.hf attribute)": [[84, "psi4.core.HF.diis_enabled_", false]], "diis_freq (detci)": [[1704, "term-DIIS_FREQ-DETCI", true]], "diis_manager_ (psi4.core.hf attribute)": [[84, "psi4.core.HF.diis_manager_", false]], "diis_max_vecs (dct)": [[1704, "term-DIIS_MAX_VECS-DCT", true]], "diis_max_vecs (detci)": [[1704, "term-DIIS_MAX_VECS-DETCI", true]], "diis_max_vecs (fnocc)": [[1704, "term-DIIS_MAX_VECS-FNOCC", true]], "diis_max_vecs (mcscf)": [[1704, "term-DIIS_MAX_VECS-MCSCF", true]], "diis_max_vecs (occ)": [[1704, "term-DIIS_MAX_VECS-OCC", true]], "diis_max_vecs (psimrcc)": [[1704, "term-DIIS_MAX_VECS-PSIMRCC", true]], "diis_max_vecs (scf)": [[1704, "term-DIIS_MAX_VECS-SCF", true]], "diis_min_vecs (dct)": [[1704, "term-DIIS_MIN_VECS-DCT", true]], "diis_min_vecs (detci)": [[1704, "term-DIIS_MIN_VECS-DETCI", true]], "diis_min_vecs (occ)": [[1704, "term-DIIS_MIN_VECS-OCC", true]], "diis_min_vecs (scf)": [[1704, "term-DIIS_MIN_VECS-SCF", true]], "diis_rms_error (scf)": [[1704, "term-DIIS_RMS_ERROR-SCF", true]], "diis_start (psimrcc)": [[1704, "term-DIIS_START-PSIMRCC", true]], "diis_start (scf)": [[1704, "term-DIIS_START-SCF", true]], "diis_start_ (psi4.core.hf attribute)": [[84, "psi4.core.HF.diis_start_", false]], "diis_start_convergence (dct)": [[1704, "term-DIIS_START_CONVERGENCE-DCT", true]], "diis_start_iter (detci)": [[1704, "term-DIIS_START_ITER-DETCI", true]], "dim() (psi4.core.intvector method)": [[88, "psi4.core.IntVector.dim", false]], "dim() (psi4.core.orbitalspace method)": [[115, "psi4.core.OrbitalSpace.dim", false]], "dim() (psi4.core.vector method)": [[148, "psi4.core.Vector.dim", false]], "dimension (class in psi4.core)": [[64, "psi4.core.Dimension", false]], "dimpi() (psi4.core.intvector method)": [[88, "psi4.core.IntVector.dimpi", false]], "dimpi() (psi4.core.vector method)": [[148, "psi4.core.Vector.dimpi", false]], "dipmom (detci)": [[1704, "term-DIPMOM-DETCI", true]], "dipmom (fnocc)": [[1704, "term-DIPMOM-FNOCC", true]], "dipole_grad() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.dipole_grad", false]], "dipoleint (class in psi4.core)": [[65, "psi4.core.DipoleInt", false]], "directjk (class in psi4.core)": [[66, "psi4.core.DirectJK", false]], "disksomcscf (class in psi4.core)": [[67, "psi4.core.DiskSOMCSCF", false]], "disp (psi4.driver.empiricaldispersion attribute)": [[267, "psi4.driver.EmpiricalDispersion.disp", false]], "disp (psi4.driver.procrouting.empirical_dispersion.empiricaldispersion attribute)": [[1759, "psi4.driver.procrouting.empirical_dispersion.EmpiricalDispersion.disp", false]], "disp() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.disp", false]], "disp_size (findif)": [[1704, "term-DISP_SIZE-FINDIF", true]], "dispersion (class in psi4.core)": [[68, "psi4.core.Dispersion", false]], "dispersion correction energy": [[1776, "psivar-DISPERSION-CORRECTION-ENERGY", false]], "distance() (psi4.core.vector3 method)": [[149, "psi4.core.Vector3.distance", false]], "distance_matrix() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.distance_matrix", false]], "distributed multipole analysis": [[1775, "index-0", false]], "distributed_matrix (scf)": [[1704, "term-DISTRIBUTED_MATRIX-SCF", true]], "divide() (psi4.core.civector method)": [[12, "psi4.core.CIVector.divide", false]], "dkh": [[1762, "index-0", false]], "dkh_order (globals)": [[1704, "term-DKH_ORDER-GLOBALS", true]], "dlpno() (in module psi4.core)": [[180, "psi4.core.dlpno", false]], "dlpno-mp2": [[1763, "index-0", false], [1763, "index-1", false]], "dlpno_algorithm (dlpno)": [[1704, "term-DLPNO_ALGORITHM-DLPNO", true]], "dlpno_local_orbitals (dlpno)": [[1704, "term-DLPNO_LOCAL_ORBITALS-DLPNO", true]], "dlpno_maxiter (dlpno)": [[1704, "term-DLPNO_MAXITER-DLPNO", true]], "dma": [[1775, "index-0", false]], "dma distributed multipoles": [[1776, "psivar-DMA-DISTRIBUTED-MULTIPOLES", false]], "dma total multipoles": [[1776, "psivar-DMA-TOTAL-MULTIPOLES", false]], "dmrg() (in module psi4.core)": [[181, "psi4.core.dmrg", false]], "dmrg-caspt2 total energy": [[1776, "psivar-DMRG-CASPT2-TOTAL-ENERGY", false]], "dmrg-scf total energy": [[1776, "psivar-DMRG-SCF-TOTAL-ENERGY", false]], "dmrg_caspt2_calc (dmrg)": [[1704, "term-DMRG_CASPT2_CALC-DMRG", true]], "dmrg_caspt2_imag (dmrg)": [[1704, "term-DMRG_CASPT2_IMAG-DMRG", true]], "dmrg_caspt2_ipea (dmrg)": [[1704, "term-DMRG_CASPT2_IPEA-DMRG", true]], "dmrg_caspt2_orbs (dmrg)": [[1704, "term-DMRG_CASPT2_ORBS-DMRG", true]], "dmrg_diis (dmrg)": [[1704, "term-DMRG_DIIS-DMRG", true]], "dmrg_diis_write (dmrg)": [[1704, "term-DMRG_DIIS_WRITE-DMRG", true]], "dmrg_excitation (dmrg)": [[1704, "term-DMRG_EXCITATION-DMRG", true]], "dmrg_irrep (dmrg)": [[1704, "term-DMRG_IRREP-DMRG", true]], "dmrg_local_init (dmrg)": [[1704, "term-DMRG_LOCAL_INIT-DMRG", true]], "dmrg_molden_write (dmrg)": [[1704, "term-DMRG_MOLDEN_WRITE-DMRG", true]], "dmrg_mps_write (dmrg)": [[1704, "term-DMRG_MPS_WRITE-DMRG", true]], "dmrg_multiplicity (dmrg)": [[1704, "term-DMRG_MULTIPLICITY-DMRG", true]], "dmrg_opdm_ao_print (dmrg)": [[1704, "term-DMRG_OPDM_AO_PRINT-DMRG", true]], "dmrg_print_corr (dmrg)": [[1704, "term-DMRG_PRINT_CORR-DMRG", true]], "dmrg_scf_active_space (dmrg)": [[1704, "term-DMRG_SCF_ACTIVE_SPACE-DMRG", true]], "dmrg_scf_diis_thr (dmrg)": [[1704, "term-DMRG_SCF_DIIS_THR-DMRG", true]], "dmrg_scf_grad_thr (dmrg)": [[1704, "term-DMRG_SCF_GRAD_THR-DMRG", true]], "dmrg_scf_max_iter (dmrg)": [[1704, "term-DMRG_SCF_MAX_ITER-DMRG", true]], "dmrg_scf_state_avg (dmrg)": [[1704, "term-DMRG_SCF_STATE_AVG-DMRG", true]], "dmrg_sweep_dvdson_rtol (dmrg)": [[1704, "term-DMRG_SWEEP_DVDSON_RTOL-DMRG", true]], "dmrg_sweep_energy_conv (dmrg)": [[1704, "term-DMRG_SWEEP_ENERGY_CONV-DMRG", true]], "dmrg_sweep_max_sweeps (dmrg)": [[1704, "term-DMRG_SWEEP_MAX_SWEEPS-DMRG", true]], "dmrg_sweep_noise_prefac (dmrg)": [[1704, "term-DMRG_SWEEP_NOISE_PREFAC-DMRG", true]], "dmrg_sweep_states (dmrg)": [[1704, "term-DMRG_SWEEP_STATES-DMRG", true]], "dmrg_unitary_write (dmrg)": [[1704, "term-DMRG_UNITARY_WRITE-DMRG", true]], "dnrm2() (in module psi4.core)": [[39, "psi4.core.DNRM2", false]], "do_ccd_disp (sapt)": [[1704, "term-DO_CCD_DISP-SAPT", true]], "do_cubes() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.do_cubes", false]], "do_diis (dfocc)": [[1704, "term-DO_DIIS-DFOCC", true]], "do_diis (occ)": [[1704, "term-DO_DIIS-OCC", true]], "do_disp_exch_sinf (sapt)": [[1704, "term-DO_DISP_EXCH_SINF-SAPT", true]], "do_incfock_iter() (psi4.core.compositejk method)": [[18, "psi4.core.CompositeJK.do_incfock_iter", false]], "do_incfock_iter() (psi4.core.directjk method)": [[66, "psi4.core.DirectJK.do_incfock_iter", false]], "do_ind30_exch_sinf (sapt)": [[1704, "term-DO_IND30_EXCH_SINF-SAPT", true]], "do_ind_exch_sinf (sapt)": [[1704, "term-DO_IND_EXCH_SINF-SAPT", true]], "do_level_shift (dfocc)": [[1704, "term-DO_LEVEL_SHIFT-DFOCC", true]], "do_level_shift (occ)": [[1704, "term-DO_LEVEL_SHIFT-OCC", true]], "do_mbpt_disp (sapt)": [[1704, "term-DO_MBPT_DISP-SAPT", true]], "do_scs (dfocc)": [[1704, "term-DO_SCS-DFOCC", true]], "do_scs (occ)": [[1704, "term-DO_SCS-OCC", true]], "do_sos (dfocc)": [[1704, "term-DO_SOS-DFOCC", true]], "do_sos (occ)": [[1704, "term-DO_SOS-OCC", true]], "do_third_order (sapt)": [[1704, "term-DO_THIRD_ORDER-SAPT", true]], "docc (globals)": [[1704, "term-DOCC-GLOBALS", true]], "docc (mcscf)": [[1704, "term-DOCC-MCSCF", true]], "doccpi() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.doccpi", false]], "docs_table_link() (in module psi4.driver)": [[292, "psi4.driver.docs_table_link", false]], "docs_table_link() (in module psi4.driver.p4util)": [[343, "psi4.driver.p4util.docs_table_link", false]], "doi_basis_tolerance (dlpno)": [[1704, "term-DOI_BASIS_TOLERANCE-DLPNO", true]], "doi_pruning_scheme (dlpno)": [[1704, "term-DOI_PRUNING_SCHEME-DLPNO", true]], "doi_radial_points (dlpno)": [[1704, "term-DOI_RADIAL_POINTS-DLPNO", true]], "doi_spherical_points (dlpno)": [[1704, "term-DOI_SPHERICAL_POINTS-DLPNO", true]], "domain (psi4.driver.p4util.lineshape attribute)": [[324, "psi4.driver.p4util.Lineshape.domain", false]], "dot() (psi4.core.vector3 method)": [[149, "psi4.core.Vector3.dot", false]], "double-hybrid correction energy": [[1776, "psivar-DOUBLE-HYBRID-CORRECTION-ENERGY", false]], "doublet() (in module psi4.core)": [[182, "psi4.core.doublet", false]], "doublet() (psi4.core.matrix static method)": [[100, "psi4.core.Matrix.doublet", false]], "dpd_id() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.DPD_ID", false]], "dpdbuf4 (class in psi4.core)": [[183, "psi4.core.dpdbuf4", false]], "dpdfile2 (class in psi4.core)": [[184, "psi4.core.dpdfile2", false]], "dpotrf() (in module psi4.core)": [[40, "psi4.core.DPOTRF", false]], "dpotri() (in module psi4.core)": [[41, "psi4.core.DPOTRI", false]], "dpotrs() (in module psi4.core)": [[42, "psi4.core.DPOTRS", false]], "driver (psi4.driver.atomiccomputer attribute)": [[265, "psi4.driver.AtomicComputer.driver", false]], "driver (psi4.driver.driver_cbs.compositecomputer attribute)": [[1740, "psi4.driver.driver_cbs.CompositeComputer.driver", false]], "driver (psi4.driver.driver_findif.finitedifferencecomputer attribute)": [[1772, "psi4.driver.driver_findif.FiniteDifferenceComputer.driver", false]], "driver (psi4.driver.driver_nbody.manybodycomputer attribute)": [[1794, "psi4.driver.driver_nbody.ManyBodyComputer.driver", false]], "drop_duplicates() (in module psi4.driver.p4util)": [[344, "psi4.driver.p4util.drop_duplicates", false]], "drot() (in module psi4.core)": [[43, "psi4.core.DROT", false]], "dsbmv() (in module psi4.core)": [[44, "psi4.core.DSBMV", false]], "dscal() (in module psi4.core)": [[45, "psi4.core.DSCAL", false]], "dswap() (in module psi4.core)": [[46, "psi4.core.DSWAP", false]], "dsyev() (in module psi4.core)": [[47, "psi4.core.DSYEV", false]], "dsymm() (in module psi4.core)": [[48, "psi4.core.DSYMM", false]], "dsymv() (in module psi4.core)": [[49, "psi4.core.DSYMV", false]], "dsyr() (in module psi4.core)": [[50, "psi4.core.DSYR", false]], "dsyr2() (in module psi4.core)": [[51, "psi4.core.DSYR2", false]], "dsyr2k() (in module psi4.core)": [[52, "psi4.core.DSYR2K", false]], "dsyrk() (in module psi4.core)": [[53, "psi4.core.DSYRK", false]], "dsysv() (in module psi4.core)": [[54, "psi4.core.DSYSV", false]], "dtbmv() (in module psi4.core)": [[55, "psi4.core.DTBMV", false]], "dtbsv() (in module psi4.core)": [[56, "psi4.core.DTBSV", false]], "dtrmm() (in module psi4.core)": [[57, "psi4.core.DTRMM", false]], "dtrmv() (in module psi4.core)": [[58, "psi4.core.DTRMV", false]], "dtrsm() (in module psi4.core)": [[59, "psi4.core.DTRSM", false]], "dtrsv() (in module psi4.core)": [[60, "psi4.core.DTRSV", false]], "dum() (psi4.core.mospace static method)": [[98, "psi4.core.MOSpace.dum", false]], "dummy_einsums() (in module psi4.core)": [[185, "psi4.core.dummy_einsums", false]], "dummy_integratorxx() (in module psi4.core)": [[186, "psi4.core.dummy_integratorxx", false]], "dynamic_level (optking)": [[1704, "term-DYNAMIC_LEVEL-OPTKING", true]], "dynamic_variable_bind() (in module psi4.driver)": [[293, "psi4.driver.dynamic_variable_bind", false]], "e() (psi4.core.symmetryoperation method)": [[139, "psi4.core.SymmetryOperation.E", false]], "e3_scale (dfocc)": [[1704, "term-E3_SCALE-DFOCC", true]], "e3_scale (occ)": [[1704, "term-E3_SCALE-OCC", true]], "e_conv (psi4.driver.scfconvergenceerror attribute)": [[276, "psi4.driver.SCFConvergenceError.e_conv", false]], "e_convergence (ccenergy)": [[1704, "term-E_CONVERGENCE-CCENERGY", true]], "e_convergence (cceom)": [[1704, "term-E_CONVERGENCE-CCEOM", true]], "e_convergence (dct)": [[1704, "term-E_CONVERGENCE-DCT", true]], "e_convergence (detci)": [[1704, "term-E_CONVERGENCE-DETCI", true]], "e_convergence (dfocc)": [[1704, "term-E_CONVERGENCE-DFOCC", true]], "e_convergence (dlpno)": [[1704, "term-E_CONVERGENCE-DLPNO", true]], "e_convergence (fnocc)": [[1704, "term-E_CONVERGENCE-FNOCC", true]], "e_convergence (mcscf)": [[1704, "term-E_CONVERGENCE-MCSCF", true]], "e_convergence (mrcc)": [[1704, "term-E_CONVERGENCE-MRCC", true]], "e_convergence (occ)": [[1704, "term-E_CONVERGENCE-OCC", true]], "e_convergence (psimrcc)": [[1704, "term-E_CONVERGENCE-PSIMRCC", true]], "e_convergence (scf)": [[1704, "term-E_CONVERGENCE-SCF", true]], "ea_poles (occ)": [[1704, "term-EA_POLES-OCC", true]], "ecp_shell() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.ecp_shell", false]], "ecp_shell_on_center() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.ecp_shell_on_center", false]], "ecpint": [[1765, "index-0", false]], "efp": [[1782, "index-0", false], [1782, "index-1", false], [1782, "index-4", false], [1782, "index-5", false]], "efp disp energy": [[1776, "psivar-EFP-DISP-ENERGY", false]], "efp elst energy": [[1776, "psivar-EFP-ELST-ENERGY", false]], "efp exch energy": [[1776, "psivar-EFP-EXCH-ENERGY", false]], "efp ind energy": [[1776, "psivar-EFP-IND-ENERGY", false]], "efp torque": [[1776, "psivar-EFP-TORQUE", false]], "efp total energy": [[1776, "psivar-EFP-TOTAL-ENERGY", false]], "efp_disp (efp)": [[1704, "term-EFP_DISP-EFP", true]], "efp_disp_damping (efp)": [[1704, "term-EFP_DISP_DAMPING-EFP", true]], "efp_elst (efp)": [[1704, "term-EFP_ELST-EFP", true]], "efp_elst_damping (efp)": [[1704, "term-EFP_ELST_DAMPING-EFP", true]], "efp_exch (efp)": [[1704, "term-EFP_EXCH-EFP", true]], "efp_ind (efp)": [[1704, "term-EFP_IND-EFP", true]], "efp_ind_damping (efp)": [[1704, "term-EFP_IND_DAMPING-EFP", true]], "efp_qm_elst (efp)": [[1704, "term-EFP_QM_ELST-EFP", true]], "efp_qm_ind (efp)": [[1704, "term-EFP_QM_IND-EFP", true]], "efzc() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.efzc", false]], "ekt_ea (occ)": [[1704, "term-EKT_EA-OCC", true]], "ekt_ip (dfocc)": [[1704, "term-EKT_IP-DFOCC", true]], "ekt_ip (occ)": [[1704, "term-EKT_IP-OCC", true]], "electric_field() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.electric_field", false]], "electric_field() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.electric_field", false]], "electric_field_value() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.electric_field_value", false]], "electricfieldint (class in psi4.core)": [[71, "psi4.core.ElectricFieldInt", false]], "electrostatic() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.electrostatic", false]], "electrostatic_potential_value() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.electrostatic_potential_value", false]], "electrostaticint (class in psi4.core)": [[72, "psi4.core.ElectrostaticInt", false]], "elevation (psi4.driver.p4util.inpsight attribute)": [[323, "psi4.driver.p4util.InPsight.elevation", false]], "elst() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.elst", false]], "embedding_charges (psi4.driver.driver_nbody.manybodycomputer attribute)": [[1794, "psi4.driver.driver_nbody.ManyBodyComputer.embedding_charges", false]], "empiricaldispersion (class in psi4.driver)": [[267, "psi4.driver.EmpiricalDispersion", false]], "empiricaldispersion (class in psi4.driver.procrouting.empirical_dispersion)": [[1759, "psi4.driver.procrouting.empirical_dispersion.EmpiricalDispersion", false]], "end() (psi4.core.slice method)": [[137, "psi4.core.Slice.end", false]], "energies_from_fcidump() (in module psi4.driver)": [[294, "psi4.driver.energies_from_fcidump", false]], "energies_from_fcidump() (in module psi4.driver.p4util)": [[345, "psi4.driver.p4util.energies_from_fcidump", false]], "energy()": [[1766, "index-0", false]], "energy() (in module psi4.driver)": [[295, "psi4.driver.energy", false]], "energy() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.energy", false]], "energy_level_shift (dct)": [[1704, "term-ENERGY_LEVEL_SHIFT-DCT", true]], "engine (psi4.driver.empiricaldispersion attribute)": [[267, "psi4.driver.EmpiricalDispersion.engine", false]], "engine (psi4.driver.procrouting.empirical_dispersion.empiricaldispersion attribute)": [[1759, "psi4.driver.procrouting.empirical_dispersion.EmpiricalDispersion.engine", false]], "ensure_bt_convergence (optking)": [[1704, "term-ENSURE_BT_CONVERGENCE-OPTKING", true]], "enthalpy": [[1776, "psivar-ENTHALPY", false]], "enthalpy correction": [[1776, "psivar-ENTHALPY-CORRECTION", false]], "environment variable": [[2, "index-0", false], [2, "index-1", false], [106, "index-0", false], [106, "index-1", false], [194, "index-0", false], [245, "index-0", false], [661, "index-0", false], [1206, "index-0", false], [1224, "index-0", false], [1240, "index-0", false], [1704, "index-0", false], [1704, "index-1", false], [1730, "index-4", false], [1730, "index-5", false], [1735, "envvar-BRIANQC_ENABLE", false], [1735, "envvar-BRIANQC_INSTALL_PATH", false], [1735, "envvar-BRIANQC_SDK_INSTALL", false], [1735, "index-1", false], [1735, "index-2", false], [1735, "index-3", false], [1735, "index-4", false], [1738, "envvar-CRAYPE_LINK_TYPE", false], [1738, "envvar-CRAY_ADD_RPATH", false], [1738, "envvar-MATH_ROOT", false], [1738, "envvar-MKL_ROOT", false], [1738, "index-1", false], [1738, "index-10", false], [1738, "index-11", false], [1738, "index-12", false], [1738, "index-13", false], [1738, "index-14", false], [1738, "index-15", false], [1738, "index-16", false], [1738, "index-17", false], [1738, "index-18", false], [1738, "index-19", false], [1738, "index-2", false], [1738, "index-20", false], [1738, "index-21", false], [1738, "index-22", false], [1738, "index-23", false], [1738, "index-24", false], [1738, "index-25", false], [1738, "index-26", false], [1738, "index-27", false], [1738, "index-3", false], [1738, "index-4", false], [1738, "index-5", false], [1738, "index-6", false], [1738, "index-7", false], [1738, "index-8", false], [1738, "index-9", false], [1743, "index-1", false], [1743, "index-2", false], [1743, "index-3", false], [1743, "index-4", false], [1743, "index-5", false], [1743, "index-6", false], [1743, "index-7", false], [1743, "index-8", false], [1743, "index-9", false], [1748, "index-0", false], [1748, "index-1", false], [1748, "index-2", false], [1748, "index-3", false], [1748, "index-4", false], [1748, "index-5", false], [1748, "index-6", false], [1748, "index-7", false], [1748, "index-8", false], [1750, "envvar-MONTAGE", false], [1750, "envvar-VMDPATH", false], [1750, "index-1", false], [1750, "index-2", false], [1752, "index-1", false], [1752, "index-2", false], [1756, "index-2", false], [1756, "index-3", false], [1759, "index-1", false], [1759, "index-2", false], [1767, "envvar-CONDA_PREFIX", false], [1767, "envvar-HOST", false], [1767, "envvar-MKL_NUM_THREADS", false], [1767, "envvar-OMP_NESTED", false], [1767, "envvar-OMP_NUM_THREADS", false], [1767, "envvar-PATH", false], [1767, "envvar-PSIDATADIR", false], [1767, "envvar-PSIPATH", false], [1767, "envvar-PSI_SCRATCH", false], [1767, "envvar-PYTHONPATH", false], [1767, "index-1", false], [1767, "index-10", false], [1767, "index-11", false], [1767, "index-12", false], [1767, "index-13", false], [1767, "index-14", false], [1767, "index-15", false], [1767, "index-16", false], [1767, "index-17", false], [1767, "index-18", false], [1767, "index-19", false], [1767, "index-2", false], [1767, "index-20", false], [1767, "index-21", false], [1767, "index-22", false], [1767, "index-23", false], [1767, "index-24", false], [1767, "index-3", false], [1767, "index-5", false], [1767, "index-7", false], [1767, "index-8", false], [1774, "index-1", false], [1774, "index-2", false], [1774, "index-3", false], [1782, "index-2", false], [1782, "index-3", false], [1792, "index-1", false], [1806, "index-1", false], [1807, "index-1", false], [1807, "index-2", false], [1808, "index-0", false], [1808, "index-1", false], [1827, "index-2", false], [1827, "index-3", false], [1835, "index-1", false]], "eom_guess (cceom)": [[1704, "term-EOM_GUESS-CCEOM", true]], "eom_reference (cceom)": [[1704, "term-EOM_REFERENCE-CCEOM", true]], "eom_reference (cchbar)": [[1704, "term-EOM_REFERENCE-CCHBAR", true]], "ep2_convergence (dfep2)": [[1704, "term-EP2_CONVERGENCE-DFEP2", true]], "ep2_maxiter (dfep2)": [[1704, "term-EP2_MAXITER-DFEP2", true]], "ep2_num_ea (dfep2)": [[1704, "term-EP2_NUM_EA-DFEP2", true]], "ep2_num_ip (dfep2)": [[1704, "term-EP2_NUM_IP-DFEP2", true]], "ep2_orbitals (dfep2)": [[1704, "term-EP2_ORBITALS-DFEP2", true]], "ep_ea_poles (occ)": [[1704, "term-EP_EA_POLES-OCC", true]], "ep_ip_poles (occ)": [[1704, "term-EP_IP_POLES-OCC", true]], "ep_maxiter (occ)": [[1704, "term-EP_MAXITER-OCC", true]], "epsilon_a() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.epsilon_a", false]], "epsilon_a_subset() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.epsilon_a_subset", false]], "epsilon_b() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.epsilon_b", false]], "epsilon_b_subset() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.epsilon_b_subset", false]], "erd_coef() (psi4.core.gaussianshell method)": [[81, "psi4.core.GaussianShell.erd_coef", false]], "erf_complement_eri() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.erf_complement_eri", false]], "erf_eri() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.erf_eri", false]], "eri (class in psi4.core)": [[69, "psi4.core.ERI", false]], "eri() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.eri", false]], "esp at center n": [[1776, "psivar-ESP-AT-CENTER-n", false]], "esp_at_nuclei() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.esp_at_nuclei", false]], "esppropcalc (class in psi4.core)": [[70, "psi4.core.ESPPropCalc", false]], "evals() (psi4.core.orbitalspace method)": [[115, "psi4.core.OrbitalSpace.evals", false]], "ex_allow (detci)": [[1704, "term-EX_ALLOW-DETCI", true]], "ex_level (detci)": [[1704, "term-EX_LEVEL-DETCI", true]], "exch() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.exch", false]], "exch_scale_alpha (sapt)": [[1704, "term-EXCH_SCALE_ALPHA-SAPT", true]], "excitation_range (cceom)": [[1704, "term-EXCITATION_RANGE-CCEOM", true]], "exists() (psi4.core.io method)": [[86, "psi4.core.IO.exists", false]], "exp() (psi4.core.gaussianshell method)": [[81, "psi4.core.GaussianShell.exp", false]], "expand_cbs_methods() (in module psi4.driver.task_planner)": [[1768, "psi4.driver.task_planner.expand_cbs_methods", false]], "expand_psivars() (in module psi4.driver.p4util)": [[346, "psi4.driver.p4util.expand_psivars", false]], "explicit_hamiltonian (cphf)": [[1704, "term-EXPLICIT_HAMILTONIAN-CPHF", true]], "exponent() (psi4.core.fittedslatercorrelationfactor method)": [[77, "psi4.core.FittedSlaterCorrelationFactor.exponent", false]], "ext_force_bend (optking)": [[1704, "term-EXT_FORCE_BEND-OPTKING", true]], "ext_force_cartesian (optking)": [[1704, "term-EXT_FORCE_CARTESIAN-OPTKING", true]], "ext_force_dihedral (optking)": [[1704, "term-EXT_FORCE_DIHEDRAL-OPTKING", true]], "ext_force_distance (optking)": [[1704, "term-EXT_FORCE_DISTANCE-OPTKING", true]], "ext_force_oofp (optking)": [[1704, "term-EXT_FORCE_OOFP-OPTKING", true]], "extend() (psi4.core.bsvec method)": [[5, "psi4.core.BSVec.extend", false]], "extern (scf)": [[1704, "term-EXTERN-SCF", true]], "external_pot() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.external_pot", false]], "external_potential_symmetry (globals)": [[1704, "term-EXTERNAL_POTENTIAL_SYMMETRY-GLOBALS", true]], "externalpotential (class in psi4.core)": [[73, "psi4.core.ExternalPotential", false]], "extract_subsets() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.extract_subsets", false]], "extrapolate() (psi4.driver.p4util.diis method)": [[321, "psi4.driver.p4util.DIIS.extrapolate", false]], "extrapolation": [[1740, "index-3", false]], "extrapolation schemes": [[1740, "index-3", false]], "exvals() (psi4.core.oeprop method)": [[111, "psi4.core.OEProp.Exvals", false]], "eyvals() (psi4.core.oeprop method)": [[111, "psi4.core.OEProp.Eyvals", false]], "ezvals() (psi4.core.oeprop method)": [[111, "psi4.core.OEProp.Ezvals", false]], "f12() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.f12", false]], "f12_cgtg() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.f12_cgtg", false]], "f12_double_commutator() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.f12_double_commutator", false]], "f12_squared() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.f12_squared", false]], "f12g12() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.f12g12", false]], "f_cut (dlpno)": [[1704, "term-F_CUT-DLPNO", true]], "fa() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.Fa", false]], "fa_subset() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.Fa_subset", false]], "factory() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.factory", false]], "fail_on_maxiter (scf)": [[1704, "term-FAIL_ON_MAXITER-SCF", true]], "failure (psi4.core.psireturntype attribute)": [[126, "psi4.core.PsiReturnType.Failure", false]], "favg (mcscf)": [[1704, "term-FAVG-MCSCF", true]], "favg_ccsd_t (psimrcc)": [[1704, "term-FAVG_CCSD_T-PSIMRCC", true]], "favg_start (mcscf)": [[1704, "term-FAVG_START-MCSCF", true]], "fb() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.Fb", false]], "fb_subset() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.Fb_subset", false]], "fcharge() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.fcharge", false]], "fchk": [[1769, "index-0", false]], "fchk() (in module psi4.driver)": [[296, "psi4.driver.fchk", false]], "fchkwriter (class in psi4.core)": [[74, "psi4.core.FCHKWriter", false]], "fci (detci)": [[1704, "term-FCI-DETCI", true]], "fci correlation energy": [[1776, "psivar-FCI-CORRELATION-ENERGY", false]], "fci total energy": [[1776, "psivar-FCI-TOTAL-ENERGY", false]], "fci_strings (detci)": [[1704, "term-FCI_STRINGS-DETCI", true]], "fcidump() (in module psi4.driver)": [[297, "psi4.driver.fcidump", false]], "fcidump() (in module psi4.driver.p4util)": [[347, "psi4.driver.p4util.fcidump", false]], "fcidump_from_file() (in module psi4.driver)": [[298, "psi4.driver.fcidump_from_file", false]], "fcidump_from_file() (in module psi4.driver.p4util)": [[348, "psi4.driver.p4util.fcidump_from_file", false]], "fcidump_tei_helper() (in module psi4.core)": [[187, "psi4.core.fcidump_tei_helper", false]], "fctl dispersion correction energy": [[1776, "psivar-fctl-DISPERSION-CORRECTION-ENERGY", false]], "fctldash (psi4.driver.empiricaldispersion attribute)": [[267, "psi4.driver.EmpiricalDispersion.fctldash", false]], "fctldash (psi4.driver.procrouting.empirical_dispersion.empiricaldispersion attribute)": [[1759, "psi4.driver.procrouting.empirical_dispersion.EmpiricalDispersion.fctldash", false]], "fd_project (findif)": [[1704, "term-FD_PROJECT-FINDIF", true]], "fdds_dispersion (class in psi4.core)": [[75, "psi4.core.FDDS_Dispersion", false]], "fdisp() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.fdisp", false]], "felst() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.felst", false]], "fexch() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.fexch", false]], "fill() (psi4.core.dimension method)": [[64, "psi4.core.Dimension.fill", false]], "filter_guess (detci)": [[1704, "term-FILTER_GUESS-DETCI", true]], "filter_guess_det1 (detci)": [[1704, "term-FILTER_GUESS_DET1-DETCI", true]], "filter_guess_det2 (detci)": [[1704, "term-FILTER_GUESS_DET2-DETCI", true]], "filter_guess_sign (detci)": [[1704, "term-FILTER_GUESS_SIGN-DETCI", true]], "filter_nonvib() (in module psi4.driver.qcdb.vib)": [[384, "psi4.driver.qcdb.vib.filter_nonvib", false]], "filter_omega_to_real() (in module psi4.driver.qcdb.vib)": [[385, "psi4.driver.qcdb.vib.filter_omega_to_real", false]], "filter_zero_det (detci)": [[1704, "term-FILTER_ZERO_DET-DETCI", true]], "finalize() (in module psi4.core)": [[188, "psi4.core.finalize", false]], "finalize() (psi4.core.hf method)": [[84, "psi4.core.HF.finalize", false]], "finalize() (psi4.core.jk method)": [[92, "psi4.core.JK.finalize", false]], "finalize() (psi4.core.vbase method)": [[147, "psi4.core.VBase.finalize", false]], "finalize_energy() (psi4.core.hf method)": [[84, "psi4.core.HF.finalize_energy", false]], "find() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.find", false]], "find_approximate_string_matches() (in module psi4.driver)": [[299, "psi4.driver.find_approximate_string_matches", false]], "find_approximate_string_matches() (in module psi4.driver.p4util)": [[349, "psi4.driver.p4util.find_approximate_string_matches", false]], "find_highest_point_group() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.find_highest_point_group", false]], "find_occupation() (psi4.core.hf method)": [[84, "psi4.core.HF.find_occupation", false]], "find_point_group() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.find_point_group", false]], "findif number": [[1776, "psivar-FINDIF-NUMBER", false]], "findifrec (psi4.driver.driver_findif.finitedifferencecomputer attribute)": [[1772, "psi4.driver.driver_findif.FiniteDifferenceComputer.findifrec", false]], "first() (psi4.core.aoshellcombinationsiterator method)": [[3, "psi4.core.AOShellCombinationsIterator.first", false]], "fisapt": [[1770, "index-0", false]], "fisapt (class in psi4.core)": [[76, "psi4.core.FISAPT", false]], "fisapt_charge_completeness (fisapt)": [[1704, "term-FISAPT_CHARGE_COMPLETENESS-FISAPT", true]], "fisapt_cube_densmat (fisapt)": [[1704, "term-FISAPT_CUBE_DENSMAT-FISAPT", true]], "fisapt_cube_linkibos (fisapt)": [[1704, "term-FISAPT_CUBE_LINKIBOS-FISAPT", true]], "fisapt_cube_linkihos (fisapt)": [[1704, "term-FISAPT_CUBE_LINKIHOS-FISAPT", true]], "fisapt_do_fsapt (fisapt)": [[1704, "term-FISAPT_DO_FSAPT-FISAPT", true]], "fisapt_do_fsapt_disp (fisapt)": [[1704, "term-FISAPT_DO_FSAPT_DISP-FISAPT", true]], "fisapt_do_plot (fisapt)": [[1704, "term-FISAPT_DO_PLOT-FISAPT", true]], "fisapt_exch_parperp (fisapt)": [[1704, "term-FISAPT_EXCH_PARPERP-FISAPT", true]], "fisapt_fsapt_exch_scale (fisapt)": [[1704, "term-FISAPT_FSAPT_EXCH_SCALE-FISAPT", true]], "fisapt_fsapt_filepath (fisapt)": [[1704, "term-FISAPT_FSAPT_FILEPATH-FISAPT", true]], "fisapt_fsapt_ind_response (fisapt)": [[1704, "term-FISAPT_FSAPT_IND_RESPONSE-FISAPT", true]], "fisapt_fsapt_ind_scale (fisapt)": [[1704, "term-FISAPT_FSAPT_IND_SCALE-FISAPT", true]], "fisapt_fssapt_filepath (fisapt)": [[1704, "term-FISAPT_FSSAPT_FILEPATH-FISAPT", true]], "fisapt_link_assignment (fisapt)": [[1704, "term-FISAPT_LINK_ASSIGNMENT-FISAPT", true]], "fisapt_link_ortho (fisapt)": [[1704, "term-FISAPT_LINK_ORTHO-FISAPT", true]], "fisapt_link_selection (fisapt)": [[1704, "term-FISAPT_LINK_SELECTION-FISAPT", true]], "fisapt_manual_links (fisapt)": [[1704, "term-FISAPT_MANUAL_LINKS-FISAPT", true]], "fisapt_mem_safety_factor (fisapt)": [[1704, "term-FISAPT_MEM_SAFETY_FACTOR-FISAPT", true]], "fisapt_plot_filepath (fisapt)": [[1704, "term-FISAPT_PLOT_FILEPATH-FISAPT", true]], "fittedslatercorrelationfactor (class in psi4.core)": [[77, "psi4.core.FittedSlaterCorrelationFactor", false]], "fittingmetric (class in psi4.core)": [[78, "psi4.core.FittingMetric", false]], "fix_com() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.fix_com", false]], "fix_orientation() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.fix_orientation", false]], "flabel() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.flabel", false]], "flexible_g_convergence (optking)": [[1704, "term-FLEXIBLE_G_CONVERGENCE-OPTKING", true]], "flocalize() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.flocalize", false]], "flush_outfile() (in module psi4.core)": [[189, "psi4.core.flush_outfile", false]], "fmass() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.fmass", false]], "fno-cc": [[1771, "index-0", false]], "fno-ccsd(t)": [[1771, "index-1", false]], "fno-mp4": [[1771, "index-1", false]], "fno-qcisd(t)": [[1771, "index-1", false]], "fnocc": [[1771, "index-2", false], [1771, "index-3", false]], "fnocc() (in module psi4.core)": [[190, "psi4.core.fnocc", false]], "follow_root (detci)": [[1704, "term-FOLLOW_ROOT-DETCI", true]], "follow_root (mcscf)": [[1704, "term-FOLLOW_ROOT-MCSCF", true]], "follow_root (psimrcc)": [[1704, "term-FOLLOW_ROOT-PSIMRCC", true]], "follow_step_increment (scf)": [[1704, "term-FOLLOW_STEP_INCREMENT-SCF", true]], "follow_step_scale (scf)": [[1704, "term-FOLLOW_STEP_SCALE-SCF", true]], "follow_vector (detci)": [[1704, "term-FOLLOW_VECTOR-DETCI", true]], "force_occpi() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.force_occpi", false]], "force_restart (ccenergy)": [[1704, "term-FORCE_RESTART-CCENERGY", true]], "force_twocon (mcscf)": [[1704, "term-FORCE_TWOCON-MCSCF", true]], "form_aux_matrices() (psi4.core.fdds_dispersion method)": [[75, "psi4.core.FDDS_Dispersion.form_aux_matrices", false]], "form_c() (psi4.core.hf method)": [[84, "psi4.core.HF.form_C", false]], "form_cholesky_inverse() (psi4.core.fittingmetric method)": [[78, "psi4.core.FittingMetric.form_cholesky_inverse", false]], "form_d() (psi4.core.hf method)": [[84, "psi4.core.HF.form_D", false]], "form_eig_inverse() (psi4.core.fittingmetric method)": [[78, "psi4.core.FittingMetric.form_eig_inverse", false]], "form_f() (psi4.core.hf method)": [[84, "psi4.core.HF.form_F", false]], "form_fdsmsdf() (psi4.core.hf method)": [[84, "psi4.core.HF.form_FDSmSDF", false]], "form_fitting_metric() (psi4.core.fittingmetric method)": [[78, "psi4.core.FittingMetric.form_fitting_metric", false]], "form_full_inverse() (psi4.core.fittingmetric method)": [[78, "psi4.core.FittingMetric.form_full_inverse", false]], "form_g() (psi4.core.hf method)": [[84, "psi4.core.HF.form_G", false]], "form_h() (psi4.core.hf method)": [[84, "psi4.core.HF.form_H", false]], "form_initial_c() (psi4.core.hf method)": [[84, "psi4.core.HF.form_initial_C", false]], "form_initial_f() (psi4.core.hf method)": [[84, "psi4.core.HF.form_initial_F", false]], "form_opdm() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.form_opdm", false]], "form_qr_inverse() (psi4.core.fittingmetric method)": [[78, "psi4.core.FittingMetric.form_QR_inverse", false]], "form_rotation_matrix() (psi4.core.somcscf method)": [[133, "psi4.core.SOMCSCF.form_rotation_matrix", false]], "form_shalf() (psi4.core.hf method)": [[84, "psi4.core.HF.form_Shalf", false]], "form_symmetry_information() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.form_symmetry_information", false]], "form_tpdm() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.form_tpdm", false]], "form_unc_amplitude() (psi4.core.fdds_dispersion method)": [[75, "psi4.core.FDDS_Dispersion.form_unc_amplitude", false]], "form_v() (psi4.core.hf method)": [[84, "psi4.core.HF.form_V", false]], "format_molecule_for_input() (in module psi4.driver.p4util)": [[350, "psi4.driver.p4util.format_molecule_for_input", false]], "format_molecule_for_mol() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.format_molecule_for_mol", false]], "format_options_for_input() (in module psi4.driver.p4util)": [[351, "psi4.driver.p4util.format_options_for_input", false]], "frac_diis (scf)": [[1704, "term-FRAC_DIIS-SCF", true]], "frac_load (scf)": [[1704, "term-FRAC_LOAD-SCF", true]], "frac_nuke() (in module psi4.driver.frac)": [[1768, "psi4.driver.frac.frac_nuke", false]], "frac_occ (scf)": [[1704, "term-FRAC_OCC-SCF", true]], "frac_performed_ (psi4.core.hf attribute)": [[84, "psi4.core.HF.frac_performed_", false]], "frac_renormalize (scf)": [[1704, "term-FRAC_RENORMALIZE-SCF", true]], "frac_renormalize() (psi4.core.hf method)": [[84, "psi4.core.HF.frac_renormalize", false]], "frac_start (scf)": [[1704, "term-FRAC_START-SCF", true]], "frac_traverse() (in module psi4.driver.frac)": [[1768, "psi4.driver.frac.frac_traverse", false]], "frac_val (scf)": [[1704, "term-FRAC_VAL-SCF", true]], "frag_mode (optking)": [[1704, "term-FRAG_MODE-OPTKING", true]], "frag_ref_atoms (optking)": [[1704, "term-FRAG_REF_ATOMS-OPTKING", true]], "fragmenttype (class in psi4.core)": [[79, "psi4.core.FragmentType", false]], "free_atom_volumes() (in module psi4.driver.p4util)": [[352, "psi4.driver.p4util.free_atom_volumes", false]], "freeze_all_dihedrals (optking)": [[1704, "term-FREEZE_ALL_DIHEDRALS-OPTKING", true]], "freeze_core (globals)": [[1704, "term-FREEZE_CORE-GLOBALS", true]], "freeze_core (sapt)": [[1704, "term-FREEZE_CORE-SAPT", true]], "freeze_core() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.freeze_core", false]], "freeze_core_policy (globals)": [[1704, "term-FREEZE_CORE_POLICY-GLOBALS", true]], "freeze_interfrag (optking)": [[1704, "term-FREEZE_INTERFRAG-OPTKING", true]], "freeze_intrafrag (optking)": [[1704, "term-FREEZE_INTRAFRAG-OPTKING", true]], "freq()": [[1772, "index-0", false]], "freq() (in module psi4.driver)": [[300, "psi4.driver.freq", false]], "frequencies()": [[1772, "index-0", false]], "frequencies() (in module psi4.driver)": [[301, "psi4.driver.frequencies", false]], "frequencies() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.frequencies", false]], "frequency()": [[1772, "index-0", false]], "frequency() (in module psi4.driver)": [[302, "psi4.driver.frequency", false]], "frequency();": [[1772, "index-0", false]], "from_array() (psi4.core.matrix class method)": [[100, "psi4.core.Matrix.from_array", false]], "from_array() (psi4.core.vector class method)": [[148, "psi4.core.Vector.from_array", false]], "from_arrays() (psi4.core.molecule class method)": [[106, "psi4.core.Molecule.from_arrays", false]], "from_dict() (psi4.core.molecule static method)": [[106, "psi4.core.Molecule.from_dict", false]], "from_file() (psi4.core.wavefunction static method)": [[150, "psi4.core.Wavefunction.from_file", false]], "from_list() (psi4.core.dimension class method)": [[64, "psi4.core.Dimension.from_list", false]], "from_list() (psi4.core.matrix class method)": [[100, "psi4.core.Matrix.from_list", false]], "from_list() (psi4.core.vector class method)": [[148, "psi4.core.Vector.from_list", false]], "from_schema() (psi4.core.molecule class method)": [[106, "psi4.core.Molecule.from_schema", false]], "from_serial() (psi4.core.matrix class method)": [[100, "psi4.core.Matrix.from_serial", false]], "from_serial() (psi4.core.vector class method)": [[148, "psi4.core.Vector.from_serial", false]], "from_string() (psi4.core.molecule class method)": [[106, "psi4.core.Molecule.from_string", false]], "frozen natural orbital coupled cluster": [[1771, "index-0", false]], "frozen natural orbitals": [[1771, "index-1", false]], "frozen_bend (optking)": [[1704, "term-FROZEN_BEND-OPTKING", true]], "frozen_cartesian (optking)": [[1704, "term-FROZEN_CARTESIAN-OPTKING", true]], "frozen_dihedral (optking)": [[1704, "term-FROZEN_DIHEDRAL-OPTKING", true]], "frozen_distance (optking)": [[1704, "term-FROZEN_DISTANCE-OPTKING", true]], "frozen_docc (globals)": [[1704, "term-FROZEN_DOCC-GLOBALS", true]], "frozen_oofp (optking)": [[1704, "term-FROZEN_OOFP-OPTKING", true]], "frozen_uocc (globals)": [[1704, "term-FROZEN_UOCC-GLOBALS", true]], "frzcpi() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.frzcpi", false]], "frzvpi() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.frzvpi", false]], "fsymbol() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.fsymbol", false]], "ftrue_atomic_number() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.ftrue_atomic_number", false]], "full (psi4.core.savetype attribute)": [[135, "psi4.core.SaveType.Full", false]], "full_geometry() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.full_geometry", false]], "full_hess_every (optking)": [[1704, "term-FULL_HESS_EVERY-OPTKING", true]], "full_matrix (cceom)": [[1704, "term-FULL_MATRIX-CCEOM", true]], "full_name() (psi4.core.pointgroup method)": [[120, "psi4.core.PointGroup.full_name", false]], "full_pg_n() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.full_pg_n", false]], "function call": [[1772, "index-0", false], [1800, "index-0", false]], "function_index (psi4.core.gaussianshell attribute)": [[81, "psi4.core.GaussianShell.function_index", false]], "function_to_center() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.function_to_center", false]], "function_to_shell() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.function_to_shell", false]], "functional (class in psi4.core)": [[80, "psi4.core.Functional", false]], "functional() (psi4.core.hf method)": [[84, "psi4.core.HF.functional", false]], "functional() (psi4.core.vbase method)": [[147, "psi4.core.VBase.functional", false]], "functionals": [[1784, "index-0", false]], "functions_local_to_global() (psi4.core.blockopoints method)": [[9, "psi4.core.BlockOPoints.functions_local_to_global", false]], "fx() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.fx", false]], "fy() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.fy", false]], "fz() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.fZ", false], [106, "psi4.core.Molecule.fz", false]], "fzc() (psi4.core.mospace static method)": [[98, "psi4.core.MOSpace.fzc", false]], "fzv() (psi4.core.mospace static method)": [[98, "psi4.core.MOSpace.fzv", false]], "g_convergence (optking)": [[1704, "term-G_CONVERGENCE-OPTKING", true]], "gamma (psi4.driver.p4util.lineshape attribute)": [[324, "psi4.driver.p4util.Lineshape.gamma", false]], "gamma() (psi4.core.charactertable method)": [[17, "psi4.core.CharacterTable.gamma", false]], "gau2grid": [[1773, "index-0", false]], "gauge (adc)": [[1704, "term-GAUGE-ADC", true]], "gauge (ccdensity)": [[1704, "term-GAUGE-CCDENSITY", true]], "gauge (ccresponse)": [[1704, "term-GAUGE-CCRESPONSE", true]], "gaussian (class in psi4.driver.p4util)": [[322, "psi4.driver.p4util.Gaussian", false]], "gaussian formatted checkpoint": [[1769, "index-0", false]], "gaussianshell (class in psi4.core)": [[81, "psi4.core.GaussianShell", false]], "gaussiantype (class in psi4.core)": [[82, "psi4.core.GaussianType", false]], "gcp": [[1774, "index-0", false]], "gdma": [[1775, "index-0", false]], "gdma() (in module psi4.driver)": [[303, "psi4.driver.gdma", false]], "gdma_limit (gdma)": [[1704, "term-GDMA_LIMIT-GDMA", true]], "gdma_multipole_units (gdma)": [[1704, "term-GDMA_MULTIPOLE_UNITS-GDMA", true]], "gdma_origin (gdma)": [[1704, "term-GDMA_ORIGIN-GDMA", true]], "gdma_radius (gdma)": [[1704, "term-GDMA_RADIUS-GDMA", true]], "gdma_switch (gdma)": [[1704, "term-GDMA_SWITCH-GDMA", true]], "gemm() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.gemm", false]], "genbas() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.genbas", false]], "general": [[1832, "index-2", false]], "general_invert() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.general_invert", false]], "geom_maxiter (optking)": [[1704, "term-GEOM_MAXITER-OPTKING", true]], "geometry optimization": [[1800, "index-0", false], [1802, "index-1", false], [1802, "index-2", false], [1802, "index-3", false], [1802, "index-4", false]], "geometry optimization, optimization": [[1802, "index-0", false]], "geometry() (in module psi4.driver)": [[304, "psi4.driver.geometry", false]], "geometry() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.geometry", false]], "geometryunits (class in psi4.core)": [[83, "psi4.core.GeometryUnits", false]], "get() (psi4.core.intvector method)": [[88, "psi4.core.IntVector.get", false]], "get() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.get", false]], "get() (psi4.core.vector method)": [[148, "psi4.core.Vector.get", false]], "get_active_molecule() (in module psi4.core)": [[191, "psi4.core.get_active_molecule", false]], "get_algorithm() (psi4.core.fittingmetric method)": [[78, "psi4.core.FittingMetric.get_algorithm", false]], "get_amplitudes() (psi4.core.ccwavefunction method)": [[11, "psi4.core.CCWavefunction.get_amplitudes", false]], "get_ao_core() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.get_AO_core", false]], "get_ao_size() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.get_AO_size", false]], "get_array() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.get_array", false]], "get_array_variable() (in module psi4.core)": [[192, "psi4.core.get_array_variable", false]], "get_array_variables() (in module psi4.core)": [[193, "psi4.core.get_array_variables", false]], "get_basisset() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.get_basisset", false]], "get_block() (psi4.core.intvector method)": [[88, "psi4.core.IntVector.get_block", false]], "get_block() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.get_block", false]], "get_block() (psi4.core.vbase method)": [[147, "psi4.core.VBase.get_block", false]], "get_block() (psi4.core.vector method)": [[148, "psi4.core.Vector.get_block", false]], "get_bool() (psi4.core.options method)": [[114, "psi4.core.Options.get_bool", false]], "get_cosx_grid() (psi4.core.compositejk method)": [[18, "psi4.core.CompositeJK.get_COSX_grid", false]], "get_current_module() (psi4.core.options method)": [[114, "psi4.core.Options.get_current_module", false]], "get_datadir() (in module psi4.core)": [[194, "psi4.core.get_datadir", false]], "get_default_namespace() (psi4.core.io static method)": [[86, "psi4.core.IO.get_default_namespace", false]], "get_default_path() (psi4.core.iomanager method)": [[87, "psi4.core.IOManager.get_default_path", false]], "get_density() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.get_density", false]], "get_dimension() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.get_dimension", false]], "get_dipole_field_strength() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.get_dipole_field_strength", false]], "get_double() (psi4.core.options method)": [[114, "psi4.core.Options.get_double", false]], "get_dpd_id() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.get_dpd_id", false]], "get_energies() (psi4.core.hf method)": [[84, "psi4.core.HF.get_energies", false]], "get_file_path() (psi4.core.iomanager method)": [[87, "psi4.core.IOManager.get_file_path", false]], "get_fragment_charges() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.get_fragment_charges", false]], "get_fragment_multiplicities() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.get_fragment_multiplicities", false]], "get_fragment_types() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.get_fragment_types", false]], "get_fragments() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.get_fragments", false]], "get_frozen_core_energy() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.get_frozen_core_energy", false]], "get_full_point_group() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.get_full_point_group", false]], "get_full_point_group_with_n() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.get_full_point_group_with_n", false]], "get_global_option() (in module psi4.core)": [[195, "psi4.core.get_global_option", false]], "get_global_option_list() (in module psi4.core)": [[196, "psi4.core.get_global_option_list", false]], "get_int() (psi4.core.options method)": [[114, "psi4.core.Options.get_int", false]], "get_int_vector() (psi4.core.options method)": [[114, "psi4.core.Options.get_int_vector", false]], "get_keep_dpd_so_ints() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.get_keep_dpd_so_ints", false]], "get_keep_ht_ints() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.get_keep_ht_ints", false]], "get_keep_iwl_so_ints() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.get_keep_iwl_so_ints", false]], "get_local_option() (in module psi4.core)": [[197, "psi4.core.get_local_option", false]], "get_memory() (in module psi4.core)": [[198, "psi4.core.get_memory", false]], "get_memory() (in module psi4.driver)": [[305, "psi4.driver.get_memory", false]], "get_memory() (in module psi4.driver.p4util)": [[353, "psi4.driver.p4util.get_memory", false]], "get_memory() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.get_memory", false]], "get_memory() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.get_memory", false]], "get_method() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.get_method", false]], "get_metric() (psi4.core.fittingmetric method)": [[78, "psi4.core.FittingMetric.get_metric", false]], "get_mix_data() (psi4.core.libxcfunctional method)": [[96, "psi4.core.LibXCFunctional.get_mix_data", false]], "get_mo_core() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.get_MO_core", false]], "get_np_xyzw() (psi4.core.vbase method)": [[147, "psi4.core.VBase.get_np_xyzw", false]], "get_num_threads() (in module psi4.core)": [[199, "psi4.core.get_num_threads", false]], "get_omega() (psi4.core.jk method)": [[92, "psi4.core.JK.get_omega", false]], "get_omega_alpha() (psi4.core.jk method)": [[92, "psi4.core.JK.get_omega_alpha", false]], "get_omega_beta() (psi4.core.jk method)": [[92, "psi4.core.JK.get_omega_beta", false]], "get_opdm() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.get_opdm", false]], "get_option() (in module psi4.core)": [[200, "psi4.core.get_option", false]], "get_options() (in module psi4.core)": [[201, "psi4.core.get_options", false]], "get_orbitals() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.get_orbitals", false]], "get_output_file() (in module psi4.core)": [[202, "psi4.core.get_output_file", false]], "get_pivots() (psi4.core.fittingmetric method)": [[78, "psi4.core.FittingMetric.get_pivots", false]], "get_print() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.get_print", false]], "get_print() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.get_print", false]], "get_psi_results() (psi4.driver.driver_cbs.compositecomputer method)": [[1740, "psi4.driver.driver_cbs.CompositeComputer.get_psi_results", false]], "get_psi_results() (psi4.driver.driver_findif.finitedifferencecomputer method)": [[1772, "psi4.driver.driver_findif.FiniteDifferenceComputer.get_psi_results", false]], "get_psi_results() (psi4.driver.driver_nbody.manybodycomputer method)": [[1794, "psi4.driver.driver_nbody.ManyBodyComputer.get_psi_results", false]], "get_psifile() (in module psi4.driver.p4util)": [[354, "psi4.driver.p4util.get_psifile", false]], "get_psio() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.get_psio", false]], "get_results() (psi4.driver.atomiccomputer method)": [[265, "psi4.driver.AtomicComputer.get_results", false]], "get_results() (psi4.driver.driver_cbs.compositecomputer method)": [[1740, "psi4.driver.driver_cbs.CompositeComputer.get_results", false]], "get_results() (psi4.driver.driver_findif.finitedifferencecomputer method)": [[1772, "psi4.driver.driver_findif.FiniteDifferenceComputer.get_results", false]], "get_results() (psi4.driver.driver_nbody.manybodycomputer method)": [[1794, "psi4.driver.driver_nbody.ManyBodyComputer.get_results", false]], "get_reverse_pivots() (psi4.core.fittingmetric method)": [[78, "psi4.core.FittingMetric.get_reverse_pivots", false]], "get_schwarz_cutoff() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.get_schwarz_cutoff", false]], "get_scratch_filename() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.get_scratch_filename", false]], "get_snlink_max_am() (psi4.core.compositejk method)": [[18, "psi4.core.CompositeJK.get_snLinK_max_am", false]], "get_space_size() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.get_space_size", false]], "get_str() (psi4.core.options method)": [[114, "psi4.core.Options.get_str", false]], "get_tei_already_presorted() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.get_tei_already_presorted", false]], "get_tensor() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.get_tensor", false]], "get_tensor_pqq() (psi4.core.fdds_dispersion method)": [[75, "psi4.core.FDDS_Dispersion.get_tensor_pqQ", false]], "get_tensor_shape() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.get_tensor_shape", false]], "get_tensor_size() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.get_tensor_size", false]], "get_tpdm() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.get_tpdm", false]], "get_variable() (in module psi4.core)": [[203, "psi4.core.get_variable", false]], "get_variable() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.get_variable", false]], "get_variable() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.get_variable", false]], "get_variables() (in module psi4.core)": [[204, "psi4.core.get_variables", false]], "get_wcombine() (psi4.core.jk method)": [[92, "psi4.core.JK.get_wcombine", false]], "get_writer_file_prefix() (in module psi4.core)": [[205, "psi4.core.get_writer_file_prefix", false]], "get_x1() (psi4.core.ls_thc_computer method)": [[94, "psi4.core.LS_THC_Computer.get_x1", false]], "get_x2() (psi4.core.ls_thc_computer method)": [[94, "psi4.core.LS_THC_Computer.get_x2", false]], "get_x3() (psi4.core.ls_thc_computer method)": [[94, "psi4.core.LS_THC_Computer.get_x3", false]], "get_x4() (psi4.core.ls_thc_computer method)": [[94, "psi4.core.LS_THC_Computer.get_x4", false]], "get_z() (psi4.core.ls_thc_computer method)": [[94, "psi4.core.LS_THC_Computer.get_Z", false]], "getattr_ignorecase() (in module psi4.driver.p4util)": [[355, "psi4.driver.p4util.getattr_ignorecase", false]], "getcharges() (psi4.core.externalpotential method)": [[73, "psi4.core.ExternalPotential.getCharges", false]], "getpid() (psi4.core.io method)": [[86, "psi4.core.IO.getpid", false]], "ghost": [[1833, "index-3", false]], "ghost (psi4.core.fragmenttype attribute)": [[79, "psi4.core.FragmentType.Ghost", false]], "ghost atoms": [[1833, "index-3", false]], "gibbs free energy": [[1776, "psivar-GIBBS-FREE-ENERGY", false]], "gibbs free energy correction": [[1776, "psivar-GIBBS-FREE-ENERGY-CORRECTION", false]], "git_version() (in module psi4.core)": [[206, "psi4.core.git_version", false]], "grac_alpha() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.grac_alpha", false]], "grac_beta() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.grac_beta", false]], "grac_shift() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.grac_shift", false]], "gradient": [[1800, "index-0", false]], "gradient() (in module psi4.driver)": [[306, "psi4.driver.gradient", false]], "gradient() (psi4.core.somcscf method)": [[133, "psi4.core.SOMCSCF.gradient", false]], "gradient() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.gradient", false]], "gradient_on_charges() (psi4.core.externalpotential method)": [[73, "psi4.core.ExternalPotential.gradient_on_charges", false]], "gradient_rms() (psi4.core.somcscf method)": [[133, "psi4.core.SOMCSCF.gradient_rms", false]], "gradient_write (findif)": [[1704, "term-GRADIENT_WRITE-FINDIF", true]], "grid electrons alpha": [[1776, "psivar-GRID-ELECTRONS-ALPHA", false]], "grid electrons beta": [[1776, "psivar-GRID-ELECTRONS-BETA", false]], "grid electrons total": [[1776, "psivar-GRID-ELECTRONS-TOTAL", false]], "grid() (psi4.core.vbase method)": [[147, "psi4.core.VBase.grid", false]], "group() (psi4.core.correlationtable method)": [[20, "psi4.core.CorrelationTable.group", false]], "guess (scf)": [[1704, "term-GUESS-SCF", true]], "guess() (psi4.core.hf method)": [[84, "psi4.core.HF.guess", false]], "guess_ca() (psi4.core.hf method)": [[84, "psi4.core.HF.guess_Ca", false]], "guess_cb() (psi4.core.hf method)": [[84, "psi4.core.HF.guess_Cb", false]], "guess_mix (scf)": [[1704, "term-GUESS_MIX-SCF", true]], "guess_persist (scf)": [[1704, "term-GUESS_PERSIST-SCF", true]], "guess_r_convergence (dct)": [[1704, "term-GUESS_R_CONVERGENCE-DCT", true]], "guess_vector (detci)": [[1704, "term-GUESS_VECTOR-DETCI", true]], "h() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.H", false]], "h0_block_coupling (detci)": [[1704, "term-H0_BLOCK_COUPLING-DETCI", true]], "h0_block_coupling_size (detci)": [[1704, "term-H0_BLOCK_COUPLING_SIZE-DETCI", true]], "h0_blocksize (detci)": [[1704, "term-H0_BLOCKSIZE-DETCI", true]], "h0_guess_size (detci)": [[1704, "term-H0_GUESS_SIZE-DETCI", true]], "h_approx_diag() (psi4.core.somcscf method)": [[133, "psi4.core.SOMCSCF.H_approx_diag", false]], "h_bond_connect (optking)": [[1704, "term-H_BOND_CONNECT-OPTKING", true]], "h_guess_every (optking)": [[1704, "term-H_GUESS_EVERY-OPTKING", true]], "h_update_den_tol (optking)": [[1704, "term-H_UPDATE_DEN_TOL-OPTKING", true]], "hamiltonian() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.hamiltonian", false]], "hamiltonian_solver() (in module psi4.driver.p4util)": [[356, "psi4.driver.p4util.hamiltonian_solver", false]], "harmonic vibrational analysis, vibrational analysis, thermochemical analysis": [[1843, "index-0", false]], "harmonic_analysis() (in module psi4.driver.qcdb.vib)": [[386, "psi4.driver.qcdb.vib.harmonic_analysis", false]], "hartree--fock": [[1838, "index-0", false]], "has_array_variable() (in module psi4.core)": [[207, "psi4.core.has_array_variable", false]], "has_array_variable() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.has_array_variable", false]], "has_ecp() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.has_ECP", false]], "has_global_option_changed() (in module psi4.core)": [[208, "psi4.core.has_global_option_changed", false]], "has_local_option_changed() (in module psi4.core)": [[209, "psi4.core.has_local_option_changed", false]], "has_option_changed() (in module psi4.core)": [[210, "psi4.core.has_option_changed", false]], "has_potential_variable() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.has_potential_variable", false]], "has_puream() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.has_puream", false]], "has_scalar_variable() (in module psi4.core)": [[211, "psi4.core.has_scalar_variable", false]], "has_scalar_variable() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.has_scalar_variable", false]], "has_variable() (in module psi4.core)": [[212, "psi4.core.has_variable", false]], "has_variable() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.has_variable", false]], "has_zmatrix() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.has_zmatrix", false]], "hd_avg (detci)": [[1704, "term-HD_AVG-DETCI", true]], "hd_otf (detci)": [[1704, "term-HD_OTF-DETCI", true]], "hd_vector() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.Hd_vector", false]], "heff4 (psimrcc)": [[1704, "term-HEFF4-PSIMRCC", true]], "heff_print (psimrcc)": [[1704, "term-HEFF_PRINT-PSIMRCC", true]], "height (psi4.driver.p4util.inpsight attribute)": [[323, "psi4.driver.p4util.InPsight.height", false]], "hermitivitize() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.hermitivitize", false]], "hermitize() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.hermitize", false]], "hess_type (dfocc)": [[1704, "term-HESS_TYPE-DFOCC", true]], "hess_update (optking)": [[1704, "term-HESS_UPDATE-OPTKING", true]], "hess_update_limit (optking)": [[1704, "term-HESS_UPDATE_LIMIT-OPTKING", true]], "hess_update_limit_max (optking)": [[1704, "term-HESS_UPDATE_LIMIT_MAX-OPTKING", true]], "hess_update_limit_scale (optking)": [[1704, "term-HESS_UPDATE_LIMIT_SCALE-OPTKING", true]], "hess_update_use_last (optking)": [[1704, "term-HESS_UPDATE_USE_LAST-OPTKING", true]], "hessian": [[1772, "index-0", false]], "hessian() (in module psi4.driver)": [[307, "psi4.driver.hessian", false]], "hessian() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.hessian", false]], "hessian_symmetrize() (in module psi4.driver.qcdb.vib)": [[387, "psi4.driver.qcdb.vib.hessian_symmetrize", false]], "hessian_write (findif)": [[1704, "term-HESSIAN_WRITE-FINDIF", true]], "hf": [[1838, "index-0", false]], "hf (class in psi4.core)": [[84, "psi4.core.HF", false]], "hf dipole gradient": [[1776, "psivar-HF-DIPOLE-GRADIENT", false]], "hf kinetic energy": [[1776, "psivar-HF-KINETIC-ENERGY", false]], "hf potential energy": [[1776, "psivar-HF-POTENTIAL-ENERGY", false]], "hf total energy": [[1776, "psivar-HF-TOTAL-ENERGY", false]], "hf total gradient": [[1776, "psivar-HF-TOTAL-GRADIENT", false]], "hf total hessian": [[1776, "psivar-HF-TOTAL-HESSIAN", false]], "hf virial ratio": [[1776, "psivar-HF-VIRIAL-RATIO", false]], "higher-order": [[1837, "index-3", false]], "hold_met() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.hold_met", false]], "hold_options_state() (in module psi4.driver.p4util)": [[357, "psi4.driver.p4util.hold_options_state", false]], "host": [[1738, "index-21", false], [1738, "index-23", false], [1767, "envvar-HOST", false]], "i() (psi4.core.symmetryoperation method)": [[139, "psi4.core.SymmetryOperation.i", false]], "icore (detci)": [[1704, "term-ICORE-DETCI", true]], "id() (psi4.core.orbitalspace method)": [[115, "psi4.core.OrbitalSpace.id", false]], "idamax() (in module psi4.core)": [[85, "psi4.core.IDAMAX", false]], "identity() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.identity", false]], "idfmo() (psi4.core.dftensor method)": [[30, "psi4.core.DFTensor.Idfmo", false]], "imo() (psi4.core.dftensor method)": [[30, "psi4.core.DFTensor.Imo", false]], "import_ignorecase() (in module psi4.driver.p4util)": [[358, "psi4.driver.p4util.import_ignorecase", false]], "incfock (scf)": [[1704, "term-INCFOCK-SCF", true]], "incfock_convergence (scf)": [[1704, "term-INCFOCK_CONVERGENCE-SCF", true]], "incfock_full_fock_every (scf)": [[1704, "term-INCFOCK_FULL_FOCK_EVERY-SCF", true]], "ind() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.ind", false]], "induced_convergence (pe)": [[1704, "term-INDUCED_CONVERGENCE-PE", true]], "induction_operator() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.induction_operator", false]], "inertia_tensor() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.inertia_tensor", false]], "init() (psi4.core.dimension method)": [[64, "psi4.core.Dimension.init", false]], "init() (psi4.core.intvector method)": [[88, "psi4.core.IntVector.init", false]], "init() (psi4.core.vector method)": [[148, "psi4.core.Vector.init", false]], "init_io_files() (psi4.core.civector method)": [[12, "psi4.core.CIVector.init_io_files", false]], "initialize() (in module psi4.core)": [[213, "psi4.core.initialize", false]], "initialize() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.initialize", false]], "initialize() (psi4.core.hf method)": [[84, "psi4.core.HF.initialize", false]], "initialize() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.initialize", false]], "initialize() (psi4.core.jk method)": [[92, "psi4.core.JK.initialize", false]], "initialize() (psi4.core.vbase method)": [[147, "psi4.core.VBase.initialize", false]], "initialize_gtfock_jk() (psi4.core.hf method)": [[84, "psi4.core.HF.initialize_gtfock_jk", false]], "initialize_jk() (psi4.core.hf method)": [[84, "psi4.core.HF.initialize_jk", false]], "initialized_diis_manager_ (psi4.core.hf attribute)": [[84, "psi4.core.HF.initialized_diis_manager_", false]], "inpsight (class in psi4.driver.p4util)": [[323, "psi4.driver.p4util.InPsight", false]], "input_units_to_au() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.input_units_to_au", false]], "insert() (psi4.core.bsvec method)": [[5, "psi4.core.BSVec.insert", false]], "installing": [[1738, "index-0", false]], "intcos_generate_exit (optking)": [[1704, "term-INTCOS_GENERATE_EXIT-OPTKING", true]], "integral() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.integral", false]], "integral() (psi4.core.orbitalspace method)": [[115, "psi4.core.OrbitalSpace.integral", false]], "integral_cutoff (dfocc)": [[1704, "term-INTEGRAL_CUTOFF-DFOCC", true]], "integral_package (globals)": [[1704, "term-INTEGRAL_PACKAGE-GLOBALS", true]], "integralfactory (class in psi4.core)": [[89, "psi4.core.IntegralFactory", false]], "integrals": [[1783, "index-0", false], [1839, "index-0", false]], "integrals() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.integrals", false]], "integrals_erf() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.integrals_erf", false]], "integrals_erfc() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.integrals_erfc", false]], "integraltransform (class in psi4.core)": [[90, "psi4.core.IntegralTransform", false]], "interfrag_collinear_tol (optking)": [[1704, "term-INTERFRAG_COLLINEAR_TOL-OPTKING", true]], "interfrag_coords (optking)": [[1704, "term-INTERFRAG_COORDS-OPTKING", true]], "interfrag_dist_inv (optking)": [[1704, "term-INTERFRAG_DIST_INV-OPTKING", true]], "interfrag_hess (optking)": [[1704, "term-INTERFRAG_HESS-OPTKING", true]], "interfrag_mode (optking)": [[1704, "term-INTERFRAG_MODE-OPTKING", true]], "interfrag_step_limit (optking)": [[1704, "term-INTERFRAG_STEP_LIMIT-OPTKING", true]], "interfragment_connect (optking)": [[1704, "term-INTERFRAGMENT_CONNECT-OPTKING", true]], "internal_rotations (mcscf)": [[1704, "term-INTERNAL_ROTATIONS-MCSCF", true]], "intrafrag_hess (optking)": [[1704, "term-INTRAFRAG_HESS-OPTKING", true]], "intrafrag_step_limit (optking)": [[1704, "term-INTRAFRAG_STEP_LIMIT-OPTKING", true]], "intrafrag_step_limit_max (optking)": [[1704, "term-INTRAFRAG_STEP_LIMIT_MAX-OPTKING", true]], "intrafrag_step_limit_min (optking)": [[1704, "term-INTRAFRAG_STEP_LIMIT_MIN-OPTKING", true]], "ints_tolerance (ccdensity)": [[1704, "term-INTS_TOLERANCE-CCDENSITY", true]], "ints_tolerance (dct)": [[1704, "term-INTS_TOLERANCE-DCT", true]], "ints_tolerance (dfmp2)": [[1704, "term-INTS_TOLERANCE-DFMP2", true]], "ints_tolerance (fisapt)": [[1704, "term-INTS_TOLERANCE-FISAPT", true]], "ints_tolerance (mrcc)": [[1704, "term-INTS_TOLERANCE-MRCC", true]], "ints_tolerance (sapt)": [[1704, "term-INTS_TOLERANCE-SAPT", true]], "ints_tolerance (scf)": [[1704, "term-INTS_TOLERANCE-SCF", true]], "intvector (class in psi4.core)": [[88, "psi4.core.IntVector", false]], "invert() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.invert", false]], "io (class in psi4.core)": [[86, "psi4.core.IO", false]], "iomanager (class in psi4.core)": [[87, "psi4.core.IOManager", false]], "iota() (psi4.core.intvector static method)": [[88, "psi4.core.IntVector.iota", false]], "ip_fitting() (in module psi4.driver.frac)": [[1768, "psi4.driver.frac.ip_fitting", false]], "ip_poles (occ)": [[1704, "term-IP_POLES-OCC", true]], "ipi_broker() (in module psi4.driver)": [[308, "psi4.driver.ipi_broker", false]], "ipibroker (class in psi4.driver.ipi_broker)": [[1768, "psi4.driver.ipi_broker.IPIBroker", false]], "irc": [[1802, "index-2", false]], "irc_direction (optking)": [[1704, "term-IRC_DIRECTION-OPTKING", true]], "irc_points (optking)": [[1704, "term-IRC_POINTS-OPTKING", true]], "irc_step_size (optking)": [[1704, "term-IRC_STEP_SIZE-OPTKING", true]], "irreduciblerepresentation (class in psi4.core)": [[91, "psi4.core.IrreducibleRepresentation", false]], "irrep() (psi4.core.cdsalc method)": [[15, "psi4.core.CdSalc.irrep", false]], "irrep_index() (psi4.core.cdsalc method)": [[15, "psi4.core.CdSalc.irrep_index", false]], "irrep_labels() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.irrep_labels", false]], "is_c_hybrid() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.is_c_hybrid", false]], "is_c_lrc() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.is_c_lrc", false]], "is_c_scs_hybrid() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.is_c_scs_hybrid", false]], "is_cartesian() (psi4.core.gaussianshell method)": [[81, "psi4.core.GaussianShell.is_cartesian", false]], "is_done() (psi4.core.aoshellcombinationsiterator method)": [[3, "psi4.core.AOShellCombinationsIterator.is_done", false]], "is_gga() (psi4.core.functional method)": [[80, "psi4.core.Functional.is_gga", false]], "is_gga() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.is_gga", false]], "is_inverted() (psi4.core.fittingmetric method)": [[78, "psi4.core.FittingMetric.is_inverted", false]], "is_libxc_func() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.is_libxc_func", false]], "is_lrc() (psi4.core.functional method)": [[80, "psi4.core.Functional.is_lrc", false]], "is_meta() (psi4.core.functional method)": [[80, "psi4.core.Functional.is_meta", false]], "is_meta() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.is_meta", false]], "is_poisson() (psi4.core.fittingmetric method)": [[78, "psi4.core.FittingMetric.is_poisson", false]], "is_pure() (psi4.core.gaussianshell method)": [[81, "psi4.core.GaussianShell.is_pure", false]], "is_variable() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.is_variable", false]], "is_x_hybrid() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.is_x_hybrid", false]], "is_x_lrc() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.is_x_lrc", false]], "isa": [[1799, "index-1", false]], "isotope": [[1833, "index-4", false]], "isotopes": [[1833, "index-4", false]], "isotropic_pol (pe)": [[1704, "term-ISOTROPIC_POL-PE", true]], "istop (detci)": [[1704, "term-ISTOP-DETCI", true]], "iteration (psi4.driver.convergenceerror attribute)": [[266, "psi4.driver.ConvergenceError.iteration", false]], "iteration (psi4.driver.optimizationconvergenceerror attribute)": [[270, "psi4.driver.OptimizationConvergenceError.iteration", false]], "iteration (psi4.driver.scfconvergenceerror attribute)": [[276, "psi4.driver.SCFConvergenceError.iteration", false]], "iteration (psi4.driver.tdscfconvergenceerror attribute)": [[277, "psi4.driver.TDSCFConvergenceError.iteration", false]], "iteration_ (psi4.core.hf attribute)": [[84, "psi4.core.HF.iteration_", false]], "iteration_energies (psi4.core.hf attribute)": [[84, "psi4.core.HF.iteration_energies", false]], "iterations() (psi4.core.hf method)": [[84, "psi4.core.HF.iterations", false]], "j() (psi4.core.jk method)": [[92, "psi4.core.JK.J", false]], "jk (class in psi4.core)": [[92, "psi4.core.JK", false]], "jk() (psi4.core.hf method)": [[84, "psi4.core.HF.jk", false]], "jobtype (cclambda)": [[1704, "term-JOBTYPE-CCLAMBDA", true]], "k() (psi4.core.jk method)": [[92, "psi4.core.JK.K", false]], "keywords": [[1740, "index-0", false], [1752, "index-0", false], [1761, "index-0", false], [1766, "index-0", false], [1772, "index-0", false], [1794, "index-1", false], [1800, "index-0", false], [1826, "index-0", false], [1832, "index-2", false], [1833, "index-2", false]], "keywords (psi4.driver.atomiccomputer attribute)": [[265, "psi4.driver.AtomicComputer.keywords", false]], "keywords (psi4.driver.driver_cbs.compositecomputer attribute)": [[1740, "psi4.driver.driver_cbs.CompositeComputer.keywords", false]], "keywords (psi4.driver.driver_nbody.manybodycomputer attribute)": [[1794, "psi4.driver.driver_nbody.ManyBodyComputer.keywords", false]], "kind (adc)": [[1704, "term-KIND-ADC", true]], "kinetic() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.kinetic", false]], "kinetic_grad() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.kinetic_grad", false]], "kineticint (class in psi4.core)": [[93, "psi4.core.KineticInt", false]], "kwargs_lower() (in module psi4.driver.p4util)": [[359, "psi4.driver.p4util.kwargs_lower", false]], "l (psi4.core.localizer attribute)": [[97, "psi4.core.Localizer.L", false]], "label() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.label", false]], "label() (psi4.core.mospace method)": [[98, "psi4.core.MOSpace.label", false]], "lagrangian() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.lagrangian", false]], "laplacedenominator (class in psi4.core)": [[95, "psi4.core.LaplaceDenominator", false]], "lcc2 (+lmp2) total energy": [[1776, "psivar-LCC2-LMP2-TOTAL-ENERGY", false]], "lccd correlation energy": [[1776, "psivar-LCCD-CORRELATION-ENERGY", false]], "lccd doubles energy": [[1776, "psivar-LCCD-DOUBLES-ENERGY", false]], "lccd opposite-spin correlation energy": [[1776, "psivar-LCCD-OPPOSITE-SPIN-CORRELATION-ENERGY", false]], "lccd same-spin correlation energy": [[1776, "psivar-LCCD-SAME-SPIN-CORRELATION-ENERGY", false]], "lccd singles energy": [[1776, "psivar-LCCD-SINGLES-ENERGY", false]], "lccd total energy": [[1776, "psivar-LCCD-TOTAL-ENERGY", false]], "lccsd": [[1771, "index-1", false]], "lccsd (+lmp2) total energy": [[1776, "psivar-LCCSD-LMP2-TOTAL-ENERGY", false]], "lccsd correlation energy": [[1776, "psivar-LCCSD-CORRELATION-ENERGY", false]], "lccsd doubles energy": [[1776, "psivar-LCCSD-DOUBLES-ENERGY", false]], "lccsd opposite-spin correlation energy": [[1776, "psivar-LCCSD-OPPOSITE-SPIN-CORRELATION-ENERGY", false]], "lccsd same-spin correlation energy": [[1776, "psivar-LCCSD-SAME-SPIN-CORRELATION-ENERGY", false]], "lccsd singles energy": [[1776, "psivar-LCCSD-SINGLES-ENERGY", false]], "lccsd total energy": [[1776, "psivar-LCCSD-TOTAL-ENERGY", false]], "left-right cc2 eigenvector overlap": [[1776, "psivar-LEFT-RIGHT-CC2-EIGENVECTOR-OVERLAP", false]], "left-right cc3 eigenvector overlap": [[1776, "psivar-LEFT-RIGHT-CC3-EIGENVECTOR-OVERLAP", false]], "left-right ccsd eigenvector overlap": [[1776, "psivar-LEFT-RIGHT-CCSD-EIGENVECTOR-OVERLAP", false]], "left-right ccsd(t) eigenvector overlap": [[1776, "psivar-LEFT-RIGHT-CCSD-T-EIGENVECTOR-OVERLAP", false]], "level_shift (dfocc)": [[1704, "term-LEVEL_SHIFT-DFOCC", true]], "level_shift (mcscf)": [[1704, "term-LEVEL_SHIFT-MCSCF", true]], "level_shift (occ)": [[1704, "term-LEVEL_SHIFT-OCC", true]], "level_shift (scf)": [[1704, "term-LEVEL_SHIFT-SCF", true]], "level_shift_cutoff (scf)": [[1704, "term-LEVEL_SHIFT_CUTOFF-SCF", true]], "levenshtein() (in module psi4.driver)": [[309, "psi4.driver.levenshtein", false]], "levenshtein() (in module psi4.driver.p4util)": [[360, "psi4.driver.p4util.levenshtein", false]], "libecpint": [[1765, "index-0", false]], "libefp": [[1782, "index-0", false]], "libint": [[1783, "index-0", false]], "libint2_configuration() (in module psi4.driver)": [[310, "psi4.driver.libint2_configuration", false]], "libint2_configuration() (in module psi4.driver.p4util)": [[361, "psi4.driver.p4util.libint2_configuration", false]], "libint2_print_out() (in module psi4.driver)": [[311, "psi4.driver.libint2_print_out", false]], "libint2_print_out() (in module psi4.driver.p4util)": [[362, "psi4.driver.p4util.libint2_print_out", false]], "libint2_solid_harmonics_ordering() (in module psi4.core)": [[214, "psi4.core.libint2_solid_harmonics_ordering", false]], "library fragments": [[1782, "index-1", false], [1782, "index-5", false]], "libxc": [[1784, "index-0", false]], "libxcfunctional (class in psi4.core)": [[96, "psi4.core.LibXCFunctional", false]], "license": [[1781, "index-2", false]], "light (psi4.driver.p4util.inpsight attribute)": [[323, "psi4.driver.p4util.InPsight.light", false]], "light_color (psi4.driver.p4util.inpsight attribute)": [[323, "psi4.driver.p4util.InPsight.light_color", false]], "linear (ccresponse)": [[1704, "term-LINEAR-CCRESPONSE", true]], "lineq_solver (dfocc)": [[1704, "term-LINEQ_SOLVER-DFOCC", true]], "lineshape (class in psi4.driver.p4util)": [[324, "psi4.driver.p4util.Lineshape", false]], "lineshape() (psi4.driver.p4util.gaussian method)": [[322, "psi4.driver.p4util.Gaussian.lineshape", false]], "lineshape() (psi4.driver.p4util.lineshape method)": [[324, "psi4.driver.p4util.Lineshape.lineshape", false]], "lineshape() (psi4.driver.p4util.lorentzian method)": [[325, "psi4.driver.p4util.Lorentzian.lineshape", false]], "link_ints_tolerance (scf)": [[1704, "term-LINK_INTS_TOLERANCE-SCF", true]], "literal_cfour (globals)": [[1704, "term-LITERAL_CFOUR-GLOBALS", true]], "load() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.load", false]], "load() (psi4.core.vector method)": [[148, "psi4.core.Vector.load", false]], "load_mpqc() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.load_mpqc", false]], "local (ccenergy)": [[1704, "term-LOCAL-CCENERGY", true]], "local (cceom)": [[1704, "term-LOCAL-CCEOM", true]], "local (cclambda)": [[1704, "term-LOCAL-CCLAMBDA", true]], "local (ccresponse)": [[1704, "term-LOCAL-CCRESPONSE", true]], "local_convergence (dlpno)": [[1704, "term-LOCAL_CONVERGENCE-DLPNO", true]], "local_convergence (fisapt)": [[1704, "term-LOCAL_CONVERGENCE-FISAPT", true]], "local_convergence (scf)": [[1704, "term-LOCAL_CONVERGENCE-SCF", true]], "local_cphf_cutoff (ccenergy)": [[1704, "term-LOCAL_CPHF_CUTOFF-CCENERGY", true]], "local_cphf_cutoff (cclambda)": [[1704, "term-LOCAL_CPHF_CUTOFF-CCLAMBDA", true]], "local_cphf_cutoff (ccresponse)": [[1704, "term-LOCAL_CPHF_CUTOFF-CCRESPONSE", true]], "local_cutoff (ccenergy)": [[1704, "term-LOCAL_CUTOFF-CCENERGY", true]], "local_cutoff (cceom)": [[1704, "term-LOCAL_CUTOFF-CCEOM", true]], "local_cutoff (cclambda)": [[1704, "term-LOCAL_CUTOFF-CCLAMBDA", true]], "local_cutoff (ccresponse)": [[1704, "term-LOCAL_CUTOFF-CCRESPONSE", true]], "local_do_singles (cceom)": [[1704, "term-LOCAL_DO_SINGLES-CCEOM", true]], "local_filter_singles (cceom)": [[1704, "term-LOCAL_FILTER_SINGLES-CCEOM", true]], "local_filter_singles (cclambda)": [[1704, "term-LOCAL_FILTER_SINGLES-CCLAMBDA", true]], "local_filter_singles (ccresponse)": [[1704, "term-LOCAL_FILTER_SINGLES-CCRESPONSE", true]], "local_ibo_condition (fisapt)": [[1704, "term-LOCAL_IBO_CONDITION-FISAPT", true]], "local_ibo_power (fisapt)": [[1704, "term-LOCAL_IBO_POWER-FISAPT", true]], "local_ibo_stars (fisapt)": [[1704, "term-LOCAL_IBO_STARS-FISAPT", true]], "local_ibo_stars_completeness (fisapt)": [[1704, "term-LOCAL_IBO_STARS_COMPLETENESS-FISAPT", true]], "local_ibo_use_stars (fisapt)": [[1704, "term-LOCAL_IBO_USE_STARS-FISAPT", true]], "local_maxiter (dlpno)": [[1704, "term-LOCAL_MAXITER-DLPNO", true]], "local_maxiter (fisapt)": [[1704, "term-LOCAL_MAXITER-FISAPT", true]], "local_maxiter (scf)": [[1704, "term-LOCAL_MAXITER-SCF", true]], "local_method (ccenergy)": [[1704, "term-LOCAL_METHOD-CCENERGY", true]], "local_method (cceom)": [[1704, "term-LOCAL_METHOD-CCEOM", true]], "local_method (cclambda)": [[1704, "term-LOCAL_METHOD-CCLAMBDA", true]], "local_method (ccresponse)": [[1704, "term-LOCAL_METHOD-CCRESPONSE", true]], "local_pairdef (ccenergy)": [[1704, "term-LOCAL_PAIRDEF-CCENERGY", true]], "local_pairdef (cclambda)": [[1704, "term-LOCAL_PAIRDEF-CCLAMBDA", true]], "local_pairdef (ccresponse)": [[1704, "term-LOCAL_PAIRDEF-CCRESPONSE", true]], "local_preconditioner (cceom)": [[1704, "term-LOCAL_PRECONDITIONER-CCEOM", true]], "local_use_ghosts (fisapt)": [[1704, "term-LOCAL_USE_GHOSTS-FISAPT", true]], "local_weakp (ccenergy)": [[1704, "term-LOCAL_WEAKP-CCENERGY", true]], "local_weakp (cceom)": [[1704, "term-LOCAL_WEAKP-CCEOM", true]], "local_weakp (cclambda)": [[1704, "term-LOCAL_WEAKP-CCLAMBDA", true]], "local_weakp (ccresponse)": [[1704, "term-LOCAL_WEAKP-CCRESPONSE", true]], "localize() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.localize", false]], "localize() (psi4.core.localizer method)": [[97, "psi4.core.Localizer.localize", false]], "localizer (class in psi4.core)": [[97, "psi4.core.Localizer", false]], "location (psi4.driver.p4util.inpsight attribute)": [[323, "psi4.driver.p4util.InPsight.location", false]], "lock_singlet (psimrcc)": [[1704, "term-LOCK_SINGLET-PSIMRCC", true]], "look_at (psi4.driver.p4util.inpsight attribute)": [[323, "psi4.driver.p4util.InPsight.look_at", false]], "lorentzian (class in psi4.driver.p4util)": [[325, "psi4.driver.p4util.Lorentzian", false]], "lowdin charges": [[1776, "psivar-LOWDIN-CHARGES", false]], "lowertriangle (psi4.core.savetype attribute)": [[135, "psi4.core.SaveType.LowerTriangle", false]], "ls_thc_basis_tolerance (globals)": [[1704, "term-LS_THC_BASIS_TOLERANCE-GLOBALS", true]], "ls_thc_computer (class in psi4.core)": [[94, "psi4.core.LS_THC_Computer", false]], "ls_thc_df (globals)": [[1704, "term-LS_THC_DF-GLOBALS", true]], "ls_thc_pruning_scheme (globals)": [[1704, "term-LS_THC_PRUNING_SCHEME-GLOBALS", true]], "ls_thc_radial_points (globals)": [[1704, "term-LS_THC_RADIAL_POINTS-GLOBALS", true]], "ls_thc_s_epsilon (globals)": [[1704, "term-LS_THC_S_EPSILON-GLOBALS", true]], "ls_thc_spherical_points (globals)": [[1704, "term-LS_THC_SPHERICAL_POINTS-GLOBALS", true]], "ls_thc_weights_tolerance (globals)": [[1704, "term-LS_THC_WEIGHTS_TOLERANCE-GLOBALS", true]], "lsda_cutoff() (psi4.core.functional method)": [[80, "psi4.core.Functional.lsda_cutoff", false]], "lse (detci)": [[1704, "term-LSE-DETCI", true]], "lse_collapse (detci)": [[1704, "term-LSE_COLLAPSE-DETCI", true]], "lse_tolerance (detci)": [[1704, "term-LSE_TOLERANCE-DETCI", true]], "madmp2_sleep (dfmp2)": [[1704, "term-MADMP2_SLEEP-DFMP2", true]], "make_filename() (psi4.core.basisset static method)": [[8, "psi4.core.BasisSet.make_filename", false]], "managedmethoderror": [[268, "psi4.driver.ManagedMethodError", false]], "mark_file_for_retention() (psi4.core.iomanager method)": [[87, "psi4.core.IOManager.mark_file_for_retention", false]], "mass() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.mass", false]], "mass_number() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.mass_number", false]], "mat2arr() (in module psi4.driver.p4util)": [[363, "psi4.driver.p4util.mat2arr", false]], "mat_num_column_print (globals)": [[1704, "term-MAT_NUM_COLUMN_PRINT-GLOBALS", true]], "math_root": [[1738, "envvar-MATH_ROOT", false]], "matrices() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.matrices", false]], "matrix (class in psi4.core)": [[100, "psi4.core.Matrix", false]], "matrix() (psi4.core.cdsalclist method)": [[16, "psi4.core.CdSalcList.matrix", false]], "matrix() (psi4.core.symmetryoperation method)": [[139, "psi4.core.SymmetryOperation.matrix", false]], "matrix_irrep() (psi4.core.cdsalclist method)": [[16, "psi4.core.CdSalcList.matrix_irrep", false]], "matrixfactory (class in psi4.core)": [[101, "psi4.core.MatrixFactory", false]], "max() (psi4.core.dimension method)": [[64, "psi4.core.Dimension.max", false]], "max_am() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.max_am", false]], "max_attempts (scf)": [[1704, "term-MAX_ATTEMPTS-SCF", true]], "max_ccd_diisvecs (sapt)": [[1704, "term-MAX_CCD_DIISVECS-SAPT", true]], "max_disp_g_convergence (optking)": [[1704, "term-MAX_DISP_G_CONVERGENCE-OPTKING", true]], "max_energy_g_convergence (optking)": [[1704, "term-MAX_ENERGY_G_CONVERGENCE-OPTKING", true]], "max_force_g_convergence (optking)": [[1704, "term-MAX_FORCE_G_CONVERGENCE-OPTKING", true]], "max_function_per_shell() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.max_function_per_shell", false]], "max_functions() (psi4.core.basisfunctions method)": [[7, "psi4.core.BasisFunctions.max_functions", false]], "max_functions() (psi4.core.moleculargrid method)": [[105, "psi4.core.MolecularGrid.max_functions", false]], "max_mem_buf (scf)": [[1704, "term-MAX_MEM_BUF-SCF", true]], "max_mograd_convergence (dfocc)": [[1704, "term-MAX_MOGRAD_CONVERGENCE-DFOCC", true]], "max_mograd_convergence (occ)": [[1704, "term-MAX_MOGRAD_CONVERGENCE-OCC", true]], "max_nbody (psi4.driver.driver_nbody.manybodycomputer attribute)": [[1794, "psi4.driver.driver_nbody.ManyBodyComputer.max_nbody", false]], "max_nprimitive() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.max_nprimitive", false]], "max_num_vecs (adc)": [[1704, "term-MAX_NUM_VECS-ADC", true]], "max_num_vecs (detci)": [[1704, "term-MAX_NUM_VECS-DETCI", true]], "max_points() (psi4.core.basisfunctions method)": [[7, "psi4.core.BasisFunctions.max_points", false]], "max_points() (psi4.core.moleculargrid method)": [[105, "psi4.core.MolecularGrid.max_points", false]], "max_points() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.max_points", false]], "max_radial_moment (globals)": [[1704, "term-MAX_RADIAL_MOMENT-GLOBALS", true]], "maximum() (psi4.driver.p4util.gaussian method)": [[322, "psi4.driver.p4util.Gaussian.maximum", false]], "maximum() (psi4.driver.p4util.lineshape method)": [[324, "psi4.driver.p4util.Lineshape.maximum", false]], "maximum() (psi4.driver.p4util.lorentzian method)": [[325, "psi4.driver.p4util.Lorentzian.maximum", false]], "maxiter (adc)": [[1704, "term-MAXITER-ADC", true]], "maxiter (ccenergy)": [[1704, "term-MAXITER-CCENERGY", true]], "maxiter (cceom)": [[1704, "term-MAXITER-CCEOM", true]], "maxiter (cclambda)": [[1704, "term-MAXITER-CCLAMBDA", true]], "maxiter (ccresponse)": [[1704, "term-MAXITER-CCRESPONSE", true]], "maxiter (dct)": [[1704, "term-MAXITER-DCT", true]], "maxiter (fisapt)": [[1704, "term-MAXITER-FISAPT", true]], "maxiter (fnocc)": [[1704, "term-MAXITER-FNOCC", true]], "maxiter (mcscf)": [[1704, "term-MAXITER-MCSCF", true]], "maxiter (pe)": [[1704, "term-MAXITER-PE", true]], "maxiter (psimrcc)": [[1704, "term-MAXITER-PSIMRCC", true]], "maxiter (sapt)": [[1704, "term-MAXITER-SAPT", true]], "maxiter (scf)": [[1704, "term-MAXITER-SCF", true]], "maxr() (psi4.core.basisextents method)": [[6, "psi4.core.BasisExtents.maxR", false]], "mayer indices": [[1776, "psivar-MAYER-INDICES", false]], "mbis": [[1799, "index-1", false]], "mbis charges": [[1776, "psivar-MBIS-CHARGES", false]], "mbis dipoles": [[1776, "psivar-MBIS-DIPOLES", false]], "mbis free atom n volume": [[1776, "psivar-MBIS-FREE-ATOM-n-VOLUME", false]], "mbis octupoles": [[1776, "psivar-MBIS-OCTUPOLES", false]], "mbis quadrupoles": [[1776, "psivar-MBIS-QUADRUPOLES", false]], "mbis radial moments <r^3>": [[1776, "psivar-MBIS-RADIAL-MOMENTS-R-3", false]], "mbis valence widths": [[1776, "psivar-MBIS-VALENCE-WIDTHS", false]], "mbis volume ratios": [[1776, "psivar-MBIS-VOLUME-RATIOS", false]], "mbis_d_convergence (globals)": [[1704, "term-MBIS_D_CONVERGENCE-GLOBALS", true]], "mbis_maxiter (globals)": [[1704, "term-MBIS_MAXITER-GLOBALS", true]], "mbis_pruning_scheme (globals)": [[1704, "term-MBIS_PRUNING_SCHEME-GLOBALS", true]], "mbis_radial_points (globals)": [[1704, "term-MBIS_RADIAL_POINTS-GLOBALS", true]], "mbis_spherical_points (globals)": [[1704, "term-MBIS_SPHERICAL_POINTS-GLOBALS", true]], "mcscf": [[1789, "index-0", false], [1789, "index-1", false]], "mcscf total energy": [[1776, "psivar-MCSCF-TOTAL-ENERGY", false]], "mcscf() (in module psi4.core)": [[215, "psi4.core.mcscf", false]], "mcscf_algorithm (detci)": [[1704, "term-MCSCF_ALGORITHM-DETCI", true]], "mcscf_ci_cleanup (detci)": [[1704, "term-MCSCF_CI_CLEANUP-DETCI", true]], "mcscf_diis_error_type (detci)": [[1704, "term-MCSCF_DIIS_ERROR_TYPE-DETCI", true]], "mcscf_diis_freq (detci)": [[1704, "term-MCSCF_DIIS_FREQ-DETCI", true]], "mcscf_diis_max_vecs (detci)": [[1704, "term-MCSCF_DIIS_MAX_VECS-DETCI", true]], "mcscf_diis_start (detci)": [[1704, "term-MCSCF_DIIS_START-DETCI", true]], "mcscf_dpd_cleanup (detci)": [[1704, "term-MCSCF_DPD_CLEANUP-DETCI", true]], "mcscf_e_convergence (detci)": [[1704, "term-MCSCF_E_CONVERGENCE-DETCI", true]], "mcscf_guess (detci)": [[1704, "term-MCSCF_GUESS-DETCI", true]], "mcscf_max_rot (detci)": [[1704, "term-MCSCF_MAX_ROT-DETCI", true]], "mcscf_maxiter (detci)": [[1704, "term-MCSCF_MAXITER-DETCI", true]], "mcscf_object() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.mcscf_object", false]], "mcscf_r_convergence (detci)": [[1704, "term-MCSCF_R_CONVERGENCE-DETCI", true]], "mcscf_rotate (detci)": [[1704, "term-MCSCF_ROTATE-DETCI", true]], "mcscf_so_start_e (detci)": [[1704, "term-MCSCF_SO_START_E-DETCI", true]], "mcscf_so_start_grad (detci)": [[1704, "term-MCSCF_SO_START_GRAD-DETCI", true]], "mcscf_type (detci)": [[1704, "term-MCSCF_TYPE-DETCI", true]], "mdi_run() (in module psi4.driver)": [[312, "psi4.driver.mdi_run", false]], "memdfjk (class in psi4.core)": [[102, "psi4.core.MemDFJK", false]], "memory": [[1832, "index-1", false]], "memory_estimate() (psi4.core.jk method)": [[92, "psi4.core.JK.memory_estimate", false]], "message (psi4.driver.convergenceerror attribute)": [[266, "psi4.driver.ConvergenceError.message", false]], "message (psi4.driver.managedmethoderror attribute)": [[268, "psi4.driver.ManagedMethodError.message", false]], "message (psi4.driver.missingmethoderror attribute)": [[269, "psi4.driver.MissingMethodError.message", false]], "message (psi4.driver.optimizationconvergenceerror attribute)": [[270, "psi4.driver.OptimizationConvergenceError.message", false]], "message (psi4.driver.scfconvergenceerror attribute)": [[276, "psi4.driver.SCFConvergenceError.message", false]], "message (psi4.driver.tdscfconvergenceerror attribute)": [[277, "psi4.driver.TDSCFConvergenceError.message", false]], "message (psi4.driver.testcomparisonerror attribute)": [[278, "psi4.driver.TestComparisonError.message", false]], "message (psi4.driver.validationerror attribute)": [[280, "psi4.driver.ValidationError.message", false]], "message_box() (in module psi4.driver)": [[313, "psi4.driver.message_box", false]], "message_box() (in module psi4.driver.p4util)": [[364, "psi4.driver.p4util.message_box", false]], "meta_cutoff() (psi4.core.functional method)": [[80, "psi4.core.Functional.meta_cutoff", false]], "metadata (psi4.driver.driver_cbs.compositecomputer attribute)": [[1740, "psi4.driver.driver_cbs.CompositeComputer.metadata", false]], "metameta (psi4.driver.driver_cbs.compositecomputer attribute)": [[1740, "psi4.driver.driver_cbs.CompositeComputer.metameta", false]], "metameta (psi4.driver.driver_findif.finitedifferencecomputer attribute)": [[1772, "psi4.driver.driver_findif.FiniteDifferenceComputer.metameta", false]], "method (psi4.driver.atomiccomputer attribute)": [[265, "psi4.driver.AtomicComputer.method", false]], "method (psi4.driver.driver_cbs.compositecomputer attribute)": [[1740, "psi4.driver.driver_cbs.CompositeComputer.method", false]], "method (psi4.driver.driver_findif.finitedifferencecomputer attribute)": [[1772, "psi4.driver.driver_findif.FiniteDifferenceComputer.method", false]], "method (psi4.driver.driver_nbody.manybodycomputer attribute)": [[1794, "psi4.driver.driver_nbody.ManyBodyComputer.method", false]], "method alias": [[1834, "index-0", false]], "metric() (psi4.core.fdds_dispersion method)": [[75, "psi4.core.FDDS_Dispersion.metric", false]], "metric_inv() (psi4.core.fdds_dispersion method)": [[75, "psi4.core.FDDS_Dispersion.metric_inv", false]], "min_ccd_diisvecs (sapt)": [[1704, "term-MIN_CCD_DIISVECS-SAPT", true]], "minao_basis (fisapt)": [[1704, "term-MINAO_BASIS-FISAPT", true]], "minima": [[1802, "index-1", false]], "mintshelper (class in psi4.core)": [[103, "psi4.core.MintsHelper", false]], "mintshelper() (psi4.core.cuhf method)": [[14, "psi4.core.CUHF.mintshelper", false]], "mintshelper() (psi4.core.rhf method)": [[128, "psi4.core.RHF.mintshelper", false]], "mintshelper() (psi4.core.rohf method)": [[130, "psi4.core.ROHF.mintshelper", false]], "mintshelper() (psi4.core.uhf method)": [[145, "psi4.core.UHF.mintshelper", false]], "mintshelper() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.mintshelper", false]], "missingmethoderror": [[269, "psi4.driver.MissingMethodError", false]], "mixed (detci)": [[1704, "term-MIXED-DETCI", true]], "mixed4 (detci)": [[1704, "term-MIXED4-DETCI", true]], "mk-mrcc": [[1829, "index-0", false]], "mkl_num_threads": [[1767, "envvar-MKL_NUM_THREADS", false], [1767, "index-8", false]], "mkl_root": [[1738, "envvar-MKL_ROOT", false]], "mo_diis_num_vecs (dfocc)": [[1704, "term-MO_DIIS_NUM_VECS-DFOCC", true]], "mo_elec_dip_deriv1() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.mo_elec_dip_deriv1", false]], "mo_erf_eri() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.mo_erf_eri", false]], "mo_eri() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.mo_eri", false]], "mo_extents() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.mo_extents", false]], "mo_f12() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.mo_f12", false]], "mo_f12_double_commutator() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.mo_f12_double_commutator", false]], "mo_f12_squared() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.mo_f12_squared", false]], "mo_f12g12() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.mo_f12g12", false]], "mo_maxiter (dfocc)": [[1704, "term-MO_MAXITER-DFOCC", true]], "mo_maxiter (occ)": [[1704, "term-MO_MAXITER-OCC", true]], "mo_oei_deriv1() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.mo_oei_deriv1", false]], "mo_oei_deriv2() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.mo_oei_deriv2", false]], "mo_overlap_half_deriv1() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.mo_overlap_half_deriv1", false]], "mo_read (mcscf)": [[1704, "term-MO_READ-MCSCF", true]], "mo_read (occ)": [[1704, "term-MO_READ-OCC", true]], "mo_spin_eri() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.mo_spin_eri", false]], "mo_step_max (dfocc)": [[1704, "term-MO_STEP_MAX-DFOCC", true]], "mo_step_max (occ)": [[1704, "term-MO_STEP_MAX-OCC", true]], "mo_tei_deriv1() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.mo_tei_deriv1", false]], "mo_tei_deriv2() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.mo_tei_deriv2", false]], "mo_transform() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.mo_transform", false]], "mo_write (occ)": [[1704, "term-MO_WRITE-OCC", true]], "module": [[1772, "module-psi4.driver.qcdb.vib", false], [1827, "module-psi4.core", false], [1827, "module-psi4.driver", false], [1827, "module-psi4.driver.p4util", false]], "module (cphf)": [[1704, "term-MODULE-CPHF", true]], "module() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.module", false]], "mofa() (psi4.core.rohf method)": [[130, "psi4.core.ROHF.moFa", false]], "mofb() (psi4.core.rohf method)": [[130, "psi4.core.ROHF.moFb", false]], "mofeff() (psi4.core.rohf method)": [[130, "psi4.core.ROHF.moFeff", false]], "mograd_damping (occ)": [[1704, "term-MOGRAD_DAMPING-OCC", true]], "molden": [[1791, "index-0", false]], "molden() (in module psi4.driver)": [[314, "psi4.driver.molden", false]], "molden_with_virtual (globals)": [[1704, "term-MOLDEN_WITH_VIRTUAL-GLOBALS", true]], "molden_write (dfocc)": [[1704, "term-MOLDEN_WRITE-DFOCC", true]], "molden_write (scf)": [[1704, "term-MOLDEN_WRITE-SCF", true]], "moldenwriter (class in psi4.core)": [[104, "psi4.core.MoldenWriter", false]], "molecular_charge() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.molecular_charge", false]], "moleculargrid (class in psi4.core)": [[105, "psi4.core.MolecularGrid", false]], "molecule": [[1782, "index-4", false], [1833, "index-0", false], [1833, "index-1", false], [1833, "index-2", false], [1833, "index-3", false], [1833, "index-4", false], [1833, "index-5", false], [1833, "index-7", false]], "molecule (class in psi4.core)": [[106, "psi4.core.Molecule", false]], "molecule (class in psi4.driver.qcdb)": [[1768, "psi4.driver.qcdb.Molecule", false]], "molecule (psi4.driver.atomiccomputer attribute)": [[265, "psi4.driver.AtomicComputer.molecule", false]], "molecule (psi4.driver.driver_cbs.compositecomputer attribute)": [[1740, "psi4.driver.driver_cbs.CompositeComputer.molecule", false]], "molecule (psi4.driver.driver_findif.finitedifferencecomputer attribute)": [[1772, "psi4.driver.driver_findif.FiniteDifferenceComputer.molecule", false]], "molecule (psi4.driver.driver_nbody.manybodycomputer attribute)": [[1794, "psi4.driver.driver_nbody.ManyBodyComputer.molecule", false]], "molecule specification": [[1782, "index-4", false]], "molecule() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.molecule", false]], "molecule() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.molecule", false]], "molecule() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.molecule", false]], "molecule_get_attr() (in module psi4.driver)": [[315, "psi4.driver.molecule_get_attr", false]], "molecule_set_attr() (in module psi4.driver)": [[316, "psi4.driver.molecule_set_attr", false]], "mom": [[1838, "index-2", false]], "mom_excited_ (psi4.core.hf attribute)": [[84, "psi4.core.HF.MOM_excited_", false]], "mom_occ (scf)": [[1704, "term-MOM_OCC-SCF", true]], "mom_performed_ (psi4.core.hf attribute)": [[84, "psi4.core.HF.MOM_performed_", false]], "mom_start (scf)": [[1704, "term-MOM_START-SCF", true]], "mom_vir (scf)": [[1704, "term-MOM_VIR-SCF", true]], "montage": [[1750, "envvar-MONTAGE", false], [1750, "index-2", false]], "mospace (class in psi4.core)": [[98, "psi4.core.MOSpace", false]], "move_atom() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.move_atom", false]], "move_to_com() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.move_to_com", false]], "mowriter (class in psi4.core)": [[99, "psi4.core.MOWriter", false]], "mp2": [[1756, "index-0", false]], "mp2 alpha-alpha pair energies": [[1776, "psivar-MP2-ALPHA-ALPHA-PAIR-ENERGIES", false]], "mp2 alpha-beta pair energies": [[1776, "psivar-MP2-ALPHA-BETA-PAIR-ENERGIES", false]], "mp2 correlation energy": [[1776, "psivar-MP2-CORRELATION-ENERGY", false]], "mp2 dipole gradient": [[1776, "psivar-MP2-DIPOLE-GRADIENT", false]], "mp2 doubles energy": [[1776, "psivar-MP2-DOUBLES-ENERGY", false]], "mp2 opposite-spin correlation energy": [[1776, "psivar-MP2-OPPOSITE-SPIN-CORRELATION-ENERGY", false]], "mp2 same-spin correlation energy": [[1776, "psivar-MP2-SAME-SPIN-CORRELATION-ENERGY", false]], "mp2 singles energy": [[1776, "psivar-MP2-SINGLES-ENERGY", false]], "mp2 singlet pair energies": [[1776, "psivar-MP2-SINGLET-PAIR-ENERGIES", false]], "mp2 total energy": [[1776, "psivar-MP2-TOTAL-ENERGY", false]], "mp2 total gradient": [[1776, "psivar-MP2-TOTAL-GRADIENT", false]], "mp2 total hessian": [[1776, "psivar-MP2-TOTAL-HESSIAN", false]], "mp2 triplet pair energies": [[1776, "psivar-MP2-TRIPLET-PAIR-ENERGIES", false]], "mp2-ccsd total energy": [[1776, "psivar-MP2-CCSD-TOTAL-ENERGY", false]], "mp2.5 correlation energy": [[1776, "psivar-MP2.5-CORRELATION-ENERGY", false]], "mp2.5 doubles energy": [[1776, "psivar-MP2.5-DOUBLES-ENERGY", false]], "mp2.5 opposite-spin correlation energy": [[1776, "psivar-MP2.5-OPPOSITE-SPIN-CORRELATION-ENERGY", false]], "mp2.5 same-spin correlation energy": [[1776, "psivar-MP2.5-SAME-SPIN-CORRELATION-ENERGY", false]], "mp2.5 singles energy": [[1776, "psivar-MP2.5-SINGLES-ENERGY", false]], "mp2.5 total energy": [[1776, "psivar-MP2.5-TOTAL-ENERGY", false]], "mp2_amp_type (dfocc)": [[1704, "term-MP2_AMP_TYPE-DFOCC", true]], "mp2_amps_print (ccenergy)": [[1704, "term-MP2_AMPS_PRINT-CCENERGY", true]], "mp2_ccsd_method (psimrcc)": [[1704, "term-MP2_CCSD_METHOD-PSIMRCC", true]], "mp2_guess (psimrcc)": [[1704, "term-MP2_GUESS-PSIMRCC", true]], "mp2_os_scale (ccenergy)": [[1704, "term-MP2_OS_SCALE-CCENERGY", true]], "mp2_os_scale (dfmp2)": [[1704, "term-MP2_OS_SCALE-DFMP2", true]], "mp2_os_scale (dfocc)": [[1704, "term-MP2_OS_SCALE-DFOCC", true]], "mp2_os_scale (occ)": [[1704, "term-MP2_OS_SCALE-OCC", true]], "mp2_scale_os (fnocc)": [[1704, "term-MP2_SCALE_OS-FNOCC", true]], "mp2_scale_ss (fnocc)": [[1704, "term-MP2_SCALE_SS-FNOCC", true]], "mp2_sos_scale (dfocc)": [[1704, "term-MP2_SOS_SCALE-DFOCC", true]], "mp2_sos_scale (occ)": [[1704, "term-MP2_SOS_SCALE-OCC", true]], "mp2_sos_scale2 (dfocc)": [[1704, "term-MP2_SOS_SCALE2-DFOCC", true]], "mp2_sos_scale2 (occ)": [[1704, "term-MP2_SOS_SCALE2-OCC", true]], "mp2_ss_scale (ccenergy)": [[1704, "term-MP2_SS_SCALE-CCENERGY", true]], "mp2_ss_scale (dfmp2)": [[1704, "term-MP2_SS_SCALE-DFMP2", true]], "mp2_ss_scale (dfocc)": [[1704, "term-MP2_SS_SCALE-DFOCC", true]], "mp2_ss_scale (occ)": [[1704, "term-MP2_SS_SCALE-OCC", true]], "mp2_type (globals)": [[1704, "term-MP2_TYPE-GLOBALS", true]], "mp3 correlation energy": [[1776, "psivar-MP3-CORRELATION-ENERGY", false]], "mp3 doubles energy": [[1776, "psivar-MP3-DOUBLES-ENERGY", false]], "mp3 opposite-spin correlation energy": [[1776, "psivar-MP3-OPPOSITE-SPIN-CORRELATION-ENERGY", false]], "mp3 same-spin correlation energy": [[1776, "psivar-MP3-SAME-SPIN-CORRELATION-ENERGY", false]], "mp3 singles energy": [[1776, "psivar-MP3-SINGLES-ENERGY", false]], "mp3 total energy": [[1776, "psivar-MP3-TOTAL-ENERGY", false]], "mp4": [[1771, "index-1", false]], "mp4 correlation energy": [[1776, "psivar-MP4-CORRELATION-ENERGY", false]], "mp4 total energy": [[1776, "psivar-MP4-TOTAL-ENERGY", false]], "mp4(sdq) correlation energy": [[1776, "psivar-MP4-SDQ-CORRELATION-ENERGY", false]], "mp4(sdq) total energy": [[1776, "psivar-MP4-SDQ-TOTAL-ENERGY", false]], "mp4(sdtq) correlation energy": [[1776, "psivar-MP4-SDTQ-CORRELATION-ENERGY", false]], "mp4(sdtq) total energy": [[1776, "psivar-MP4-SDTQ-TOTAL-ENERGY", false]], "mp4(t) correction energy": [[1776, "psivar-MP4-T-CORRECTION-ENERGY", false]], "mp_type (globals)": [[1704, "term-MP_TYPE-GLOBALS", true]], "mpn (detci)": [[1704, "term-MPN-DETCI", true]], "mpn correlation energy": [[1776, "psivar-MPn-CORRELATION-ENERGY", false]], "mpn total energy": [[1776, "psivar-MPn-TOTAL-ENERGY", false]], "mpn_order_save (detci)": [[1704, "term-MPN_ORDER_SAVE-DETCI", true]], "mpn_schmidt (detci)": [[1704, "term-MPN_SCHMIDT-DETCI", true]], "mpn_wigner (detci)": [[1704, "term-MPN_WIGNER-DETCI", true]], "mrcc": [[1792, "index-0", false]], "mrcc total energy": [[1776, "psivar-MRCC-TOTAL-ENERGY", false]], "mrcc_generate_input() (in module psi4.core)": [[216, "psi4.core.mrcc_generate_input", false]], "mrcc_level (mrcc)": [[1704, "term-MRCC_LEVEL-MRCC", true]], "mrcc_load_densities() (in module psi4.core)": [[217, "psi4.core.mrcc_load_densities", false]], "mrcc_method (mrcc)": [[1704, "term-MRCC_METHOD-MRCC", true]], "mrcc_num_doublet_roots (mrcc)": [[1704, "term-MRCC_NUM_DOUBLET_ROOTS-MRCC", true]], "mrcc_num_singlet_roots (mrcc)": [[1704, "term-MRCC_NUM_SINGLET_ROOTS-MRCC", true]], "mrcc_num_triplet_roots (mrcc)": [[1704, "term-MRCC_NUM_TRIPLET_ROOTS-MRCC", true]], "mrcc_omp_num_threads (mrcc)": [[1704, "term-MRCC_OMP_NUM_THREADS-MRCC", true]], "mrcc_restart (mrcc)": [[1704, "term-MRCC_RESTART-MRCC", true]], "mrpt total energy": [[1776, "psivar-MRPT-TOTAL-ENERGY", false]], "ms0 (detci)": [[1704, "term-MS0-DETCI", true]], "mtd 128-pole": [[1776, "psivar-mtd-128-POLE", false]], "mtd 32-pole": [[1776, "psivar-mtd-32-POLE", false]], "mtd 64-pole": [[1776, "psivar-mtd-64-POLE", false]], "mtd dipole": [[1776, "psivar-mtd-DIPOLE", false]], "mtd hexadecapole": [[1776, "psivar-mtd-HEXADECAPOLE", false]], "mtd octupole": [[1776, "psivar-mtd-OCTUPOLE", false]], "mtd quadrupole": [[1776, "psivar-mtd-QUADRUPOLE", false]], "mulliken charges": [[1776, "psivar-MULLIKEN-CHARGES", false]], "multi-configurational self-consistent-field": [[1789, "index-2", false]], "multiple fragments": [[1833, "index-7", false]], "multiple in input file": [[1833, "index-1", false]], "multiple within molecule": [[1730, "index-1", false]], "multiplicity": [[1833, "index-2", false]], "multiplicity() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.multiplicity", false]], "multipole_grad() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.multipole_grad", false]], "multipoleint (class in psi4.core)": [[107, "psi4.core.MultipoleInt", false]], "multipolesymmetry (class in psi4.core)": [[108, "psi4.core.MultipoleSymmetry", false]], "multireference": [[1829, "index-0", false]], "n() (psi4.core.correlationtable method)": [[20, "psi4.core.CorrelationTable.n", false]], "n() (psi4.core.dimension method)": [[64, "psi4.core.Dimension.n", false]], "n_ecp_core() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.n_ecp_core", false]], "n_ecp_shell_on_center() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.n_ecp_shell_on_center", false]], "n_frozen_core() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.n_frozen_core", false]], "nablaint (class in psi4.core)": [[109, "psi4.core.NablaInt", false]], "nallatom() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.nallatom", false]], "nalpha() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.nalpha", false]], "nalphapi() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.nalphapi", false]], "name (psi4.core.derivcalctype attribute)": [[62, "psi4.core.DerivCalcType.name", false]], "name (psi4.core.diagonalizeorder attribute)": [[63, "psi4.core.DiagonalizeOrder.name", false]], "name (psi4.core.dimension attribute)": [[64, "psi4.core.Dimension.name", false]], "name (psi4.core.fragmenttype attribute)": [[79, "psi4.core.FragmentType.name", false]], "name (psi4.core.gaussiantype attribute)": [[82, "psi4.core.GaussianType.name", false]], "name (psi4.core.geometryunits attribute)": [[83, "psi4.core.GeometryUnits.name", false]], "name (psi4.core.intvector attribute)": [[88, "psi4.core.IntVector.name", false]], "name (psi4.core.matrix attribute)": [[100, "psi4.core.Matrix.name", false]], "name (psi4.core.primitivetype attribute)": [[122, "psi4.core.PrimitiveType.name", false]], "name (psi4.core.psireturntype attribute)": [[126, "psi4.core.PsiReturnType.name", false]], "name (psi4.core.savetype attribute)": [[135, "psi4.core.SaveType.name", false]], "name (psi4.core.vector attribute)": [[148, "psi4.core.Vector.name", false]], "name() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.name", false]], "name() (psi4.core.dispersion method)": [[68, "psi4.core.Dispersion.name", false]], "name() (psi4.core.functional method)": [[80, "psi4.core.Functional.name", false]], "name() (psi4.core.jk method)": [[92, "psi4.core.JK.name", false]], "name() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.name", false]], "name() (psi4.core.orbitalspace method)": [[115, "psi4.core.OrbitalSpace.name", false]], "name() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.name", false]], "name() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.name", false]], "nao() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.nao", false]], "nat_orbs (detci)": [[1704, "term-NAT_ORBS-DETCI", true]], "nat_orbs (dfocc)": [[1704, "term-NAT_ORBS-DFOCC", true]], "nat_orbs (fnocc)": [[1704, "term-NAT_ORBS-FNOCC", true]], "nat_orbs (occ)": [[1704, "term-NAT_ORBS-OCC", true]], "nat_orbs_t2 (sapt)": [[1704, "term-NAT_ORBS_T2-SAPT", true]], "nat_orbs_t3 (sapt)": [[1704, "term-NAT_ORBS_T3-SAPT", true]], "nat_orbs_v4 (sapt)": [[1704, "term-NAT_ORBS_V4-SAPT", true]], "natom() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.natom", false]], "naux (cc)": [[1776, "psivar-NAUX-CC", false]], "naux (scf)": [[1776, "psivar-NAUX-SCF", false]], "nbeta() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.nbeta", false]], "nbetapi() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.nbetapi", false]], "nbf() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.nbf", false]], "nbf() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.nbf", false]], "nblocks() (psi4.core.vbase method)": [[147, "psi4.core.VBase.nblocks", false]], "nbodies_per_mc_level (psi4.driver.driver_nbody.manybodycomputer attribute)": [[1794, "psi4.driver.driver_nbody.ManyBodyComputer.nbodies_per_mc_level", false]], "nbody (i, j, ..., k)@(a, b, ..., c) total energy": [[1776, "psivar-NBODY-i-j-...-k-a-b-...-c-TOTAL-ENERGY", false]], "nbody number": [[1776, "psivar-NBODY-NUMBER", false]], "nbody() (in module psi4.driver.driver_nbody)": [[1794, "psi4.driver.driver_nbody.nbody", false]], "ncartesian (psi4.core.gaussianshell attribute)": [[81, "psi4.core.GaussianShell.ncartesian", false]], "ncd() (psi4.core.cdsalclist method)": [[16, "psi4.core.CdSalcList.ncd", false]], "ncenter (psi4.core.gaussianshell attribute)": [[81, "psi4.core.GaussianShell.ncenter", false]], "ndet() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.ndet", false]], "needs_grac() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.needs_grac", false]], "needs_vv10() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.needs_vv10", false]], "needs_xc() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.needs_xc", false]], "new_civector() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.new_civector", false]], "new_triples (ccenergy)": [[1704, "term-NEW_TRIPLES-CCENERGY", true]], "new_triples (cceom)": [[1704, "term-NEW_TRIPLES-CCEOM", true]], "new_vector() (psi4.driver.p4util.solverengine method)": [[329, "psi4.driver.p4util.SolverEngine.new_vector", false]], "next() (psi4.core.aoshellcombinationsiterator method)": [[3, "psi4.core.AOShellCombinationsIterator.next", false]], "nfragments (psi4.driver.driver_nbody.manybodycomputer attribute)": [[1794, "psi4.driver.driver_nbody.ManyBodyComputer.nfragments", false]], "nfragments() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.nfragments", false]], "nfrzc() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.nfrzc", false]], "nfunction (psi4.core.gaussianshell attribute)": [[81, "psi4.core.GaussianShell.nfunction", false]], "ngamma() (psi4.core.correlationtable method)": [[20, "psi4.core.CorrelationTable.ngamma", false]], "nil() (psi4.core.mospace static method)": [[98, "psi4.core.MOSpace.nil", false]], "nirrep() (psi4.core.cdsalclist method)": [[16, "psi4.core.CdSalcList.nirrep", false]], "nirrep() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.nirrep", false]], "nirrep() (psi4.core.intvector method)": [[88, "psi4.core.IntVector.nirrep", false]], "nirrep() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.nirrep", false]], "nirrep() (psi4.core.orbitalspace method)": [[115, "psi4.core.OrbitalSpace.nirrep", false]], "nirrep() (psi4.core.vector method)": [[148, "psi4.core.Vector.nirrep", false]], "nirrep() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.nirrep", false]], "nl_dispersion_parameters (scf)": [[1704, "term-NL_DISPERSION_PARAMETERS-SCF", true]], "nmo() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.nmo", false]], "nmopi() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.nmopi", false]], "no_dfile (detci)": [[1704, "term-NO_DFILE-DETCI", true]], "no_occupations() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.no_occupations", false]], "no_reorient": [[1833, "index-2", false]], "no_singles (psimrcc)": [[1704, "term-NO_SINGLES-PSIMRCC", true]], "nocp (psi4.driver.driver_nbody.bsseenum attribute)": [[1794, "psi4.driver.driver_nbody.BsseEnum.nocp", false]], "norm() (psi4.core.civector method)": [[12, "psi4.core.CIVector.norm", false]], "norm() (psi4.core.vector3 method)": [[149, "psi4.core.Vector3.norm", false]], "normal_modes_write (findif)": [[1704, "term-NORMAL_MODES_WRITE-FINDIF", true]], "normalize() (psi4.core.vector3 method)": [[149, "psi4.core.Vector3.normalize", false]], "normalized (psi4.core.primitivetype attribute)": [[122, "psi4.core.PrimitiveType.Normalized", false]], "np (psi4.core.civector attribute)": [[12, "psi4.core.CIVector.np", false]], "np (psi4.core.matrix attribute)": [[100, "psi4.core.Matrix.np", false]], "np (psi4.core.vector attribute)": [[148, "psi4.core.Vector.np", false]], "np_read() (psi4.core.matrix class method)": [[100, "psi4.core.Matrix.np_read", false]], "np_read() (psi4.core.vector class method)": [[148, "psi4.core.Vector.np_read", false]], "np_write() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.np_write", false]], "np_write() (psi4.core.vector method)": [[148, "psi4.core.Vector.np_write", false]], "nph (psi4.core.matrix attribute)": [[100, "psi4.core.Matrix.nph", false]], "nph (psi4.core.vector attribute)": [[148, "psi4.core.Vector.nph", false]], "npoints() (psi4.core.blockopoints method)": [[9, "psi4.core.BlockOPoints.npoints", false]], "npoints() (psi4.core.moleculargrid method)": [[105, "psi4.core.MolecularGrid.npoints", false]], "nprimitive (psi4.core.gaussianshell attribute)": [[81, "psi4.core.GaussianShell.nprimitive", false]], "nprimitive() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.nprimitive", false]], "nshell() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.nshell", false]], "nshell_on_center() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.nshell_on_center", false]], "nso() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.nso", false]], "nsopi() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.nsopi", false]], "nuclear repulsion energy": [[1776, "psivar-NUCLEAR-REPULSION-ENERGY", false]], "nuclear() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.nuclear", false]], "nuclear_dipole() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.nuclear_dipole", false]], "nuclear_repulsion_energy() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.nuclear_repulsion_energy", false]], "nuclear_repulsion_energy_deriv1() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.nuclear_repulsion_energy_deriv1", false]], "nuclear_repulsion_energy_deriv2() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.nuclear_repulsion_energy_deriv2", false]], "num_amps_print (ccenergy)": [[1704, "term-NUM_AMPS_PRINT-CCENERGY", true]], "num_amps_print (cceom)": [[1704, "term-NUM_AMPS_PRINT-CCEOM", true]], "num_amps_print (cclambda)": [[1704, "term-NUM_AMPS_PRINT-CCLAMBDA", true]], "num_amps_print (ccresponse)": [[1704, "term-NUM_AMPS_PRINT-CCRESPONSE", true]], "num_amps_print (detci)": [[1704, "term-NUM_AMPS_PRINT-DETCI", true]], "num_core_orbitals (adc)": [[1704, "term-NUM_CORE_ORBITALS-ADC", true]], "num_dets_print (detci)": [[1704, "term-NUM_DETS_PRINT-DETCI", true]], "num_frozen_docc (globals)": [[1704, "term-NUM_FROZEN_DOCC-GLOBALS", true]], "num_frozen_uocc (globals)": [[1704, "term-NUM_FROZEN_UOCC-GLOBALS", true]], "num_guesses (adc)": [[1704, "term-NUM_GUESSES-ADC", true]], "num_init_vecs (detci)": [[1704, "term-NUM_INIT_VECS-DETCI", true]], "num_roots (detci)": [[1704, "term-NUM_ROOTS-DETCI", true]], "numint_grid() (psi4.core.numinthelper method)": [[110, "psi4.core.NumIntHelper.numint_grid", false]], "numinthelper (class in psi4.core)": [[110, "psi4.core.NumIntHelper", false]], "numpy": [[1797, "index-0", false]], "occ() (in module psi4.core)": [[218, "psi4.core.occ", false]], "occ() (psi4.core.mospace static method)": [[98, "psi4.core.MOSpace.occ", false]], "occ_orbs_print (dfocc)": [[1704, "term-OCC_ORBS_PRINT-DFOCC", true]], "occ_orbs_print (occ)": [[1704, "term-OCC_ORBS_PRINT-OCC", true]], "occ_percentage (fnocc)": [[1704, "term-OCC_PERCENTAGE-FNOCC", true]], "occ_tolerance (fnocc)": [[1704, "term-OCC_TOLERANCE-FNOCC", true]], "occ_tolerance (sapt)": [[1704, "term-OCC_TOLERANCE-SAPT", true]], "occupation_a() (psi4.core.hf method)": [[84, "psi4.core.HF.occupation_a", false]], "occupation_b() (psi4.core.hf method)": [[84, "psi4.core.HF.occupation_b", false]], "ocepa(0) correlation energy": [[1776, "psivar-OCEPA-0-CORRELATION-ENERGY", false]], "ocepa(0) total energy": [[1776, "psivar-OCEPA-0-TOTAL-ENERGY", false]], "odc_guess (dct)": [[1704, "term-ODC_GUESS-DCT", true]], "oeprop": [[1799, "index-0", false]], "oeprop (class in psi4.core)": [[111, "psi4.core.OEProp", false]], "oeprop (dfocc)": [[1704, "term-OEPROP-DFOCC", true]], "oeprop (occ)": [[1704, "term-OEPROP-OCC", true]], "oeprop() (in module psi4.driver)": [[317, "psi4.driver.oeprop", false]], "oeprop() (in module psi4.driver.p4util)": [[365, "psi4.driver.p4util.oeprop", false]], "offdiagonal_ccsd_t (psimrcc)": [[1704, "term-OFFDIAGONAL_CCSD_T-PSIMRCC", true]], "olccd": [[1798, "index-1", false], [1798, "index-5", false]], "olccd correlation energy": [[1776, "psivar-OLCCD-CORRELATION-ENERGY", false]], "olccd doubles energy": [[1776, "psivar-OLCCD-DOUBLES-ENERGY", false]], "olccd opposite-spin correlation energy": [[1776, "psivar-OLCCD-OPPOSITE-SPIN-CORRELATION-ENERGY", false]], "olccd reference correction energy": [[1776, "psivar-OLCCD-REFERENCE-CORRECTION-ENERGY", false]], "olccd same-spin correlation energy": [[1776, "psivar-OLCCD-SAME-SPIN-CORRELATION-ENERGY", false]], "olccd singles energy": [[1776, "psivar-OLCCD-SINGLES-ENERGY", false]], "olccd total energy": [[1776, "psivar-OLCCD-TOTAL-ENERGY", false]], "omega (ccresponse)": [[1704, "term-OMEGA-CCRESPONSE", true]], "omega() (psi4.core.functional method)": [[80, "psi4.core.Functional.omega", false]], "omega_erf (mints)": [[1704, "term-OMEGA_ERF-MINTS", true]], "omp2": [[1798, "index-1", false], [1798, "index-2", false]], "omp2 correlation energy": [[1776, "psivar-OMP2-CORRELATION-ENERGY", false]], "omp2 doubles energy": [[1776, "psivar-OMP2-DOUBLES-ENERGY", false]], "omp2 opposite-spin correlation energy": [[1776, "psivar-OMP2-OPPOSITE-SPIN-CORRELATION-ENERGY", false]], "omp2 reference correction energy": [[1776, "psivar-OMP2-REFERENCE-CORRECTION-ENERGY", false]], "omp2 same-spin correlation energy": [[1776, "psivar-OMP2-SAME-SPIN-CORRELATION-ENERGY", false]], "omp2 total energy": [[1776, "psivar-OMP2-TOTAL-ENERGY", false]], "omp2.5": [[1798, "index-4", false]], "omp2.5 correlation energy": [[1776, "psivar-OMP2.5-CORRELATION-ENERGY", false]], "omp2.5 doubles energy": [[1776, "psivar-OMP2.5-DOUBLES-ENERGY", false]], "omp2.5 opposite-spin correlation energy": [[1776, "psivar-OMP2.5-OPPOSITE-SPIN-CORRELATION-ENERGY", false]], "omp2.5 reference correction energy": [[1776, "psivar-OMP2.5-REFERENCE-CORRECTION-ENERGY", false]], "omp2.5 same-spin correlation energy": [[1776, "psivar-OMP2.5-SAME-SPIN-CORRELATION-ENERGY", false]], "omp2.5 total energy": [[1776, "psivar-OMP2.5-TOTAL-ENERGY", false]], "omp3": [[1798, "index-1", false], [1798, "index-3", false]], "omp3 correlation energy": [[1776, "psivar-OMP3-CORRELATION-ENERGY", false]], "omp3 doubles energy": [[1776, "psivar-OMP3-DOUBLES-ENERGY", false]], "omp3 opposite-spin correlation energy": [[1776, "psivar-OMP3-OPPOSITE-SPIN-CORRELATION-ENERGY", false]], "omp3 reference correction energy": [[1776, "psivar-OMP3-REFERENCE-CORRECTION-ENERGY", false]], "omp3 same-spin correlation energy": [[1776, "psivar-OMP3-SAME-SPIN-CORRELATION-ENERGY", false]], "omp3 total energy": [[1776, "psivar-OMP3-TOTAL-ENERGY", false]], "omp_nested": [[1756, "index-2", false], [1756, "index-3", false], [1767, "envvar-OMP_NESTED", false]], "omp_num_threads": [[661, "index-0", false], [1206, "index-0", false], [1224, "index-0", false], [1240, "index-0", false], [1704, "index-0", false], [1704, "index-1", false], [1743, "index-9", false], [1767, "envvar-OMP_NUM_THREADS", false], [1767, "index-14", false], [1767, "index-7", false]], "one-electron energy": [[1776, "psivar-ONE-ELECTRON-ENERGY", false]], "one_electron_integrals() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.one_electron_integrals", false]], "onebodyaoint (class in psi4.core)": [[112, "psi4.core.OneBodyAOInt", false]], "onebodysoint (class in psi4.core)": [[113, "psi4.core.OneBodySOInt", false]], "onel_hx() (psi4.core.hf method)": [[84, "psi4.core.HF.onel_Hx", false]], "onepdm (dfmp2)": [[1704, "term-ONEPDM-DFMP2", true]], "onepot_grid_read (scf)": [[1704, "term-ONEPOT_GRID_READ-SCF", true]], "oo_scale (dfocc)": [[1704, "term-OO_SCALE-DFOCC", true]], "opdm (dct)": [[1704, "term-OPDM-DCT", true]], "opdm (detci)": [[1704, "term-OPDM-DETCI", true]], "opdm() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.opdm", false]], "opdm_only (ccdensity)": [[1704, "term-OPDM_ONLY-CCDENSITY", true]], "opdm_relax (ccdensity)": [[1704, "term-OPDM_RELAX-CCDENSITY", true]], "opdm_relax (dfmp2)": [[1704, "term-OPDM_RELAX-DFMP2", true]], "open() (psi4.core.io method)": [[86, "psi4.core.IO.open", false]], "open_check() (psi4.core.io method)": [[86, "psi4.core.IO.open_check", false]], "operate() (psi4.core.symmetryoperation method)": [[139, "psi4.core.SymmetryOperation.operate", false]], "opt()": [[1800, "index-0", false]], "opt() (in module psi4.driver)": [[318, "psi4.driver.opt", false]], "opt_coordinates (optking)": [[1704, "term-OPT_COORDINATES-OPTKING", true]], "opt_method (dfocc)": [[1704, "term-OPT_METHOD-DFOCC", true]], "opt_method (occ)": [[1704, "term-OPT_METHOD-OCC", true]], "opt_restart (optking)": [[1704, "term-OPT_RESTART-OPTKING", true]], "opt_type (optking)": [[1704, "term-OPT_TYPE-OPTKING", true]], "optimization iterations": [[1776, "psivar-OPTIMIZATION-ITERATIONS", false]], "optimizationconvergenceerror": [[270, "psi4.driver.OptimizationConvergenceError", false]], "optimize()": [[1800, "index-0", false]], "optimize() (in module psi4.driver)": [[319, "psi4.driver.optimize", false]], "optimize_geometric() (in module psi4.driver)": [[320, "psi4.driver.optimize_geometric", false]], "option_exists_in_module() (in module psi4.core)": [[219, "psi4.core.option_exists_in_module", false]], "options (class in psi4.core)": [[114, "psi4.core.Options", false]], "options() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.options", false]], "options_to_python() (in module psi4.core)": [[220, "psi4.core.options_to_python", false]], "optionsstate (class in psi4.driver.p4util)": [[327, "psi4.driver.p4util.OptionsState", false]], "optionsstatecm() (in module psi4.driver.p4util)": [[328, "psi4.driver.p4util.OptionsStateCM", false]], "optionstate (class in psi4.driver.p4util)": [[326, "psi4.driver.p4util.OptionState", false]], "orb_opt (dfocc)": [[1704, "term-ORB_OPT-DFOCC", true]], "orb_opt (occ)": [[1704, "term-ORB_OPT-OCC", true]], "orb_resp_solver (dfocc)": [[1704, "term-ORB_RESP_SOLVER-DFOCC", true]], "orb_resp_solver (occ)": [[1704, "term-ORB_RESP_SOLVER-OCC", true]], "orbital-optimized methods": [[1798, "index-1", false]], "orbital-optimized methods, olccd": [[1798, "index-0", false]], "orbital-optimized methods, omp2": [[1798, "index-0", false]], "orbital-optimized methods, omp2.5": [[1798, "index-0", false]], "orbital-optimized methods, omp3": [[1798, "index-0", false]], "orbital_level_shift (dct)": [[1704, "term-ORBITAL_LEVEL_SHIFT-DCT", true]], "orbital_values() (psi4.core.pointfunctions method)": [[119, "psi4.core.PointFunctions.orbital_values", false]], "orbitals_write (scf)": [[1704, "term-ORBITALS_WRITE-SCF", true]], "orbitalspace (class in psi4.core)": [[115, "psi4.core.OrbitalSpace", false]], "order() (psi4.core.charactertable method)": [[17, "psi4.core.CharacterTable.order", false]], "order() (psi4.core.pointgroup method)": [[120, "psi4.core.PointGroup.order", false]], "ordered_params (psi4.driver.empiricaldispersion attribute)": [[267, "psi4.driver.EmpiricalDispersion.ordered_params", false]], "ordered_params (psi4.driver.procrouting.empirical_dispersion.empiricaldispersion attribute)": [[1759, "psi4.driver.procrouting.empirical_dispersion.EmpiricalDispersion.ordered_params", false]], "oremp": [[1798, "index-6", false]], "oremp2 correlation energy": [[1776, "psivar-OREMP2-CORRELATION-ENERGY", false]], "oremp2 doubles energy": [[1776, "psivar-OREMP2-DOUBLES-ENERGY", false]], "oremp2 opposite-spin correlation energy": [[1776, "psivar-OREMP2-OPPOSITE-SPIN-CORRELATION-ENERGY", false]], "oremp2 reference correction energy": [[1776, "psivar-OREMP2-REFERENCE-CORRECTION-ENERGY", false]], "oremp2 same-spin correlation energy": [[1776, "psivar-OREMP2-SAME-SPIN-CORRELATION-ENERGY", false]], "oremp2 singles energy": [[1776, "psivar-OREMP2-SINGLES-ENERGY", false]], "oremp2 total energy": [[1776, "psivar-OREMP2-TOTAL-ENERGY", false]], "orientation() (psi4.core.moleculargrid method)": [[105, "psi4.core.MolecularGrid.orientation", false]], "orientation_fixed() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.orientation_fixed", false]], "origin (psi4.core.onebodyaoint attribute)": [[112, "psi4.core.OneBodyAOInt.origin", false]], "original_coef() (psi4.core.gaussianshell method)": [[81, "psi4.core.GaussianShell.original_coef", false]], "orth_type (dfocc)": [[1704, "term-ORTH_TYPE-DFOCC", true]], "orth_type (occ)": [[1704, "term-ORTH_TYPE-OCC", true]], "os_scale (occ)": [[1704, "term-OS_SCALE-OCC", true]], "outfile_name() (in module psi4.core)": [[221, "psi4.core.outfile_name", false]], "output": [[1740, "index-2", false], [1752, "index-3", false], [1802, "index-4", false], [1837, "index-5", false], [1843, "index-1", false]], "overlap() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.overlap", false]], "overlap_3c() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.overlap_3c", false]], "overlap_check (cceom)": [[1704, "term-OVERLAP_CHECK-CCEOM", true]], "overlap_grad() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.overlap_grad", false]], "overlapint (class in psi4.core)": [[116, "psi4.core.OverlapInt", false]], "owner_group (psi4.driver.atomiccomputer attribute)": [[265, "psi4.driver.AtomicComputer.owner_group", false]], "p (psi4.core.aoshellcombinationsiterator attribute)": [[3, "psi4.core.AOShellCombinationsIterator.p", false]], "p (thermo)": [[1704, "term-P-THERMO", true]], "pair_energies_print (ccenergy)": [[1704, "term-PAIR_ENERGIES_PRINT-CCENERGY", true]], "parallel (scf)": [[1704, "term-PARALLEL-SCF", true]], "parallel operation": [[1767, "index-6", false]], "parent_atom() (psi4.core.blockopoints method)": [[9, "psi4.core.BlockOPoints.parent_atom", false]], "parent_symmetry (globals)": [[1704, "term-PARENT_SYMMETRY-GLOBALS", true]], "parsingerror": [[271, "psi4.driver.ParsingError", false]], "partial_cholesky_factorize() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.partial_cholesky_factorize", false]], "partition() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.partition", false]], "pasturerequirederror": [[272, "psi4.driver.PastureRequiredError", false]], "path": [[2, "index-1", false], [106, "index-0", false], [1738, "index-1", false], [1738, "index-10", false], [1738, "index-11", false], [1738, "index-12", false], [1738, "index-13", false], [1738, "index-14", false], [1738, "index-15", false], [1738, "index-16", false], [1738, "index-17", false], [1738, "index-18", false], [1738, "index-19", false], [1738, "index-24", false], [1738, "index-25", false], [1738, "index-26", false], [1738, "index-5", false], [1738, "index-7", false], [1743, "index-1", false], [1743, "index-3", false], [1743, "index-5", false], [1743, "index-7", false], [1748, "index-0", false], [1748, "index-3", false], [1748, "index-5", false], [1748, "index-6", false], [1748, "index-7", false], [1759, "index-1", false], [1767, "envvar-PATH", false], [1767, "index-17", false], [1767, "index-18", false], [1774, "index-1", false], [1774, "index-2", false], [1792, "index-1", false]], "pbs queueing system": [[1767, "index-9", false]], "pcg_beta_type (dfocc)": [[1704, "term-PCG_BETA_TYPE-DFOCC", true]], "pcg_beta_type (occ)": [[1704, "term-PCG_BETA_TYPE-OCC", true]], "pcg_convergence (dfocc)": [[1704, "term-PCG_CONVERGENCE-DFOCC", true]], "pcg_convergence (occ)": [[1704, "term-PCG_CONVERGENCE-OCC", true]], "pcg_maxiter (dfocc)": [[1704, "term-PCG_MAXITER-DFOCC", true]], "pcg_maxiter (occ)": [[1704, "term-PCG_MAXITER-OCC", true]], "pcm": [[1754, "index-0", false], [1803, "index-0", false], [1803, "index-1", false]], "pcm (globals)": [[1704, "term-PCM-GLOBALS", true]], "pcm polarization energy": [[1776, "psivar-PCM-POLARIZATION-ENERGY", false]], "pcm_cc_type (pcm)": [[1704, "term-PCM_CC_TYPE-PCM", true]], "pcm_enabled() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.PCM_enabled", false]], "pcm_helper() (in module psi4.driver)": [[379, "psi4.driver.pcm_helper", false]], "pcm_helper() (in module psi4.driver.p4util)": [[366, "psi4.driver.p4util.pcm_helper", false]], "pcm_scf_type (pcm)": [[1704, "term-PCM_SCF_TYPE-PCM", true]], "pcmsolver": [[1803, "index-0", false]], "pcmsolver_parsed_fname (pcm)": [[1704, "term-PCMSOLVER_PARSED_FNAME-PCM", true]], "pe": [[1749, "index-0", false], [1749, "index-1", false]], "pe (globals)": [[1704, "term-PE-GLOBALS", true]], "pe energy": [[1776, "psivar-PE-ENERGY", false]], "pe_ecp (pe)": [[1704, "term-PE_ECP-PE", true]], "pep1": [[1804, "index-0", false]], "perturb_cbs (psimrcc)": [[1704, "term-PERTURB_CBS-PSIMRCC", true]], "perturb_cbs_coupling (psimrcc)": [[1704, "term-PERTURB_CBS_COUPLING-PSIMRCC", true]], "perturb_dipole (scf)": [[1704, "term-PERTURB_DIPOLE-SCF", true]], "perturb_grad() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.perturb_grad", false]], "perturb_h (scf)": [[1704, "term-PERTURB_H-SCF", true]], "perturb_magnitude (detci)": [[1704, "term-PERTURB_MAGNITUDE-DETCI", true]], "perturb_magnitude (scf)": [[1704, "term-PERTURB_MAGNITUDE-SCF", true]], "perturb_with (scf)": [[1704, "term-PERTURB_WITH-SCF", true]], "petite_list() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.petite_list", false]], "petite_list() (psi4.core.sobasisset method)": [[132, "psi4.core.SOBasisSet.petite_list", false]], "petite_list1() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.petite_list1", false]], "petitelist (class in psi4.core)": [[118, "psi4.core.PetiteList", false]], "phi_points (scf)": [[1704, "term-PHI_POINTS-SCF", true]], "physconst": [[1706, "index-0", false]], "physical constants": [[1832, "index-0", false]], "pitzer_to_ci_order_onel() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.pitzer_to_ci_order_onel", false]], "pitzer_to_ci_order_twoel() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.pitzer_to_ci_order_twoel", false]], "pk_all_nonsym (scf)": [[1704, "term-PK_ALL_NONSYM-SCF", true]], "pk_max_buckets (scf)": [[1704, "term-PK_MAX_BUCKETS-SCF", true]], "plan() (psi4.driver.atomiccomputer method)": [[265, "psi4.driver.AtomicComputer.plan", false]], "plan() (psi4.driver.driver_cbs.compositecomputer method)": [[1740, "psi4.driver.driver_cbs.CompositeComputer.plan", false]], "plan() (psi4.driver.driver_findif.finitedifferencecomputer method)": [[1772, "psi4.driver.driver_findif.FiniteDifferenceComputer.plan", false]], "plan() (psi4.driver.driver_nbody.manybodycomputer method)": [[1794, "psi4.driver.driver_nbody.ManyBodyComputer.plan", false]], "plan() (psi4.driver.task_base.basecomputer method)": [[1768, "psi4.driver.task_base.BaseComputer.plan", false]], "play() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.play", false]], "plugin": [[1807, "index-0", false]], "plugin() (in module psi4.core)": [[222, "psi4.core.plugin", false]], "plugin_close() (in module psi4.core)": [[223, "psi4.core.plugin_close", false]], "plugin_close_all() (in module psi4.core)": [[224, "psi4.core.plugin_close_all", false]], "plugin_load() (in module psi4.core)": [[225, "psi4.core.plugin_load", false]], "plump_qcvar() (in module psi4.driver.p4util)": [[367, "psi4.driver.p4util.plump_qcvar", false]], "pmlocalizer (class in psi4.core)": [[117, "psi4.core.PMLocalizer", false]], "pno_convergence (dlpno)": [[1704, "term-PNO_CONVERGENCE-DLPNO", true]], "point_group() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.point_group", false]], "point_values() (psi4.core.pointfunctions method)": [[119, "psi4.core.PointFunctions.point_values", false]], "pointfunctions (class in psi4.core)": [[119, "psi4.core.PointFunctions", false]], "pointgroup (class in psi4.core)": [[120, "psi4.core.PointGroup", false]], "points (findif)": [[1704, "term-POINTS-FINDIF", true]], "pop() (psi4.core.bsvec method)": [[5, "psi4.core.BSVec.pop", false]], "populateextern() (psi4.driver.qmmmbohr method)": [[275, "psi4.driver.QMMMbohr.populateExtern", false]], "position_camera() (psi4.driver.p4util.inpsight method)": [[323, "psi4.driver.p4util.InPsight.position_camera", false]], "potential_grad() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.potential_grad", false]], "potential_integral() (psi4.core.numinthelper method)": [[110, "psi4.core.NumIntHelper.potential_integral", false]], "potential_variable() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.potential_variable", false]], "potential_variables() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.potential_variables", false]], "potentialint (class in psi4.core)": [[121, "psi4.core.PotentialInt", false]], "potfile (pe)": [[1704, "term-POTFILE-PE", true]], "power() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.power", false]], "ppl_type (dfocc)": [[1704, "term-PPL_TYPE-DFOCC", true]], "precondition() (psi4.driver.p4util.solverengine method)": [[329, "psi4.driver.p4util.SolverEngine.precondition", false]], "preconditioner (detci)": [[1704, "term-PRECONDITIONER-DETCI", true]], "prefactor_ecd() (in module psi4.driver.p4util)": [[368, "psi4.driver.p4util.prefactor_ecd", false]], "prefactor_opa() (in module psi4.driver.p4util)": [[369, "psi4.driver.p4util.prefactor_opa", false]], "prepare_options_for_module() (in module psi4.core)": [[226, "psi4.core.prepare_options_for_module", false]], "prepare_options_for_modules() (in module psi4.driver.p4util)": [[370, "psi4.driver.p4util.prepare_options_for_modules", false]], "prepare_options_for_set_options() (in module psi4.driver.p4util)": [[371, "psi4.driver.p4util.prepare_options_for_set_options", false]], "prepare_results() (psi4.driver.driver_nbody.manybodycomputer method)": [[1794, "psi4.driver.driver_nbody.ManyBodyComputer.prepare_results", false]], "prerequisites": [[1738, "index-0", false]], "presort_so_tei() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.presort_so_tei", false]], "primitivetype (class in psi4.core)": [[122, "psi4.core.PrimitiveType", false]], "print (cphf)": [[1704, "term-PRINT-CPHF", true]], "print (efp)": [[1704, "term-PRINT-EFP", true]], "print (globals)": [[1704, "term-PRINT-GLOBALS", true]], "print (sapt)": [[1704, "term-PRINT-SAPT", true]], "print() (psi4.core.moleculargrid method)": [[105, "psi4.core.MolecularGrid.print", false]], "print() (psi4.core.petitelist method)": [[118, "psi4.core.PetiteList.print", false]], "print_atom_vector() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.print_atom_vector", false]], "print_basis (scf)": [[1704, "term-PRINT_BASIS-SCF", true]], "print_bond_angles() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.print_bond_angles", false]], "print_cluster() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.print_cluster", false]], "print_density_threshold() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.print_density_threshold", false]], "print_detail() (psi4.core.functional method)": [[80, "psi4.core.Functional.print_detail", false]], "print_detail() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.print_detail", false]], "print_detail_out() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.print_detail_out", false]], "print_distances() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.print_distances", false]], "print_dpd_lookup() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.print_dpd_lookup", false]], "print_energies() (psi4.core.hf method)": [[84, "psi4.core.HF.print_energies", false]], "print_energy() (psi4.core.dispersion method)": [[68, "psi4.core.Dispersion.print_energy", false]], "print_global_options() (in module psi4.core)": [[227, "psi4.core.print_global_options", false]], "print_global_options() (psi4.core.options method)": [[114, "psi4.core.Options.print_global_options", false]], "print_gradient() (psi4.core.dispersion method)": [[68, "psi4.core.Dispersion.print_gradient", false]], "print_header() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.print_header", false]], "print_header() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.print_header", false]], "print_header() (psi4.core.hf method)": [[84, "psi4.core.HF.print_header", false]], "print_header() (psi4.core.jk method)": [[92, "psi4.core.JK.print_header", false]], "print_header() (psi4.core.vbase method)": [[147, "psi4.core.VBase.print_header", false]], "print_hessian() (psi4.core.dispersion method)": [[68, "psi4.core.Dispersion.print_hessian", false]], "print_in_input_format() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.print_in_input_format", false]], "print_module_options() (psi4.core.options method)": [[114, "psi4.core.Options.print_module_options", false]], "print_molden_vibs() (in module psi4.driver.qcdb.vib)": [[388, "psi4.driver.qcdb.vib.print_molden_vibs", false]], "print_mos (scf)": [[1704, "term-PRINT_MOS-SCF", true]], "print_noons (globals)": [[1704, "term-PRINT_NOONS-GLOBALS", true]], "print_opt_params (optking)": [[1704, "term-PRINT_OPT_PARAMS-OPTKING", true]], "print_options() (in module psi4.core)": [[228, "psi4.core.print_options", false]], "print_orbitals() (psi4.core.hf method)": [[84, "psi4.core.HF.print_orbitals", false]], "print_out() (in module psi4.core)": [[229, "psi4.core.print_out", false]], "print_out() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.print_out", false]], "print_out() (psi4.core.blockopoints method)": [[9, "psi4.core.BlockOPoints.print_out", false]], "print_out() (psi4.core.cdsalc method)": [[15, "psi4.core.CdSalc.print_out", false]], "print_out() (psi4.core.cdsalclist method)": [[16, "psi4.core.CdSalcList.print_out", false]], "print_out() (psi4.core.dimension method)": [[64, "psi4.core.Dimension.print_out", false]], "print_out() (psi4.core.dispersion method)": [[68, "psi4.core.Dispersion.print_out", false]], "print_out() (psi4.core.externalpotential method)": [[73, "psi4.core.ExternalPotential.print_out", false]], "print_out() (psi4.core.functional method)": [[80, "psi4.core.Functional.print_out", false]], "print_out() (psi4.core.intvector method)": [[88, "psi4.core.IntVector.print_out", false]], "print_out() (psi4.core.iomanager method)": [[87, "psi4.core.IOManager.print_out", false]], "print_out() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.print_out", false]], "print_out() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.print_out", false]], "print_out() (psi4.core.orbitalspace method)": [[115, "psi4.core.OrbitalSpace.print_out", false]], "print_out() (psi4.core.pointfunctions method)": [[119, "psi4.core.PointFunctions.print_out", false]], "print_out() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.print_out", false]], "print_out() (psi4.core.vector method)": [[148, "psi4.core.Vector.print_out", false]], "print_out() (psi4.driver.empiricaldispersion method)": [[267, "psi4.driver.EmpiricalDispersion.print_out", false]], "print_out_in_angstrom() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.print_out_in_angstrom", false]], "print_out_in_bohr() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.print_out_in_bohr", false]], "print_out_of_planes() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.print_out_of_planes", false]], "print_preiterations() (psi4.core.hf method)": [[84, "psi4.core.HF.print_preiterations", false]], "print_rotational_constants() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.print_rotational_constants", false]], "print_stability_analysis() (psi4.core.hf method)": [[84, "psi4.core.HF.print_stability_analysis", false]], "print_tensor_pqq() (psi4.core.fdds_dispersion method)": [[75, "psi4.core.FDDS_Dispersion.print_tensor_pqQ", false]], "print_trailer() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.print_trailer", false]], "print_trajectory_xyz_file (optking)": [[1704, "term-PRINT_TRAJECTORY_XYZ_FILE-OPTKING", true]], "print_variables() (in module psi4.core)": [[230, "psi4.core.print_variables", false]], "print_vector() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.print_vector", false]], "print_vibs() (in module psi4.driver.qcdb.vib)": [[389, "psi4.driver.qcdb.vib.print_vibs", false]], "priority (psi4.driver.atomiccomputer attribute)": [[265, "psi4.driver.AtomicComputer.priority", false]], "process_grid (scf)": [[1704, "term-PROCESS_GRID-SCF", true]], "process_input() (in module psi4.driver)": [[380, "psi4.driver.process_input", false]], "process_input() (in module psi4.driver.inputparser)": [[1768, "psi4.driver.inputparser.process_input", false]], "project_densities() (psi4.core.fdds_dispersion method)": [[75, "psi4.core.FDDS_Dispersion.project_densities", false]], "prop (class in psi4.core)": [[123, "psi4.core.Prop", false]], "prop()": [[1826, "index-0", false]], "prop() (in module psi4.driver)": [[381, "psi4.driver.prop", false]], "prop_all (ccdensity)": [[1704, "term-PROP_ALL-CCDENSITY", true]], "prop_all (cclambda)": [[1704, "term-PROP_ALL-CCLAMBDA", true]], "prop_root (ccdensity)": [[1704, "term-PROP_ROOT-CCDENSITY", true]], "prop_root (cceom)": [[1704, "term-PROP_ROOT-CCEOM", true]], "prop_root (cclambda)": [[1704, "term-PROP_ROOT-CCLAMBDA", true]], "prop_sym (ccdensity)": [[1704, "term-PROP_SYM-CCDENSITY", true]], "prop_sym (cceom)": [[1704, "term-PROP_SYM-CCEOM", true]], "prop_sym (cclambda)": [[1704, "term-PROP_SYM-CCLAMBDA", true]], "properties (globals)": [[1704, "term-PROPERTIES-GLOBALS", true]], "properties()": [[1826, "index-0", false]], "properties() (in module psi4.driver)": [[382, "psi4.driver.properties", false]], "properties() (psi4.core.vbase method)": [[147, "psi4.core.VBase.properties", false]], "properties_origin (globals)": [[1704, "term-PROPERTIES_ORIGIN-GLOBALS", true]], "property (ccenergy)": [[1704, "term-PROPERTY-CCENERGY", true]], "property (ccresponse)": [[1704, "term-PROPERTY-CCRESPONSE", true]], "protocols (psi4.driver.atomiccomputer attribute)": [[265, "psi4.driver.AtomicComputer.protocols", false]], "protointvector (class in psi4.core)": [[124, "psi4.core.ProtoIntVector", false]], "protovector (class in psi4.core)": [[125, "psi4.core.ProtoVector", false]], "provenance() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.provenance", false]], "provenance_stamp() (in module psi4.driver.p4util)": [[372, "psi4.driver.p4util.provenance_stamp", false]], "pseudoinverse() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.pseudoinverse", false]], "psi4 command line option": [[1767, "cmdoption-psi4-V", false], [1767, "cmdoption-psi4-a", false], [1767, "cmdoption-psi4-h", false], [1767, "cmdoption-psi4-i", false], [1767, "cmdoption-psi4-inplace", false], [1767, "cmdoption-psi4-k", false], [1767, "cmdoption-psi4-l", false], [1767, "cmdoption-psi4-loglevel", false], [1767, "cmdoption-psi4-m", false], [1767, "cmdoption-psi4-memory", false], [1767, "cmdoption-psi4-module", false], [1767, "cmdoption-psi4-n", false], [1767, "cmdoption-psi4-o", false], [1767, "cmdoption-psi4-psiapi-path", false], [1767, "cmdoption-psi4-qcschema", false], [1767, "cmdoption-psi4-s", false], [1767, "cmdoption-psi4-t", false], [1767, "cmdoption-psi4-v", false]], "psi4.core": [[1827, "module-psi4.core", false]], "psi4.driver": [[1827, "module-psi4.driver", false]], "psi4.driver.p4util": [[1827, "module-psi4.driver.p4util", false]], "psi4.driver.qcdb.vib": [[1772, "module-psi4.driver.qcdb.vib", false]], "psi4fockci": [[1805, "index-0", false]], "psi4rc": [[1767, "index-4", false]], "psi_scratch": [[1738, "index-27", false], [1748, "index-1", false], [1748, "index-2", false], [1748, "index-4", false], [1748, "index-8", false], [1767, "envvar-PSI_SCRATCH", false], [1767, "index-1", false], [1767, "index-12", false], [1767, "index-15", false], [1767, "index-19", false], [1767, "index-2", false], [1767, "index-3", false], [1767, "index-5", false]], "psi_top_srcdir() (in module psi4.core)": [[231, "psi4.core.psi_top_srcdir", false]], "psiclean() (psi4.core.iomanager method)": [[87, "psi4.core.IOManager.psiclean", false]], "psidatadir": [[194, "index-0", false], [245, "index-0", false], [1738, "index-3", false], [1738, "index-8", false], [1738, "index-9", false], [1767, "envvar-PSIDATADIR", false], [1767, "index-10", false], [1767, "index-13", false], [1767, "index-8", false], [1827, "index-2", false], [1827, "index-3", false]], "psiexception": [[273, "psi4.driver.PsiException", false]], "psimrcc() (in module psi4.core)": [[232, "psi4.core.psimrcc", false]], "psio_entry (class in psi4.core)": [[233, "psi4.core.psio_entry", false]], "psioh": [[1708, "index-0", false]], "psipath": [[106, "index-1", false], [1730, "index-4", false], [1730, "index-5", false], [1743, "index-2", false], [1743, "index-4", false], [1743, "index-6", false], [1743, "index-8", false], [1767, "envvar-PSIPATH", false], [1767, "index-11", false], [1767, "index-16", false], [1767, "index-20", false], [1767, "index-21", false], [1767, "index-22", false], [1767, "index-23", false], [1774, "index-3", false], [1782, "index-2", false], [1782, "index-3", false], [1808, "index-1", false], [1835, "index-1", false]], "psirc": [[1767, "index-4", false]], "psireturntype (class in psi4.core)": [[126, "psi4.core.PsiReturnType", false]], "pt_energy (psimrcc)": [[1704, "term-PT_ENERGY-PSIMRCC", true]], "pubchem": [[1833, "index-5", false]], "pure (psi4.core.gaussiantype attribute)": [[82, "psi4.core.GaussianType.Pure", false]], "puream (globals)": [[1704, "term-PUREAM-GLOBALS", true]], "push_back_external_potential() (psi4.core.hf method)": [[84, "psi4.core.HF.push_back_external_potential", false]], "pythonpath": [[2, "index-0", false], [1738, "index-2", false], [1738, "index-4", false], [1738, "index-6", false], [1752, "index-1", false], [1752, "index-2", false], [1759, "index-2", false], [1767, "envvar-PYTHONPATH", false], [1767, "index-24", false], [1806, "index-1", false], [1807, "index-1", false], [1807, "index-2", false], [1808, "index-0", false]], "q (psi4.core.aoshellcombinationsiterator attribute)": [[3, "psi4.core.AOShellCombinationsIterator.q", false]], "qc_coupling (dct)": [[1704, "term-QC_COUPLING-DCT", true]], "qc_module (globals)": [[1704, "term-QC_MODULE-GLOBALS", true]], "qc_type (dct)": [[1704, "term-QC_TYPE-DCT", true]], "qchf (dfocc)": [[1704, "term-QCHF-DFOCC", true]], "qchf (scf)": [[1704, "term-QCHF-SCF", true]], "qcisd correlation energy": [[1776, "psivar-QCISD-CORRELATION-ENERGY", false]], "qcisd doubles energy": [[1776, "psivar-QCISD-DOUBLES-ENERGY", false]], "qcisd opposite-spin correlation energy": [[1776, "psivar-QCISD-OPPOSITE-SPIN-CORRELATION-ENERGY", false]], "qcisd same-spin correlation energy": [[1776, "psivar-QCISD-SAME-SPIN-CORRELATION-ENERGY", false]], "qcisd singles energy": [[1776, "psivar-QCISD-SINGLES-ENERGY", false]], "qcisd total energy": [[1776, "psivar-QCISD-TOTAL-ENERGY", false]], "qcisd(t)": [[1771, "index-1", false]], "qcisd(t) correction energy": [[1776, "psivar-QCISD-T-CORRECTION-ENERGY", false]], "qcisd(t) correlation energy": [[1776, "psivar-QCISD-T-CORRELATION-ENERGY", false]], "qcisd(t) total energy": [[1776, "psivar-QCISD-T-TOTAL-ENERGY", false]], "qmefp (efp)": [[1704, "term-QMEFP-EFP", true]], "qmmm (class in psi4.driver)": [[274, "psi4.driver.QMMM", false]], "qmmmbohr (class in psi4.driver)": [[275, "psi4.driver.QMMMbohr", false]], "qmo() (psi4.core.dftensor method)": [[30, "psi4.core.DFTensor.Qmo", false]], "qoo() (psi4.core.dftensor method)": [[30, "psi4.core.DFTensor.Qoo", false]], "qov() (psi4.core.dftensor method)": [[30, "psi4.core.DFTensor.Qov", false]], "qso() (psi4.core.dftensor method)": [[30, "psi4.core.DFTensor.Qso", false]], "quadrature_values() (psi4.core.vbase method)": [[147, "psi4.core.VBase.quadrature_values", false]], "quadrupoleint (class in psi4.core)": [[127, "psi4.core.QuadrupoleInt", false]], "query_libxc() (psi4.core.libxcfunctional method)": [[96, "psi4.core.LibXCFunctional.query_libxc", false]], "quiet (psi4.driver.driver_nbody.manybodycomputer attribute)": [[1794, "psi4.driver.driver_nbody.ManyBodyComputer.quiet", false]], "qvv() (psi4.core.dftensor method)": [[30, "psi4.core.DFTensor.Qvv", false]], "r (psi4.core.aoshellcombinationsiterator attribute)": [[3, "psi4.core.AOShellCombinationsIterator.r", false]], "r4s (detci)": [[1704, "term-R4S-DETCI", true]], "r_a() (psi4.core.fdds_dispersion method)": [[75, "psi4.core.FDDS_Dispersion.R_A", false]], "r_b() (psi4.core.fdds_dispersion method)": [[75, "psi4.core.FDDS_Dispersion.R_B", false]], "r_convergence (adc)": [[1704, "term-R_CONVERGENCE-ADC", true]], "r_convergence (ccenergy)": [[1704, "term-R_CONVERGENCE-CCENERGY", true]], "r_convergence (cceom)": [[1704, "term-R_CONVERGENCE-CCEOM", true]], "r_convergence (cclambda)": [[1704, "term-R_CONVERGENCE-CCLAMBDA", true]], "r_convergence (ccresponse)": [[1704, "term-R_CONVERGENCE-CCRESPONSE", true]], "r_convergence (dct)": [[1704, "term-R_CONVERGENCE-DCT", true]], "r_convergence (detci)": [[1704, "term-R_CONVERGENCE-DETCI", true]], "r_convergence (dfocc)": [[1704, "term-R_CONVERGENCE-DFOCC", true]], "r_convergence (dlpno)": [[1704, "term-R_CONVERGENCE-DLPNO", true]], "r_convergence (fnocc)": [[1704, "term-R_CONVERGENCE-FNOCC", true]], "r_convergence (occ)": [[1704, "term-R_CONVERGENCE-OCC", true]], "r_convergence (psimrcc)": [[1704, "term-R_CONVERGENCE-PSIMRCC", true]], "r_points (scf)": [[1704, "term-R_POINTS-SCF", true]], "radial_scale (psi4.driver.p4util.inpsight attribute)": [[323, "psi4.driver.p4util.InPsight.radial_scale", false]], "radii (psi4.driver.p4util.inpsight attribute)": [[323, "psi4.driver.p4util.InPsight.radii", false]], "radius (scf)": [[1704, "term-RADIUS-SCF", true]], "random phase approximation": [[1841, "index-0", false]], "ranged_bend (optking)": [[1704, "term-RANGED_BEND-OPTKING", true]], "ranged_dihedral (optking)": [[1704, "term-RANGED_DIHEDRAL-OPTKING", true]], "ranged_distance (optking)": [[1704, "term-RANGED_DISTANCE-OPTKING", true]], "ranged_oofp (optking)": [[1704, "term-RANGED_OOFP-OPTKING", true]], "ras1 (globals)": [[1704, "term-RAS1-GLOBALS", true]], "ras2 (globals)": [[1704, "term-RAS2-GLOBALS", true]], "ras3 (globals)": [[1704, "term-RAS3-GLOBALS", true]], "ras34_max (detci)": [[1704, "term-RAS34_MAX-DETCI", true]], "ras3_max (detci)": [[1704, "term-RAS3_MAX-DETCI", true]], "ras4 (globals)": [[1704, "term-RAS4-GLOBALS", true]], "ras4_max (detci)": [[1704, "term-RAS4_MAX-DETCI", true]], "raw_compute_properties() (psi4.core.cubeproperties method)": [[21, "psi4.core.CubeProperties.raw_compute_properties", false]], "raw_plot() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.raw_plot", false]], "read() (psi4.core.civector method)": [[12, "psi4.core.CIVector.read", false]], "read_globals() (psi4.core.options method)": [[114, "psi4.core.Options.read_globals", false]], "read_scf_3index (dfocc)": [[1704, "term-READ_SCF_3INDEX-DFOCC", true]], "real (psi4.core.fragmenttype attribute)": [[79, "psi4.core.FragmentType.Real", false]], "reference (adc)": [[1704, "term-REFERENCE-ADC", true]], "reference (ccdensity)": [[1704, "term-REFERENCE-CCDENSITY", true]], "reference (ccenergy)": [[1704, "term-REFERENCE-CCENERGY", true]], "reference (cceom)": [[1704, "term-REFERENCE-CCEOM", true]], "reference (ccresponse)": [[1704, "term-REFERENCE-CCRESPONSE", true]], "reference (cctransort)": [[1704, "term-REFERENCE-CCTRANSORT", true]], "reference (cctriples)": [[1704, "term-REFERENCE-CCTRIPLES", true]], "reference (dct)": [[1704, "term-REFERENCE-DCT", true]], "reference (detci)": [[1704, "term-REFERENCE-DETCI", true]], "reference (mcscf)": [[1704, "term-REFERENCE-MCSCF", true]], "reference (scf)": [[1704, "term-REFERENCE-SCF", true]], "reference_sym (detci)": [[1704, "term-REFERENCE_SYM-DETCI", true]], "reference_wavefunction() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.reference_wavefunction", false]], "refresh() (psi4.core.blockopoints method)": [[9, "psi4.core.BlockOPoints.refresh", false]], "reg_param (dfocc)": [[1704, "term-REG_PARAM-DFOCC", true]], "register_composite_function() (in module psi4.driver.driver_cbs_helper)": [[1740, "psi4.driver.driver_cbs_helper.register_composite_function", false]], "register_xtpl_function() (in module psi4.driver.driver_cbs_helper)": [[1740, "psi4.driver.driver_cbs_helper.register_xtpl_function", false]], "regularization (dfocc)": [[1704, "term-REGULARIZATION-DFOCC", true]], "rehash() (psi4.core.io method)": [[86, "psi4.core.IO.rehash", false]], "reinterpret_coordentry() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.reinterpret_coordentry", false]], "relativistic": [[1836, "index-0", false]], "relativistic (globals)": [[1704, "term-RELATIVISTIC-GLOBALS", true]], "relax_guess_orbitals (dct)": [[1704, "term-RELAX_GUESS_ORBITALS-DCT", true]], "relaxed (occ)": [[1704, "term-RELAXED-OCC", true]], "remove() (psi4.core.bsvec method)": [[5, "psi4.core.BSVec.remove", false]], "remove_symmetry() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.remove_symmetry", false]], "remp2 correlation energy": [[1776, "psivar-REMP2-CORRELATION-ENERGY", false]], "remp2 doubles energy": [[1776, "psivar-REMP2-DOUBLES-ENERGY", false]], "remp2 opposite-spin correlation energy": [[1776, "psivar-REMP2-OPPOSITE-SPIN-CORRELATION-ENERGY", false]], "remp2 same-spin correlation energy": [[1776, "psivar-REMP2-SAME-SPIN-CORRELATION-ENERGY", false]], "remp2 singles energy": [[1776, "psivar-REMP2-SINGLES-ENERGY", false]], "remp2 total energy": [[1776, "psivar-REMP2-TOTAL-ENERGY", false]], "remp_a (dfocc)": [[1704, "term-REMP_A-DFOCC", true]], "remp_a (occ)": [[1704, "term-REMP_A-OCC", true]], "reopen_outfile() (in module psi4.core)": [[234, "psi4.core.reopen_outfile", false]], "repl_otf (detci)": [[1704, "term-REPL_OTF-DETCI", true]], "reset_ci_h0block() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.reset_ci_H0block", false]], "reset_occ_ (psi4.core.hf attribute)": [[84, "psi4.core.HF.reset_occ_", false]], "reset_occupation() (psi4.core.hf method)": [[84, "psi4.core.HF.reset_occupation", false]], "reset_point_group() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.reset_point_group", false]], "reset_so_int() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.reset_so_int", false]], "residue() (psi4.driver.p4util.solverengine method)": [[329, "psi4.driver.p4util.SolverEngine.residue", false]], "response_algorithm (dct)": [[1704, "term-RESPONSE_ALGORITHM-DCT", true]], "restart": [[1767, "index-0", false]], "restart (ccenergy)": [[1704, "term-RESTART-CCENERGY", true]], "restart (cclambda)": [[1704, "term-RESTART-CCLAMBDA", true]], "restart (ccresponse)": [[1704, "term-RESTART-CCRESPONSE", true]], "restart (detci)": [[1704, "term-RESTART-DETCI", true]], "restart_eom_cc3 (cceom)": [[1704, "term-RESTART_EOM_CC3-CCEOM", true]], "restore() (psi4.driver.p4util.optionsstate method)": [[327, "psi4.driver.p4util.OptionsState.restore", false]], "restore() (psi4.driver.p4util.optionstate method)": [[326, "psi4.driver.p4util.OptionState.restore", false]], "restricted_docc (globals)": [[1704, "term-RESTRICTED_DOCC-GLOBALS", true]], "restricted_uocc (globals)": [[1704, "term-RESTRICTED_UOCC-GLOBALS", true]], "result (psi4.driver.atomiccomputer attribute)": [[265, "psi4.driver.AtomicComputer.result", false]], "result_id (psi4.driver.atomiccomputer attribute)": [[265, "psi4.driver.AtomicComputer.result_id", false]], "results_list (psi4.driver.driver_cbs.compositecomputer attribute)": [[1740, "psi4.driver.driver_cbs.CompositeComputer.results_list", false]], "return_total_data (psi4.driver.driver_nbody.manybodycomputer attribute)": [[1794, "psi4.driver.driver_nbody.ManyBodyComputer.return_total_data", false]], "revoke_global_option_changed() (in module psi4.core)": [[235, "psi4.core.revoke_global_option_changed", false]], "revoke_local_option_changed() (in module psi4.core)": [[236, "psi4.core.revoke_local_option_changed", false]], "rfo_follow_root (optking)": [[1704, "term-RFO_FOLLOW_ROOT-OPTKING", true]], "rfo_normalization_max (optking)": [[1704, "term-RFO_NORMALIZATION_MAX-OPTKING", true]], "rfo_root (optking)": [[1704, "term-RFO_ROOT-OPTKING", true]], "rhf (class in psi4.core)": [[128, "psi4.core.RHF", false]], "rhf_energy() (psi4.core.somcscf method)": [[133, "psi4.core.SOMCSCF.rhf_energy", false]], "rhf_triplets (cceom)": [[1704, "term-RHF_TRIPLETS-CCEOM", true]], "right (psi4.driver.p4util.inpsight attribute)": [[323, "psi4.driver.p4util.InPsight.right", false]], "rksfunctions (class in psi4.core)": [[129, "psi4.core.RKSFunctions", false]], "rms() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.rms", false]], "rms_disp_g_convergence (optking)": [[1704, "term-RMS_DISP_G_CONVERGENCE-OPTKING", true]], "rms_force_g_convergence (optking)": [[1704, "term-RMS_FORCE_G_CONVERGENCE-OPTKING", true]], "rms_mograd_convergence (dfocc)": [[1704, "term-RMS_MOGRAD_CONVERGENCE-DFOCC", true]], "rms_mograd_convergence (occ)": [[1704, "term-RMS_MOGRAD_CONVERGENCE-OCC", true]], "rohf (class in psi4.core)": [[130, "psi4.core.ROHF", false]], "roots_per_irrep (adc)": [[1704, "term-ROOTS_PER_IRREP-ADC", true]], "roots_per_irrep (ccdensity)": [[1704, "term-ROOTS_PER_IRREP-CCDENSITY", true]], "roots_per_irrep (cceom)": [[1704, "term-ROOTS_PER_IRREP-CCEOM", true]], "roots_per_irrep (cclambda)": [[1704, "term-ROOTS_PER_IRREP-CCLAMBDA", true]], "rotate_columns() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.rotate_columns", false]], "rotate_mcscf_integrals() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.rotate_mcscf_integrals", false]], "rotate_mo_angle (mcscf)": [[1704, "term-ROTATE_MO_ANGLE-MCSCF", true]], "rotate_mo_irrep (mcscf)": [[1704, "term-ROTATE_MO_IRREP-MCSCF", true]], "rotate_mo_p (mcscf)": [[1704, "term-ROTATE_MO_P-MCSCF", true]], "rotate_mo_q (mcscf)": [[1704, "term-ROTATE_MO_Q-MCSCF", true]], "rotate_n() (psi4.core.symmetryoperation method)": [[139, "psi4.core.SymmetryOperation.rotate_n", false]], "rotate_orbitals() (psi4.core.hf method)": [[84, "psi4.core.HF.rotate_orbitals", false]], "rotate_theta() (psi4.core.symmetryoperation method)": [[139, "psi4.core.SymmetryOperation.rotate_theta", false]], "rotational_constants() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.rotational_constants", false]], "rotational_symmetry_number (thermo)": [[1704, "term-ROTATIONAL_SYMMETRY_NUMBER-THERMO", true]], "rotational_symmetry_number() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.rotational_symmetry_number", false]], "rotor_type() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.rotor_type", false]], "rowdim() (psi4.core.dpdbuf4 method)": [[183, "psi4.core.dpdbuf4.rowdim", false]], "rowdim() (psi4.core.dpdfile2 method)": [[184, "psi4.core.dpdfile2.rowdim", false]], "rowdim() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.rowdim", false]], "rows() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.rows", false]], "rpa": [[1841, "index-0", false]], "rsrfo_alpha_max (optking)": [[1704, "term-RSRFO_ALPHA_MAX-OPTKING", true]], "run_ccsd (fnocc)": [[1704, "term-RUN_CCSD-FNOCC", true]], "run_cctransort (cctransort)": [[1704, "term-RUN_CCTRANSORT-CCTRANSORT", true]], "run_cepa (fnocc)": [[1704, "term-RUN_CEPA-FNOCC", true]], "run_cfour() (in module psi4.driver.procrouting.interface_cfour)": [[1743, "psi4.driver.procrouting.interface_cfour.run_cfour", false]], "run_dftd3() (in module qcdb.molecule)": [[1759, "qcdb.Molecule.run_dftd3", false]], "run_dftd3() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.run_dftd3", false]], "run_dftd4() (in module qcdb.molecule)": [[1759, "qcdb.Molecule.run_dftd4", false]], "run_dftd4() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.run_dftd4", false]], "run_gcp() (in module qcdb.molecule)": [[1774, "qcdb.Molecule.run_gcp", false]], "run_gcp() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.run_gcp", false]], "run_mp2 (fnocc)": [[1704, "term-RUN_MP2-FNOCC", true]], "run_mp3 (fnocc)": [[1704, "term-RUN_MP3-FNOCC", true]], "run_mp4 (fnocc)": [[1704, "term-RUN_MP4-FNOCC", true]], "s (detci)": [[1704, "term-S-DETCI", true]], "s (psi4.core.aoshellcombinationsiterator attribute)": [[3, "psi4.core.AOShellCombinationsIterator.s", false]], "s() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.S", false]], "s6() (psi4.core.dispersion method)": [[68, "psi4.core.Dispersion.s6", false]], "s8() (psi4.core.dispersion method)": [[68, "psi4.core.Dispersion.s8", false]], "s_cholesky_tolerance (scf)": [[1704, "term-S_CHOLESKY_TOLERANCE-SCF", true]], "s_cut (dlpno)": [[1704, "term-S_CUT-DLPNO", true]], "s_orthogonalization (scf)": [[1704, "term-S_ORTHOGONALIZATION-SCF", true]], "s_tolerance (scf)": [[1704, "term-S_TOLERANCE-SCF", true]], "sad_ (psi4.core.hf attribute)": [[84, "psi4.core.HF.sad_", false]], "sad_chol_tolerance (scf)": [[1704, "term-SAD_CHOL_TOLERANCE-SCF", true]], "sad_d_convergence (scf)": [[1704, "term-SAD_D_CONVERGENCE-SCF", true]], "sad_e_convergence (scf)": [[1704, "term-SAD_E_CONVERGENCE-SCF", true]], "sad_frac_occ (scf)": [[1704, "term-SAD_FRAC_OCC-SCF", true]], "sad_maxiter (scf)": [[1704, "term-SAD_MAXITER-SCF", true]], "sad_print (scf)": [[1704, "term-SAD_PRINT-SCF", true]], "sad_scf_type (scf)": [[1704, "term-SAD_SCF_TYPE-SCF", true]], "sad_spin_average (scf)": [[1704, "term-SAD_SPIN_AVERAGE-SCF", true]], "sadguess (class in psi4.core)": [[131, "psi4.core.SADGuess", false]], "salc_name() (psi4.core.cdsalclist method)": [[16, "psi4.core.CdSalcList.salc_name", false]], "salccomponent (class in psi4.core)": [[134, "psi4.core.SalcComponent", false]], "same_a_b_dens() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.same_a_b_dens", false]], "same_a_b_orbs() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.same_a_b_orbs", false]], "sanitize_method() (in module psi4.driver)": [[391, "psi4.driver.sanitize_method", false]], "sanitize_method() (in module psi4.driver.p4util)": [[373, "psi4.driver.p4util.sanitize_method", false]], "sanitize_name() (in module psi4.driver)": [[392, "psi4.driver.sanitize_name", false]], "sapgau_basis (scf)": [[1704, "term-SAPGAU_BASIS-SCF", true]], "sapt": [[1837, "index-0", false], [1837, "index-1", false], [1837, "index-2", false], [1837, "index-3", false], [1837, "index-4", false], [1837, "index-5", false]], "sapt (scf)": [[1704, "term-SAPT-SCF", true]], "sapt alpha": [[1776, "psivar-SAPT-ALPHA", false]], "sapt ct energy": [[1776, "psivar-SAPT-CT-ENERGY", false]], "sapt disp energy": [[1776, "psivar-SAPT-DISP-ENERGY", false]], "sapt disp2(ccd) energy": [[1776, "psivar-SAPT-DISP2-CCD-ENERGY", false]], "sapt disp20 energy": [[1776, "psivar-SAPT-DISP20-ENERGY", false]], "sapt disp21 energy": [[1776, "psivar-SAPT-DISP21-ENERGY", false]], "sapt disp22(s)(ccd) energy": [[1776, "psivar-SAPT-DISP22-S-CCD-ENERGY", false]], "sapt disp22(sdq) energy": [[1776, "psivar-SAPT-DISP22-SDQ-ENERGY", false]], "sapt disp22(t) energy": [[1776, "psivar-SAPT-DISP22-T-ENERGY", false]], "sapt disp22(t)(ccd) energy": [[1776, "psivar-SAPT-DISP22-T-CCD-ENERGY", false]], "sapt disp30 energy": [[1776, "psivar-SAPT-DISP30-ENERGY", false]], "sapt elst energy": [[1776, "psivar-SAPT-ELST-ENERGY", false]], "sapt elst extern-extern energy": [[1776, "psivar-SAPT-ELST-EXTERN-EXTERN-ENERGY", false]], "sapt elst10,r energy": [[1776, "psivar-SAPT-ELST10-R-ENERGY", false]], "sapt elst12,r energy": [[1776, "psivar-SAPT-ELST12-R-ENERGY", false]], "sapt elst13,r energy": [[1776, "psivar-SAPT-ELST13-R-ENERGY", false]], "sapt energy": [[1776, "psivar-SAPT-ENERGY", false]], "sapt est.disp22(t) energy": [[1776, "psivar-SAPT-EST.DISP22-T-ENERGY", false]], "sapt est.disp22(t)(ccd) energy": [[1776, "psivar-SAPT-EST.DISP22-T-CCD-ENERGY", false]], "sapt exch energy": [[1776, "psivar-SAPT-EXCH-ENERGY", false]], "sapt exch-disp20 energy": [[1776, "psivar-SAPT-EXCH-DISP20-ENERGY", false]], "sapt exch-disp20(s^inf) energy": [[1776, "psivar-SAPT-EXCH-DISP20-S-INF-ENERGY", false]], "sapt exch-disp30 energy": [[1776, "psivar-SAPT-EXCH-DISP30-ENERGY", false]], "sapt exch-ind-disp30 energy": [[1776, "psivar-SAPT-EXCH-IND-DISP30-ENERGY", false]], "sapt exch-ind20,r energy": [[1776, "psivar-SAPT-EXCH-IND20-R-ENERGY", false]], "sapt exch-ind20,u energy": [[1776, "psivar-SAPT-EXCH-IND20-U-ENERGY", false]], "sapt exch-ind22 energy": [[1776, "psivar-SAPT-EXCH-IND22-ENERGY", false]], "sapt exch-ind30(s^inf) energy": [[1776, "psivar-SAPT-EXCH-IND30-S-INF-ENERGY", false]], "sapt exch-ind30,r energy": [[1776, "psivar-SAPT-EXCH-IND30-R-ENERGY", false]], "sapt exch-ind30,r(s^inf) energy": [[1776, "psivar-SAPT-EXCH-IND30-R-S-INF-ENERGY", false]], "sapt exch10 energy": [[1776, "psivar-SAPT-EXCH10-ENERGY", false]], "sapt exch10(s^2) energy": [[1776, "psivar-SAPT-EXCH10-S-2-ENERGY", false]], "sapt exch11(s^2) energy": [[1776, "psivar-SAPT-EXCH11-S-2-ENERGY", false]], "sapt exch12(s^2) energy": [[1776, "psivar-SAPT-EXCH12-S-2-ENERGY", false]], "sapt hf total energy": [[1776, "psivar-SAPT-HF-TOTAL-ENERGY", false]], "sapt hf(2) energy a(0)": [[1776, "psivar-SAPT-HF-2-ENERGY-A-0", false]], "sapt hf(2) energy a(hf)": [[1776, "psivar-SAPT-HF-2-ENERGY-A-HF", false]], "sapt hf(2) energy ab(hf)": [[1776, "psivar-SAPT-HF-2-ENERGY-AB-HF", false]], "sapt hf(2) energy abc(hf)": [[1776, "psivar-SAPT-HF-2-ENERGY-ABC-HF", false]], "sapt hf(2) energy ac(0)": [[1776, "psivar-SAPT-HF-2-ENERGY-AC-0", false]], "sapt hf(2) energy ac(hf)": [[1776, "psivar-SAPT-HF-2-ENERGY-AC-HF", false]], "sapt hf(2) energy b(0)": [[1776, "psivar-SAPT-HF-2-ENERGY-B-0", false]], "sapt hf(2) energy b(hf)": [[1776, "psivar-SAPT-HF-2-ENERGY-B-HF", false]], "sapt hf(2) energy bc(0)": [[1776, "psivar-SAPT-HF-2-ENERGY-BC-0", false]], "sapt hf(2) energy bc(hf)": [[1776, "psivar-SAPT-HF-2-ENERGY-BC-HF", false]], "sapt hf(2) energy c": [[1776, "psivar-SAPT-HF-2-ENERGY-C", false]], "sapt hf(2) energy hf": [[1776, "psivar-SAPT-HF-2-ENERGY-HF", false]], "sapt ind energy": [[1776, "psivar-SAPT-IND-ENERGY", false]], "sapt ind-disp30 energy": [[1776, "psivar-SAPT-IND-DISP30-ENERGY", false]], "sapt ind20,r energy": [[1776, "psivar-SAPT-IND20-R-ENERGY", false]], "sapt ind20,u energy": [[1776, "psivar-SAPT-IND20-U-ENERGY", false]], "sapt ind22 energy": [[1776, "psivar-SAPT-IND22-ENERGY", false]], "sapt ind30,r energy": [[1776, "psivar-SAPT-IND30-R-ENERGY", false]], "sapt mp2 correlation energy": [[1776, "psivar-SAPT-MP2-CORRELATION-ENERGY", false]], "sapt same-spin disp20 energy": [[1776, "psivar-SAPT-SAME-SPIN-DISP20-ENERGY", false]], "sapt same-spin exch-disp20 energy": [[1776, "psivar-SAPT-SAME-SPIN-EXCH-DISP20-ENERGY", false]], "sapt total energy": [[1776, "psivar-SAPT-TOTAL-ENERGY", false]], "sapt() (in module psi4.core)": [[237, "psi4.core.sapt", false]], "sapt(dft)": [[1837, "index-2", false]], "sapt0": [[1837, "index-1", false]], "sapt0 disp energy": [[1776, "psivar-SAPT0-DISP-ENERGY", false]], "sapt0 elst energy": [[1776, "psivar-SAPT0-ELST-ENERGY", false]], "sapt0 exch energy": [[1776, "psivar-SAPT0-EXCH-ENERGY", false]], "sapt0 ind energy": [[1776, "psivar-SAPT0-IND-ENERGY", false]], "sapt0 total energy": [[1776, "psivar-SAPT0-TOTAL-ENERGY", false]], "sapt0_e10 (sapt)": [[1704, "term-SAPT0_E10-SAPT", true]], "sapt0_e20disp (sapt)": [[1704, "term-SAPT0_E20DISP-SAPT", true]], "sapt0_e20ind (sapt)": [[1704, "term-SAPT0_E20IND-SAPT", true]], "sapt2 disp energy": [[1776, "psivar-SAPT2-DISP-ENERGY", false]], "sapt2 elst energy": [[1776, "psivar-SAPT2-ELST-ENERGY", false]], "sapt2 exch energy": [[1776, "psivar-SAPT2-EXCH-ENERGY", false]], "sapt2 ind energy": [[1776, "psivar-SAPT2-IND-ENERGY", false]], "sapt2 total energy": [[1776, "psivar-SAPT2-TOTAL-ENERGY", false]], "sapt2+ disp energy": [[1776, "psivar-1", false]], "sapt2+ elst energy": [[1776, "psivar-2", false]], "sapt2+ exch energy": [[1776, "psivar-3", false]], "sapt2+ ind energy": [[1776, "psivar-4", false]], "sapt2+ total energy": [[1776, "psivar-9", false]], "sapt2+(3) disp energy": [[1776, "psivar-SAPT2-3-DISP-ENERGY", false]], "sapt2+(3) elst energy": [[1776, "psivar-SAPT2-3-ELST-ENERGY", false]], "sapt2+(3) exch energy": [[1776, "psivar-SAPT2-3-EXCH-ENERGY", false]], "sapt2+(3) ind energy": [[1776, "psivar-SAPT2-3-IND-ENERGY", false]], "sapt2+(3) total energy": [[1776, "psivar-SAPT2-3-TOTAL-ENERGY", false]], "sapt2+(3)(ccd) disp energy": [[1776, "psivar-SAPT2-3-CCD-DISP-ENERGY", false]], "sapt2+(3)(ccd) elst energy": [[1776, "psivar-SAPT2-3-CCD-ELST-ENERGY", false]], "sapt2+(3)(ccd) exch energy": [[1776, "psivar-SAPT2-3-CCD-EXCH-ENERGY", false]], "sapt2+(3)(ccd) ind energy": [[1776, "psivar-SAPT2-3-CCD-IND-ENERGY", false]], "sapt2+(3)(ccd) total energy": [[1776, "psivar-SAPT2-3-CCD-TOTAL-ENERGY", false]], "sapt2+(3)(ccd)dmp2 disp energy": [[1776, "psivar-SAPT2-3-CCD-DMP2-DISP-ENERGY", false]], "sapt2+(3)(ccd)dmp2 elst energy": [[1776, "psivar-SAPT2-3-CCD-DMP2-ELST-ENERGY", false]], "sapt2+(3)(ccd)dmp2 exch energy": [[1776, "psivar-SAPT2-3-CCD-DMP2-EXCH-ENERGY", false]], "sapt2+(3)(ccd)dmp2 ind energy": [[1776, "psivar-SAPT2-3-CCD-DMP2-IND-ENERGY", false]], "sapt2+(3)(ccd)dmp2 total energy": [[1776, "psivar-SAPT2-3-CCD-DMP2-TOTAL-ENERGY", false]], "sapt2+(3)dmp2 disp energy": [[1776, "psivar-SAPT2-3-DMP2-DISP-ENERGY", false]], "sapt2+(3)dmp2 elst energy": [[1776, "psivar-SAPT2-3-DMP2-ELST-ENERGY", false]], "sapt2+(3)dmp2 exch energy": [[1776, "psivar-SAPT2-3-DMP2-EXCH-ENERGY", false]], "sapt2+(3)dmp2 ind energy": [[1776, "psivar-SAPT2-3-DMP2-IND-ENERGY", false]], "sapt2+(3)dmp2 total energy": [[1776, "psivar-SAPT2-3-DMP2-TOTAL-ENERGY", false]], "sapt2+(ccd) disp energy": [[1776, "psivar-SAPT2-CCD-DISP-ENERGY", false]], "sapt2+(ccd) elst energy": [[1776, "psivar-SAPT2-CCD-ELST-ENERGY", false]], "sapt2+(ccd) exch energy": [[1776, "psivar-SAPT2-CCD-EXCH-ENERGY", false]], "sapt2+(ccd) ind energy": [[1776, "psivar-SAPT2-CCD-IND-ENERGY", false]], "sapt2+(ccd) total energy": [[1776, "psivar-SAPT2-CCD-TOTAL-ENERGY", false]], "sapt2+(ccd)dmp2 disp energy": [[1776, "psivar-SAPT2-CCD-DMP2-DISP-ENERGY", false]], "sapt2+(ccd)dmp2 elst energy": [[1776, "psivar-SAPT2-CCD-DMP2-ELST-ENERGY", false]], "sapt2+(ccd)dmp2 exch energy": [[1776, "psivar-SAPT2-CCD-DMP2-EXCH-ENERGY", false]], "sapt2+(ccd)dmp2 ind energy": [[1776, "psivar-SAPT2-CCD-DMP2-IND-ENERGY", false]], "sapt2+(ccd)dmp2 total energy": [[1776, "psivar-SAPT2-CCD-DMP2-TOTAL-ENERGY", false]], "sapt2+3 disp energy": [[1776, "psivar-5", false]], "sapt2+3 elst energy": [[1776, "psivar-6", false]], "sapt2+3 exch energy": [[1776, "psivar-7", false]], "sapt2+3 ind energy": [[1776, "psivar-8", false]], "sapt2+3 total energy": [[1776, "psivar-10", false]], "sapt2+3(ccd) disp energy": [[1776, "psivar-11", false]], "sapt2+3(ccd) elst energy": [[1776, "psivar-12", false]], "sapt2+3(ccd) exch energy": [[1776, "psivar-13", false]], "sapt2+3(ccd) ind energy": [[1776, "psivar-14", false]], "sapt2+3(ccd) total energy": [[1776, "psivar-15", false]], "sapt2+3(ccd)dmp2 disp energy": [[1776, "psivar-16", false]], "sapt2+3(ccd)dmp2 elst energy": [[1776, "psivar-17", false]], "sapt2+3(ccd)dmp2 exch energy": [[1776, "psivar-18", false]], "sapt2+3(ccd)dmp2 ind energy": [[1776, "psivar-19", false]], "sapt2+3(ccd)dmp2 total energy": [[1776, "psivar-20", false]], "sapt2+3dmp2 disp energy": [[1776, "psivar-SAPT2-3DMP2-DISP-ENERGY", false]], "sapt2+3dmp2 elst energy": [[1776, "psivar-SAPT2-3DMP2-ELST-ENERGY", false]], "sapt2+3dmp2 exch energy": [[1776, "psivar-SAPT2-3DMP2-EXCH-ENERGY", false]], "sapt2+3dmp2 ind energy": [[1776, "psivar-SAPT2-3DMP2-IND-ENERGY", false]], "sapt2+3dmp2 total energy": [[1776, "psivar-SAPT2-3DMP2-TOTAL-ENERGY", false]], "sapt2+dmp2 disp energy": [[1776, "psivar-SAPT2-DMP2-DISP-ENERGY", false]], "sapt2+dmp2 elst energy": [[1776, "psivar-SAPT2-DMP2-ELST-ENERGY", false]], "sapt2+dmp2 exch energy": [[1776, "psivar-SAPT2-DMP2-EXCH-ENERGY", false]], "sapt2+dmp2 ind energy": [[1776, "psivar-SAPT2-DMP2-IND-ENERGY", false]], "sapt2+dmp2 total energy": [[1776, "psivar-SAPT2-DMP2-TOTAL-ENERGY", false]], "sapt_dft_do_dhf (sapt)": [[1704, "term-SAPT_DFT_DO_DHF-SAPT", true]], "sapt_dft_do_hybrid (sapt)": [[1704, "term-SAPT_DFT_DO_HYBRID-SAPT", true]], "sapt_dft_exch_disp_fixed_scale (sapt)": [[1704, "term-SAPT_DFT_EXCH_DISP_FIXED_SCALE-SAPT", true]], "sapt_dft_exch_disp_scale_scheme (sapt)": [[1704, "term-SAPT_DFT_EXCH_DISP_SCALE_SCHEME-SAPT", true]], "sapt_dft_functional (sapt)": [[1704, "term-SAPT_DFT_FUNCTIONAL-SAPT", true]], "sapt_dft_grac_determination (sapt)": [[1704, "term-SAPT_DFT_GRAC_DETERMINATION-SAPT", true]], "sapt_dft_grac_shift_a (sapt)": [[1704, "term-SAPT_DFT_GRAC_SHIFT_A-SAPT", true]], "sapt_dft_grac_shift_b (sapt)": [[1704, "term-SAPT_DFT_GRAC_SHIFT_B-SAPT", true]], "sapt_dft_mp2_disp_alg (sapt)": [[1704, "term-SAPT_DFT_MP2_DISP_ALG-SAPT", true]], "sapt_fdds_disp_leg_lambda (sapt)": [[1704, "term-SAPT_FDDS_DISP_LEG_LAMBDA-SAPT", true]], "sapt_fdds_disp_num_points (sapt)": [[1704, "term-SAPT_FDDS_DISP_NUM_POINTS-SAPT", true]], "sapt_fdds_v2_rho_cutoff (sapt)": [[1704, "term-SAPT_FDDS_V2_RHO_CUTOFF-SAPT", true]], "sapt_level (sapt)": [[1704, "term-SAPT_LEVEL-SAPT", true]], "sapt_mem_check (sapt)": [[1704, "term-SAPT_MEM_CHECK-SAPT", true]], "sapt_mem_factor (sapt)": [[1704, "term-SAPT_MEM_FACTOR-SAPT", true]], "sapt_mem_safety (sapt)": [[1704, "term-SAPT_MEM_SAFETY-SAPT", true]], "sapt_quiet (sapt)": [[1704, "term-SAPT_QUIET-SAPT", true]], "save() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.save", false]], "save() (psi4.core.vector method)": [[148, "psi4.core.Vector.save", false]], "save_density() (psi4.driver.p4util.inpsight method)": [[323, "psi4.driver.p4util.InPsight.save_density", false]], "save_density_and_energy() (psi4.core.hf method)": [[84, "psi4.core.HF.save_density_and_energy", false]], "save_jk (scf)": [[1704, "term-SAVE_JK-SCF", true]], "save_molecule() (psi4.driver.p4util.inpsight method)": [[323, "psi4.driver.p4util.InPsight.save_molecule", false]], "save_optimization (optking)": [[1704, "term-SAVE_OPTIMIZATION-OPTKING", true]], "save_string_xyz() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.save_string_xyz", false]], "save_string_xyz_file() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.save_string_xyz_file", false]], "save_uhf_nos (scf)": [[1704, "term-SAVE_UHF_NOS-SCF", true]], "save_xyz_file() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.save_xyz_file", false]], "savetype (class in psi4.core)": [[135, "psi4.core.SaveType", false]], "scalar_variable() (in module psi4.core)": [[238, "psi4.core.scalar_variable", false]], "scalar_variable() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.scalar_variable", false]], "scalar_variables() (in module psi4.core)": [[239, "psi4.core.scalar_variables", false]], "scalar_variables() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.scalar_variables", false]], "scalars() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.scalars", false]], "scale() (psi4.core.civector method)": [[12, "psi4.core.CIVector.scale", false]], "scale() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.scale", false]], "scale() (psi4.core.vector method)": [[148, "psi4.core.Vector.scale", false]], "scale_column() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.scale_column", false]], "scale_row() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.scale_row", false]], "scatter() (in module psi4.core)": [[240, "psi4.core.scatter", false]], "scf": [[1838, "index-0", false], [1838, "index-1", false]], "scf dipole": [[1776, "psivar-SCF-DIPOLE", false]], "scf dipole gradient": [[1776, "psivar-SCF-DIPOLE-GRADIENT", false]], "scf iterations": [[1776, "psivar-SCF-ITERATIONS", false]], "scf quadrupole": [[1776, "psivar-SCF-QUADRUPOLE", false]], "scf stability eigenvalues": [[1776, "psivar-SCF-STABILITY-EIGENVALUES", false]], "scf total energy": [[1776, "psivar-SCF-TOTAL-ENERGY", false]], "scf total gradient": [[1776, "psivar-SCF-TOTAL-GRADIENT", false]], "scf total hessian": [[1776, "psivar-SCF-TOTAL-HESSIAN", false]], "scf() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.scf", false]], "scf_dtot() (psi4.core.fchkwriter method)": [[74, "psi4.core.FCHKWriter.SCF_Dtot", false]], "scf_helper() (in module psi4.driver)": [[393, "psi4.driver.scf_helper", false]], "scf_initial_accelerator (scf)": [[1704, "term-SCF_INITIAL_ACCELERATOR-SCF", true]], "scf_initial_finish_diis_transition (scf)": [[1704, "term-SCF_INITIAL_FINISH_DIIS_TRANSITION-SCF", true]], "scf_initial_start_diis_transition (scf)": [[1704, "term-SCF_INITIAL_START_DIIS_TRANSITION-SCF", true]], "scf_mem_safety_factor (scf)": [[1704, "term-SCF_MEM_SAFETY_FACTOR-SCF", true]], "scf_properties (scf)": [[1704, "term-SCF_PROPERTIES-SCF", true]], "scf_subtype (scf)": [[1704, "term-SCF_SUBTYPE-SCF", true]], "scf_type (cphf)": [[1704, "term-SCF_TYPE-CPHF", true]], "scf_type (globals)": [[1704, "term-SCF_TYPE-GLOBALS", true]], "scf_type() (psi4.core.hf method)": [[84, "psi4.core.HF.scf_type", false]], "scf_wavefunction_factory() (in module psi4.driver)": [[394, "psi4.driver.scf_wavefunction_factory", false]], "scf_xtpl_helgaker_2() (in module psi4.driver.driver_cbs_helper)": [[1740, "psi4.driver.driver_cbs_helper.scf_xtpl_helgaker_2", false]], "scf_xtpl_helgaker_3() (in module psi4.driver.driver_cbs_helper)": [[1740, "psi4.driver.driver_cbs_helper.scf_xtpl_helgaker_3", false]], "scf_xtpl_karton_2() (in module psi4.driver.driver_cbs_helper)": [[1740, "psi4.driver.driver_cbs_helper.scf_xtpl_karton_2", false]], "scf_xtpl_truhlar_2() (in module psi4.driver.driver_cbs_helper)": [[1740, "psi4.driver.driver_cbs_helper.scf_xtpl_truhlar_2", false]], "scfconvergenceerror": [[276, "psi4.driver.SCFConvergenceError", false]], "scfgrad() (in module psi4.core)": [[241, "psi4.core.scfgrad", false]], "scfhess() (in module psi4.core)": [[242, "psi4.core.scfhess", false]], "schmidt() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.schmidt", false]], "schmidt_add_residual_tolerance (cceom)": [[1704, "term-SCHMIDT_ADD_RESIDUAL_TOLERANCE-CCEOM", true]], "schoenflies_symbol() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.schoenflies_symbol", false]], "scramble() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.scramble", false]], "scratch files": [[1767, "index-0", false]], "screening (globals)": [[1704, "term-SCREENING-GLOBALS", true]], "scs(n)-mp2 correlation energy": [[1776, "psivar-SCS-N-MP2-CORRELATION-ENERGY", false]], "scs(n)-mp2 total energy": [[1776, "psivar-SCS-N-MP2-TOTAL-ENERGY", false]], "scs(n)-omp2 correlation energy": [[1776, "psivar-SCS-N-OMP2-CORRELATION-ENERGY", false]], "scs(n)-omp2 total energy": [[1776, "psivar-SCS-N-OMP2-TOTAL-ENERGY", false]], "scs-ccsd correlation energy": [[1776, "psivar-SCS-CCSD-CORRELATION-ENERGY", false]], "scs-ccsd total energy": [[1776, "psivar-SCS-CCSD-TOTAL-ENERGY", false]], "scs-mp2 correlation energy": [[1776, "psivar-SCS-MP2-CORRELATION-ENERGY", false]], "scs-mp2 total energy": [[1776, "psivar-SCS-MP2-TOTAL-ENERGY", false]], "scs-mp2-vdw correlation energy": [[1776, "psivar-SCS-MP2-VDW-CORRELATION-ENERGY", false]], "scs-mp2-vdw total energy": [[1776, "psivar-SCS-MP2-VDW-TOTAL-ENERGY", false]], "scs-mp3 correlation energy": [[1776, "psivar-SCS-MP3-CORRELATION-ENERGY", false]], "scs-mp3 total energy": [[1776, "psivar-SCS-MP3-TOTAL-ENERGY", false]], "scs-omp2 correlation energy": [[1776, "psivar-SCS-OMP2-CORRELATION-ENERGY", false]], "scs-omp2 total energy": [[1776, "psivar-SCS-OMP2-TOTAL-ENERGY", false]], "scs-omp3 correlation energy": [[1776, "psivar-SCS-OMP3-CORRELATION-ENERGY", false]], "scs-omp3 total energy": [[1776, "psivar-SCS-OMP3-TOTAL-ENERGY", false]], "scs_ccsd (ccenergy)": [[1704, "term-SCS_CCSD-CCENERGY", true]], "scs_ccsd (fnocc)": [[1704, "term-SCS_CCSD-FNOCC", true]], "scs_cepa (fnocc)": [[1704, "term-SCS_CEPA-FNOCC", true]], "scs_mp2 (ccenergy)": [[1704, "term-SCS_MP2-CCENERGY", true]], "scs_mp2 (fnocc)": [[1704, "term-SCS_MP2-FNOCC", true]], "scs_type (dfocc)": [[1704, "term-SCS_TYPE-DFOCC", true]], "scs_type (occ)": [[1704, "term-SCS_TYPE-OCC", true]], "scsn-omp2 correlation energy": [[1776, "psivar-SCSN-OMP2-CORRELATION-ENERGY", false]], "scsn-omp2 total energy": [[1776, "psivar-SCSN-OMP2-TOTAL-ENERGY", false]], "scsn_mp2 (ccenergy)": [[1704, "term-SCSN_MP2-CCENERGY", true]], "sekino (cclambda)": [[1704, "term-SEKINO-CCLAMBDA", true]], "sekino (ccresponse)": [[1704, "term-SEKINO-CCRESPONSE", true]], "semicanonical (ccenergy)": [[1704, "term-SEMICANONICAL-CCENERGY", true]], "semicanonical (cceom)": [[1704, "term-SEMICANONICAL-CCEOM", true]], "semicanonical (cctransort)": [[1704, "term-SEMICANONICAL-CCTRANSORT", true]], "semicanonical (cctriples)": [[1704, "term-SEMICANONICAL-CCTRIPLES", true]], "semicanonical_orbs() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.semicanonical_orbs", false]], "semicanonicalize() (psi4.core.hf method)": [[84, "psi4.core.HF.semicanonicalize", false]], "set() (psi4.core.intvector method)": [[88, "psi4.core.IntVector.set", false]], "set() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.set", false]], "set() (psi4.core.vector method)": [[148, "psi4.core.Vector.set", false]], "set_aa_int_name() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.set_aa_int_name", false]], "set_ab_int_name() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.set_ab_int_name", false]], "set_active_fragment() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.set_active_fragment", false]], "set_active_fragments() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.set_active_fragments", false]], "set_active_molecule() (in module psi4.core)": [[243, "psi4.core.set_active_molecule", false]], "set_alpha() (psi4.core.functional method)": [[80, "psi4.core.Functional.set_alpha", false]], "set_ansatz() (psi4.core.pointfunctions method)": [[119, "psi4.core.PointFunctions.set_ansatz", false]], "set_ao_core() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.set_AO_core", false]], "set_array() (psi4.core.options method)": [[114, "psi4.core.Options.set_array", false]], "set_array() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.set_array", false]], "set_array_variable() (in module psi4.core)": [[244, "psi4.core.set_array_variable", false]], "set_array_variable() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.set_array_variable", false]], "set_atomic_fit_bases() (psi4.core.sadguess method)": [[131, "psi4.core.SADGuess.set_atomic_fit_bases", false]], "set_basis() (psi4.driver.atomiccomputer class method)": [[265, "psi4.driver.AtomicComputer.set_basis", false]], "set_basis_all_atoms() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.set_basis_all_atoms", false]], "set_basis_by_label() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.set_basis_by_label", false]], "set_basis_by_number() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.set_basis_by_number", false]], "set_basis_by_symbol() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.set_basis_by_symbol", false]], "set_basisset() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.set_basisset", false]], "set_basisset() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.set_basisset", false]], "set_bb_int_name() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.set_bb_int_name", false]], "set_bibtex() (psi4.core.dispersion method)": [[68, "psi4.core.Dispersion.set_bibtex", false]], "set_block() (psi4.core.intvector method)": [[88, "psi4.core.IntVector.set_block", false]], "set_block() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.set_block", false]], "set_block() (psi4.core.vector method)": [[148, "psi4.core.Vector.set_block", false]], "set_bool() (psi4.core.options method)": [[114, "psi4.core.Options.set_bool", false]], "set_bsse_type() (psi4.driver.driver_nbody.manybodycomputer class method)": [[1794, "psi4.driver.driver_nbody.ManyBodyComputer.set_bsse_type", false]], "set_c_alpha() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.set_c_alpha", false]], "set_c_omega() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.set_c_omega", false]], "set_c_os_alpha() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.set_c_os_alpha", false]], "set_c_ss_alpha() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.set_c_ss_alpha", false]], "set_camera() (psi4.driver.p4util.inpsight method)": [[323, "psi4.driver.p4util.InPsight.set_camera", false]], "set_ci_guess() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.set_ci_guess", false]], "set_citation() (psi4.core.dispersion method)": [[68, "psi4.core.Dispersion.set_citation", false]], "set_citation() (psi4.core.functional method)": [[80, "psi4.core.Functional.set_citation", false]], "set_citation() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.set_citation", false]], "set_color() (psi4.driver.p4util.inpsight method)": [[323, "psi4.driver.p4util.InPsight.set_color", false]], "set_comment() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.set_comment", false]], "set_connectivity() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.set_connectivity", false]], "set_cosx_grid() (psi4.core.compositejk method)": [[18, "psi4.core.CompositeJK.set_COSX_grid", false]], "set_current_module() (psi4.core.options method)": [[114, "psi4.core.Options.set_current_module", false]], "set_cutoff() (psi4.core.jk method)": [[92, "psi4.core.JK.set_cutoff", false]], "set_d() (psi4.core.vbase method)": [[147, "psi4.core.VBase.set_D", false]], "set_da_ao() (psi4.core.oeprop method)": [[111, "psi4.core.OEProp.set_Da_ao", false]], "set_da_mo() (psi4.core.oeprop method)": [[111, "psi4.core.OEProp.set_Da_mo", false]], "set_da_so() (psi4.core.oeprop method)": [[111, "psi4.core.OEProp.set_Da_so", false]], "set_datadir() (in module psi4.core)": [[245, "psi4.core.set_datadir", false]], "set_db_ao() (psi4.core.oeprop method)": [[111, "psi4.core.OEProp.set_Db_ao", false]], "set_db_mo() (psi4.core.oeprop method)": [[111, "psi4.core.OEProp.set_Db_mo", false]], "set_db_so() (psi4.core.oeprop method)": [[111, "psi4.core.OEProp.set_Db_so", false]], "set_debug() (psi4.core.sadguess method)": [[131, "psi4.core.SADGuess.set_debug", false]], "set_debug() (psi4.core.vbase method)": [[147, "psi4.core.VBase.set_debug", false]], "set_default_namespace() (psi4.core.io static method)": [[86, "psi4.core.IO.set_default_namespace", false]], "set_default_path() (psi4.core.iomanager method)": [[87, "psi4.core.IOManager.set_default_path", false]], "set_define() (psi4.driver.p4util.inpsight method)": [[323, "psi4.driver.p4util.InPsight.set_define", false]], "set_delta() (psi4.core.basisextents method)": [[6, "psi4.core.BasisExtents.set_delta", false]], "set_density_cutoff() (psi4.core.functional method)": [[80, "psi4.core.Functional.set_density_cutoff", false]], "set_density_cutoff() (psi4.core.libxcfunctional method)": [[96, "psi4.core.LibXCFunctional.set_density_cutoff", false]], "set_density_tolerance() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.set_density_tolerance", false]], "set_deriv() (psi4.core.basisfunctions method)": [[7, "psi4.core.BasisFunctions.set_deriv", false]], "set_deriv() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.set_deriv", false]], "set_deriv_density_backtransformed() (psi4.core.deriv method)": [[61, "psi4.core.Deriv.set_deriv_density_backtransformed", false]], "set_description() (psi4.core.dispersion method)": [[68, "psi4.core.Dispersion.set_description", false]], "set_description() (psi4.core.functional method)": [[80, "psi4.core.Functional.set_description", false]], "set_description() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.set_description", false]], "set_do_j() (psi4.core.jk method)": [[92, "psi4.core.JK.set_do_J", false]], "set_do_k() (psi4.core.jk method)": [[92, "psi4.core.JK.set_do_K", false]], "set_do_vv10() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.set_do_vv10", false]], "set_do_wk() (psi4.core.jk method)": [[92, "psi4.core.JK.set_do_wK", false]], "set_double() (psi4.core.options method)": [[114, "psi4.core.Options.set_double", false]], "set_dpd_id() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.set_dpd_id", false]], "set_dpd_int_file() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.set_dpd_int_file", false]], "set_driver() (psi4.driver.driver_findif.finitedifferencecomputer class method)": [[1772, "psi4.driver.driver_findif.FiniteDifferenceComputer.set_driver", false]], "set_embedding_charges() (psi4.driver.driver_nbody.manybodycomputer class method)": [[1794, "psi4.driver.driver_nbody.ManyBodyComputer.set_embedding_charges", false]], "set_energies() (psi4.core.hf method)": [[84, "psi4.core.HF.set_energies", false]], "set_energy() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.set_energy", false]], "set_external_cpscf_perturbation() (psi4.core.hf method)": [[84, "psi4.core.HF.set_external_cpscf_perturbation", false]], "set_external_potential() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.set_external_potential", false]], "set_full_geometry() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.set_full_geometry", false]], "set_geometry() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.set_geometry", false]], "set_gga() (psi4.core.functional method)": [[80, "psi4.core.Functional.set_gga", false]], "set_ghost_fragment() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.set_ghost_fragment", false]], "set_ghost_fragments() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.set_ghost_fragments", false]], "set_global_option() (in module psi4.core)": [[246, "psi4.core.set_global_option", false]], "set_global_option_python() (in module psi4.core)": [[247, "psi4.core.set_global_option_python", false]], "set_grac_alpha() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.set_grac_alpha", false]], "set_grac_beta() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.set_grac_beta", false]], "set_grac_shift() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.set_grac_shift", false]], "set_gradient() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.set_gradient", false]], "set_hessian() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.set_hessian", false]], "set_ignore_reference() (psi4.core.deriv method)": [[61, "psi4.core.Deriv.set_ignore_reference", false]], "set_input_units_to_au() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.set_input_units_to_au", false]], "set_int() (psi4.core.options method)": [[114, "psi4.core.Options.set_int", false]], "set_jk() (psi4.core.hf method)": [[84, "psi4.core.HF.set_jk", false]], "set_keep_dpd_so_ints() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.set_keep_dpd_so_ints", false]], "set_keep_ht_ints() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.set_keep_ht_ints", false]], "set_keep_iwl_so_ints() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.set_keep_iwl_so_ints", false]], "set_keywords() (psi4.driver.atomiccomputer class method)": [[265, "psi4.driver.AtomicComputer.set_keywords", false]], "set_lagrangian() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.set_lagrangian", false]], "set_local_option() (in module psi4.core)": [[248, "psi4.core.set_local_option", false]], "set_local_option_python() (in module psi4.core)": [[249, "psi4.core.set_local_option_python", false]], "set_lock() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.set_lock", false]], "set_lsda_cutoff() (psi4.core.functional method)": [[80, "psi4.core.Functional.set_lsda_cutoff", false]], "set_mass() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.set_mass", false]], "set_max_nbody() (psi4.driver.driver_nbody.manybodycomputer class method)": [[1794, "psi4.driver.driver_nbody.ManyBodyComputer.set_max_nbody", false]], "set_max_points() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.set_max_points", false]], "set_memory() (in module psi4.driver)": [[395, "psi4.driver.set_memory", false]], "set_memory() (in module psi4.driver.p4util)": [[374, "psi4.driver.p4util.set_memory", false]], "set_memory() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.set_memory", false]], "set_memory() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.set_memory", false]], "set_memory() (psi4.core.jk method)": [[92, "psi4.core.JK.set_memory", false]], "set_memory_bytes() (in module psi4.core)": [[250, "psi4.core.set_memory_bytes", false]], "set_meta() (psi4.core.functional method)": [[80, "psi4.core.Functional.set_meta", false]], "set_meta_cutoff() (psi4.core.functional method)": [[80, "psi4.core.Functional.set_meta_cutoff", false]], "set_method() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.set_method", false]], "set_method() (psi4.driver.atomiccomputer class method)": [[265, "psi4.driver.AtomicComputer.set_method", false]], "set_mo_core() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.set_MO_core", false]], "set_module() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.set_module", false]], "set_module_options() (in module psi4.driver)": [[396, "psi4.driver.set_module_options", false]], "set_module_options() (in module psi4.driver.p4util)": [[375, "psi4.driver.p4util.set_module_options", false]], "set_molecular_charge() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.set_molecular_charge", false]], "set_molecule() (psi4.driver.driver_cbs.compositecomputer class method)": [[1740, "psi4.driver.driver_cbs.CompositeComputer.set_molecule", false]], "set_molecule() (psi4.driver.driver_findif.finitedifferencecomputer class method)": [[1772, "psi4.driver.driver_findif.FiniteDifferenceComputer.set_molecule", false]], "set_molecule() (psi4.driver.driver_nbody.manybodycomputer class method)": [[1794, "psi4.driver.driver_nbody.ManyBodyComputer.set_molecule", false]], "set_multiplicity() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.set_multiplicity", false]], "set_name() (psi4.core.dispersion method)": [[68, "psi4.core.Dispersion.set_name", false]], "set_name() (psi4.core.functional method)": [[80, "psi4.core.Functional.set_name", false]], "set_name() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.set_name", false]], "set_name() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.set_name", false]], "set_name() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.set_name", false]], "set_names() (psi4.core.oeprop method)": [[111, "psi4.core.OEProp.set_names", false]], "set_nfragments() (psi4.driver.driver_nbody.manybodycomputer class method)": [[1794, "psi4.driver.driver_nbody.ManyBodyComputer.set_nfragments", false]], "set_nthreads() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.set_nthreads", false]], "set_nuclear_charge() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.set_nuclear_charge", false]], "set_num_threads() (in module psi4.core)": [[251, "psi4.core.set_num_threads", false]], "set_nvec() (psi4.core.civector method)": [[12, "psi4.core.CIVector.set_nvec", false]], "set_omega() (psi4.core.functional method)": [[80, "psi4.core.Functional.set_omega", false]], "set_omega() (psi4.core.jk method)": [[92, "psi4.core.JK.set_omega", false]], "set_omega() (psi4.core.libxcfunctional method)": [[96, "psi4.core.LibXCFunctional.set_omega", false]], "set_omega_alpha() (psi4.core.jk method)": [[92, "psi4.core.JK.set_omega_alpha", false]], "set_omega_beta() (psi4.core.jk method)": [[92, "psi4.core.JK.set_omega_beta", false]], "set_omp_nthread() (psi4.core.jk method)": [[92, "psi4.core.JK.set_omp_nthread", false]], "set_options() (in module psi4.driver)": [[397, "psi4.driver.set_options", false]], "set_options() (in module psi4.driver.p4util)": [[376, "psi4.driver.p4util.set_options", false]], "set_orbitals() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.set_orbitals", false]], "set_orbitals() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.set_orbitals", false]], "set_output_file() (in module psi4)": [[1768, "psi4.set_output_file", false]], "set_output_file() (in module psi4.core)": [[252, "psi4.core.set_output_file", false]], "set_parameter() (psi4.core.functional method)": [[80, "psi4.core.Functional.set_parameter", false]], "set_params() (psi4.core.correlationfactor method)": [[19, "psi4.core.CorrelationFactor.set_params", false]], "set_pid() (psi4.core.io method)": [[86, "psi4.core.IO.set_pid", false]], "set_point_group() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.set_point_group", false]], "set_pointers() (psi4.core.pointfunctions method)": [[119, "psi4.core.PointFunctions.set_pointers", false]], "set_postscf_density_label() (psi4.core.fchkwriter method)": [[74, "psi4.core.FCHKWriter.set_postscf_density_label", false]], "set_potential_variable() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.set_potential_variable", false]], "set_print() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.set_print", false]], "set_print() (psi4.core.jk method)": [[92, "psi4.core.JK.set_print", false]], "set_print() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.set_print", false]], "set_print() (psi4.core.sadguess method)": [[131, "psi4.core.SADGuess.set_print", false]], "set_print() (psi4.core.vbase method)": [[147, "psi4.core.VBase.set_print", false]], "set_print() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.set_print", false]], "set_provenance() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.set_provenance", false]], "set_psi_file_prefix() (in module psi4.core)": [[253, "psi4.core.set_psi_file_prefix", false]], "set_psio() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.set_psio", false]], "set_radius() (psi4.driver.p4util.inpsight method)": [[323, "psi4.driver.p4util.InPsight.set_radius", false]], "set_read_globals() (psi4.core.options method)": [[114, "psi4.core.Options.set_read_globals", false]], "set_reference_wavefunction() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.set_reference_wavefunction", false]], "set_return_total_data() (psi4.driver.driver_nbody.manybodycomputer class method)": [[1794, "psi4.driver.driver_nbody.ManyBodyComputer.set_return_total_data", false]], "set_sad_basissets() (psi4.core.hf method)": [[84, "psi4.core.HF.set_sad_basissets", false]], "set_sad_fitting_basissets() (psi4.core.hf method)": [[84, "psi4.core.HF.set_sad_fitting_basissets", false]], "set_scalar_variable() (in module psi4.core)": [[254, "psi4.core.set_scalar_variable", false]], "set_scalar_variable() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.set_scalar_variable", false]], "set_schwarz_cutoff() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.set_schwarz_cutoff", false]], "set_size() (psi4.driver.p4util.inpsight method)": [[323, "psi4.driver.p4util.InPsight.set_size", false]], "set_so_tei_file() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.set_so_tei_file", false]], "set_specific_path() (psi4.core.iomanager method)": [[87, "psi4.core.IOManager.set_specific_path", false]], "set_specific_retention() (psi4.core.iomanager method)": [[87, "psi4.core.IOManager.set_specific_retention", false]], "set_str() (psi4.core.options method)": [[114, "psi4.core.Options.set_str", false]], "set_str_i() (psi4.core.options method)": [[114, "psi4.core.Options.set_str_i", false]], "set_subalgo() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.set_subalgo", false]], "set_tei_already_presorted() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.set_tei_already_presorted", false]], "set_title() (psi4.core.oeprop method)": [[111, "psi4.core.OEProp.set_title", false]], "set_tpdm_already_presorted() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.set_tpdm_already_presorted", false]], "set_tpdm_presorted() (psi4.core.deriv method)": [[61, "psi4.core.Deriv.set_tpdm_presorted", false]], "set_tweak() (psi4.core.libxcfunctional method)": [[96, "psi4.core.LibXCFunctional.set_tweak", false]], "set_units() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.set_units", false]], "set_variable() (in module psi4.core)": [[255, "psi4.core.set_variable", false]], "set_variable() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.set_variable", false]], "set_variable() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.set_variable", false]], "set_view() (psi4.driver.p4util.inpsight method)": [[323, "psi4.driver.p4util.InPsight.set_view", false]], "set_vv10_b() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.set_vv10_b", false]], "set_vv10_c() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.set_vv10_c", false]], "set_wcombine() (psi4.core.jk method)": [[92, "psi4.core.JK.set_wcombine", false]], "set_write_dpd_so_tpdm() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.set_write_dpd_so_tpdm", false]], "set_x_alpha() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.set_x_alpha", false]], "set_x_beta() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.set_x_beta", false]], "set_x_omega() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.set_x_omega", false]], "set_xclib_description() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.set_xclib_description", false]], "setname() (psi4.core.externalpotential method)": [[73, "psi4.core.ExternalPotential.setName", false]], "setting": [[1740, "index-0", false], [1752, "index-0", false], [1761, "index-0", false], [1766, "index-0", false], [1772, "index-0", false], [1794, "index-1", false], [1800, "index-0", false], [1826, "index-0", false], [1832, "index-2", false], [1833, "index-2", false]], "setting keywords": [[1798, "index-2", false], [1798, "index-3", false], [1798, "index-4", false], [1798, "index-5", false], [1798, "index-6", false]], "sf_restrict (detci)": [[1704, "term-SF_RESTRICT-DETCI", true]], "shallow_copy() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.shallow_copy", false]], "shape (psi4.core.matrix attribute)": [[100, "psi4.core.Matrix.shape", false]], "shape (psi4.core.vector attribute)": [[148, "psi4.core.Vector.shape", false]], "shared_object() (psi4.core.io static method)": [[86, "psi4.core.IO.shared_object", false]], "shared_object() (psi4.core.iomanager static method)": [[87, "psi4.core.IOManager.shared_object", false]], "shell() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.shell", false]], "shell_extents() (psi4.core.basisextents method)": [[6, "psi4.core.BasisExtents.shell_extents", false]], "shell_on_center() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.shell_on_center", false]], "shell_significant() (psi4.core.twobodyaoint method)": [[143, "psi4.core.TwoBodyAOInt.shell_significant", false]], "shell_significant() (psi4.core.twoelectronint method)": [[144, "psi4.core.TwoElectronInt.shell_significant", false]], "shell_to_ao_function() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.shell_to_ao_function", false]], "shell_to_basis_function() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.shell_to_basis_function", false]], "shell_to_center() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.shell_to_center", false]], "shellinfo (class in psi4.core)": [[136, "psi4.core.ShellInfo", false]], "shells_iterator() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.shells_iterator", false]], "shells_local_to_global() (psi4.core.blockopoints method)": [[9, "psi4.core.BlockOPoints.shells_local_to_global", false]], "sherrill_gold_standard() (in module psi4.driver.aliases)": [[1740, "psi4.driver.aliases.sherrill_gold_standard", false]], "shift() (psi4.core.civector method)": [[12, "psi4.core.CIVector.shift", false]], "sigma() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.sigma", false]], "sigma_overlap (detci)": [[1704, "term-SIGMA_OVERLAP-DETCI", true]], "sigma_xy() (psi4.core.symmetryoperation method)": [[139, "psi4.core.SymmetryOperation.sigma_xy", false]], "sigma_xz() (psi4.core.symmetryoperation method)": [[139, "psi4.core.SymmetryOperation.sigma_xz", false]], "sigma_yz() (psi4.core.symmetryoperation method)": [[139, "psi4.core.SymmetryOperation.sigma_yz", false]], "simint": [[1839, "index-0", false]], "sinf_disp() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.sinf_disp", false]], "single-point": [[1766, "index-0", false]], "singles_print (cceom)": [[1704, "term-SINGLES_PRINT-CCEOM", true]], "sky (psi4.driver.p4util.inpsight attribute)": [[323, "psi4.driver.p4util.InPsight.sky", false]], "slice (class in psi4.core)": [[137, "psi4.core.Slice", false]], "small_cutoff (psimrcc)": [[1704, "term-SMALL_CUTOFF-PSIMRCC", true]], "snlink_basis_tolerance (scf)": [[1704, "term-SNLINK_BASIS_TOLERANCE-SCF", true]], "snlink_density_tolerance (scf)": [[1704, "term-SNLINK_DENSITY_TOLERANCE-SCF", true]], "snlink_force_cartesian (scf)": [[1704, "term-SNLINK_FORCE_CARTESIAN-SCF", true]], "snlink_gpu_mem (scf)": [[1704, "term-SNLINK_GPU_MEM-SCF", true]], "snlink_grid_batch_size (scf)": [[1704, "term-SNLINK_GRID_BATCH_SIZE-SCF", true]], "snlink_integrator_kernel (scf)": [[1704, "term-SNLINK_INTEGRATOR_KERNEL-SCF", true]], "snlink_ints_tolerance (scf)": [[1704, "term-SNLINK_INTS_TOLERANCE-SCF", true]], "snlink_load_balancer_kernel (scf)": [[1704, "term-SNLINK_LOAD_BALANCER_KERNEL-SCF", true]], "snlink_lwd_kernel (scf)": [[1704, "term-SNLINK_LWD_KERNEL-SCF", true]], "snlink_mol_weights_kernel (scf)": [[1704, "term-SNLINK_MOL_WEIGHTS_KERNEL-SCF", true]], "snlink_pruning_scheme (scf)": [[1704, "term-SNLINK_PRUNING_SCHEME-SCF", true]], "snlink_radial_points (scf)": [[1704, "term-SNLINK_RADIAL_POINTS-SCF", true]], "snlink_radial_scheme (scf)": [[1704, "term-SNLINK_RADIAL_SCHEME-SCF", true]], "snlink_reduction_kernel (scf)": [[1704, "term-SNLINK_REDUCTION_KERNEL-SCF", true]], "snlink_spherical_points (scf)": [[1704, "term-SNLINK_SPHERICAL_POINTS-SCF", true]], "snlink_use_debug_grid (scf)": [[1704, "term-SNLINK_USE_DEBUG_GRID-SCF", true]], "snlink_use_gpu (scf)": [[1704, "term-SNLINK_USE_GPU-SCF", true]], "sns-mp2": [[1806, "index-0", false]], "so_angular_momentum() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.so_angular_momentum", false]], "so_angular_momentum() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.so_angular_momentum", false]], "so_dipole() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.so_dipole", false]], "so_dipole() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.so_dipole", false]], "so_dkh() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.so_dkh", false]], "so_kinetic() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.so_kinetic", false]], "so_kinetic() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.so_kinetic", false]], "so_multipoles() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.so_multipoles", false]], "so_nabla() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.so_nabla", false]], "so_nabla() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.so_nabla", false]], "so_overlap() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.so_overlap", false]], "so_overlap() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.so_overlap", false]], "so_potential() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.so_potential", false]], "so_potential() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.so_potential", false]], "so_quadrupole() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.so_quadrupole", false]], "so_quadrupole() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.so_quadrupole", false]], "so_traceless_quadrupole() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.so_traceless_quadrupole", false]], "so_traceless_quadrupole() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.so_traceless_quadrupole", false]], "sobasisset (class in psi4.core)": [[132, "psi4.core.SOBasisSet", false]], "sobasisset() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.sobasisset", false]], "sobasisset() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.sobasisset", false]], "socc (globals)": [[1704, "term-SOCC-GLOBALS", true]], "socc (mcscf)": [[1704, "term-SOCC-MCSCF", true]], "soccpi() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.soccpi", false]], "sofeff() (psi4.core.rohf method)": [[130, "psi4.core.ROHF.soFeff", false]], "solve() (psi4.core.somcscf method)": [[133, "psi4.core.SOMCSCF.solve", false]], "solver_convergence (cphf)": [[1704, "term-SOLVER_CONVERGENCE-CPHF", true]], "solver_convergence (scf)": [[1704, "term-SOLVER_CONVERGENCE-SCF", true]], "solver_maxiter (cphf)": [[1704, "term-SOLVER_MAXITER-CPHF", true]], "solver_maxiter (scf)": [[1704, "term-SOLVER_MAXITER-SCF", true]], "solver_n_guess (cphf)": [[1704, "term-SOLVER_N_GUESS-CPHF", true]], "solver_n_guess (scf)": [[1704, "term-SOLVER_N_GUESS-SCF", true]], "solver_n_root (scf)": [[1704, "term-SOLVER_N_ROOT-SCF", true]], "solver_precondition (cphf)": [[1704, "term-SOLVER_PRECONDITION-CPHF", true]], "solver_roots_per_irrep (scf)": [[1704, "term-SOLVER_ROOTS_PER_IRREP-SCF", true]], "solverengine (class in psi4.driver.p4util)": [[329, "psi4.driver.p4util.SolverEngine", false]], "somcscf (class in psi4.core)": [[133, "psi4.core.SOMCSCF", false]], "sos-mp2 correlation energy": [[1776, "psivar-SOS-MP2-CORRELATION-ENERGY", false]], "sos-mp2 total energy": [[1776, "psivar-SOS-MP2-TOTAL-ENERGY", false]], "sos-omp2 correlation energy": [[1776, "psivar-SOS-OMP2-CORRELATION-ENERGY", false]], "sos-omp2 total energy": [[1776, "psivar-SOS-OMP2-TOTAL-ENERGY", false]], "sos-omp3 correlation energy": [[1776, "psivar-SOS-OMP3-CORRELATION-ENERGY", false]], "sos-omp3 total energy": [[1776, "psivar-SOS-OMP3-TOTAL-ENERGY", false]], "sos-pi-mp2 correlation energy": [[1776, "psivar-SOS-PI-MP2-CORRELATION-ENERGY", false]], "sos-pi-mp2 total energy": [[1776, "psivar-SOS-PI-MP2-TOTAL-ENERGY", false]], "sos_type (dfocc)": [[1704, "term-SOS_TYPE-DFOCC", true]], "sos_type (occ)": [[1704, "term-SOS_TYPE-OCC", true]], "soscf": [[1838, "index-3", false]], "soscf (scf)": [[1704, "term-SOSCF-SCF", true]], "soscf_conv (scf)": [[1704, "term-SOSCF_CONV-SCF", true]], "soscf_max_iter (scf)": [[1704, "term-SOSCF_MAX_ITER-SCF", true]], "soscf_min_iter (scf)": [[1704, "term-SOSCF_MIN_ITER-SCF", true]], "soscf_print (scf)": [[1704, "term-SOSCF_PRINT-SCF", true]], "soscf_start_convergence (scf)": [[1704, "term-SOSCF_START_CONVERGENCE-SCF", true]], "soscf_update() (psi4.core.hf method)": [[84, "psi4.core.HF.soscf_update", false]], "sotoao() (psi4.core.petitelist method)": [[118, "psi4.core.PetiteList.sotoao", false]], "specification": [[1833, "index-0", false]], "spectrum() (in module psi4.driver.p4util)": [[377, "psi4.driver.p4util.spectrum", false]], "spin multiplicities of higher roots": [[1755, "index-3", false]], "spin_scale_type (occ)": [[1704, "term-SPIN_SCALE_TYPE-OCC", true]], "sr6() (psi4.core.dispersion method)": [[68, "psi4.core.Dispersion.sr6", false]], "ss_e_convergence (cceom)": [[1704, "term-SS_E_CONVERGENCE-CCEOM", true]], "ss_r_convergence (cceom)": [[1704, "term-SS_R_CONVERGENCE-CCEOM", true]], "ss_scale (occ)": [[1704, "term-SS_SCALE-OCC", true]], "ss_skip_diag (cceom)": [[1704, "term-SS_SKIP_DIAG-CCEOM", true]], "ss_vecs_per_root (cceom)": [[1704, "term-SS_VECS_PER_ROOT-CCEOM", true]], "ssapt0 disp energy": [[1776, "psivar-SSAPT0-DISP-ENERGY", false]], "ssapt0 elst energy": [[1776, "psivar-SSAPT0-ELST-ENERGY", false]], "ssapt0 exch energy": [[1776, "psivar-SSAPT0-EXCH-ENERGY", false]], "ssapt0 ind energy": [[1776, "psivar-SSAPT0-IND-ENERGY", false]], "ssapt0 total energy": [[1776, "psivar-SSAPT0-TOTAL-ENERGY", false]], "ssapt0_scale (fisapt)": [[1704, "term-SSAPT0_SCALE-FISAPT", true]], "stability_add_vectors (dct)": [[1704, "term-STABILITY_ADD_VECTORS-DCT", true]], "stability_analysis (scf)": [[1704, "term-STABILITY_ANALYSIS-SCF", true]], "stability_analysis() (psi4.core.hf method)": [[84, "psi4.core.HF.stability_analysis", false]], "stability_analysis() (psi4.core.uhf method)": [[145, "psi4.core.UHF.stability_analysis", false]], "stability_augment_space_tol (dct)": [[1704, "term-STABILITY_AUGMENT_SPACE_TOL-DCT", true]], "stability_check (dct)": [[1704, "term-STABILITY_CHECK-DCT", true]], "stability_convergence (dct)": [[1704, "term-STABILITY_CONVERGENCE-DCT", true]], "stability_max_space_size (dct)": [[1704, "term-STABILITY_MAX_SPACE_SIZE-DCT", true]], "stability_n_eigenvalues (dct)": [[1704, "term-STABILITY_N_EIGENVALUES-DCT", true]], "stability_n_guess_vectors (dct)": [[1704, "term-STABILITY_N_GUESS_VECTORS-DCT", true]], "state() (psi4.core.io method)": [[86, "psi4.core.IO.state", false]], "state_to_atomicinput() (in module psi4.driver.p4util)": [[378, "psi4.driver.p4util.state_to_atomicinput", false]], "stats (psi4.driver.managedmethoderror attribute)": [[268, "psi4.driver.ManagedMethodError.stats", false]], "stats (psi4.driver.tdscfconvergenceerror attribute)": [[277, "psi4.driver.TDSCFConvergenceError.stats", false]], "step_type (optking)": [[1704, "term-STEP_TYPE-OPTKING", true]], "subblocks (psi4.core.savetype attribute)": [[135, "psi4.core.SaveType.SubBlocks", false]], "subdegen() (psi4.core.correlationtable method)": [[20, "psi4.core.CorrelationTable.subdegen", false]], "subgroup() (psi4.core.correlationtable method)": [[20, "psi4.core.CorrelationTable.subgroup", false]], "subn() (psi4.core.correlationtable method)": [[20, "psi4.core.CorrelationTable.subn", false]], "subtaskcomputers (in module psi4.driver.driver_nbody)": [[1768, "psi4.driver.driver_nbody.SubTaskComputers", false]], "subtract() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.subtract", false]], "success (psi4.core.psireturntype attribute)": [[126, "psi4.core.PsiReturnType.Success", false]], "sum() (psi4.core.dimension method)": [[64, "psi4.core.Dimension.sum", false]], "sum_of_squares() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.sum_of_squares", false]], "summation_fields (pe)": [[1704, "term-SUMMATION_FIELDS-PE", true]], "superfunctional (class in psi4.core)": [[138, "psi4.core.SuperFunctional", false]], "symbol() (psi4.core.irreduciblerepresentation method)": [[91, "psi4.core.IrreducibleRepresentation.symbol", false]], "symbol() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.symbol", false]], "symbol() (psi4.core.pointgroup method)": [[120, "psi4.core.PointGroup.symbol", false]], "symm_operation() (psi4.core.charactertable method)": [[17, "psi4.core.CharacterTable.symm_operation", false]], "symmetrize (occ)": [[1704, "term-SYMMETRIZE-OCC", true]], "symmetrize() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.symmetrize", false]], "symmetrize_gradient() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.symmetrize_gradient", false]], "symmetry": [[1833, "index-2", false], [1833, "index-6", false]], "symmetry() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.symmetry", false]], "symmetry_from_input() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.symmetry_from_input", false]], "symmetryoperation (class in psi4.core)": [[139, "psi4.core.SymmetryOperation", false]], "symnormalize() (psi4.core.civector method)": [[12, "psi4.core.CIVector.symnormalize", false]], "t (thermo)": [[1704, "term-T-THERMO", true]], "t2_coupled (ccenergy)": [[1704, "term-T2_COUPLED-CCENERGY", true]], "t3_ws_incore (ccenergy)": [[1704, "term-T3_WS_INCORE-CCENERGY", true]], "t3_ws_incore (cceom)": [[1704, "term-T3_WS_INCORE-CCEOM", true]], "t_amps (cchbar)": [[1704, "term-T_AMPS-CCHBAR", true]], "t_cut_clmo (dlpno)": [[1704, "term-T_CUT_CLMO-DLPNO", true]], "t_cut_cpao (dlpno)": [[1704, "term-T_CUT_CPAO-DLPNO", true]], "t_cut_do (dlpno)": [[1704, "term-T_CUT_DO-DLPNO", true]], "t_cut_do_ij (dlpno)": [[1704, "term-T_CUT_DO_IJ-DLPNO", true]], "t_cut_do_pre (dlpno)": [[1704, "term-T_CUT_DO_PRE-DLPNO", true]], "t_cut_mkn (dlpno)": [[1704, "term-T_CUT_MKN-DLPNO", true]], "t_cut_pno (dlpno)": [[1704, "term-T_CUT_PNO-DLPNO", true]], "t_cut_pre (dlpno)": [[1704, "term-T_CUT_PRE-DLPNO", true]], "tag (psi4.driver.atomiccomputer attribute)": [[265, "psi4.driver.AtomicComputer.tag", false]], "tamm--dancoff approximation": [[1841, "index-0", false]], "task_list (psi4.driver.driver_cbs.compositecomputer attribute)": [[1740, "psi4.driver.driver_cbs.CompositeComputer.task_list", false]], "task_list (psi4.driver.driver_findif.finitedifferencecomputer attribute)": [[1772, "psi4.driver.driver_findif.FiniteDifferenceComputer.task_list", false]], "task_list (psi4.driver.driver_nbody.manybodycomputer attribute)": [[1794, "psi4.driver.driver_nbody.ManyBodyComputer.task_list", false]], "task_planner() (in module psi4.driver.task_planner)": [[1768, "psi4.driver.task_planner.task_planner", false]], "taskcomputers (in module psi4.driver.task_planner)": [[1768, "psi4.driver.task_planner.TaskComputers", false]], "td-fctl root 0 (h) -> root n (i) electric transition dipole moment (len)": [[1776, "psivar-TD-fctl-ROOT-0-h-ROOT-n-i-ELECTRIC-TRANSITION-DIPOLE-MOMENT-LEN", false]], "td-fctl root 0 (h) -> root n (i) electric transition dipole moment (vel)": [[1776, "psivar-TD-fctl-ROOT-0-h-ROOT-n-i-ELECTRIC-TRANSITION-DIPOLE-MOMENT-VEL", false]], "td-fctl root 0 (h) -> root n (i) excitation energy": [[1776, "psivar-TD-fctl-ROOT-0-h-ROOT-n-i-EXCITATION-ENERGY", false]], "td-fctl root 0 (h) -> root n (i) left eigenvector alpha": [[1776, "psivar-TD-fctl-ROOT-0-h-ROOT-n-i-LEFT-EIGENVECTOR-ALPHA", false]], "td-fctl root 0 (h) -> root n (i) left eigenvector beta": [[1776, "psivar-TD-fctl-ROOT-0-h-ROOT-n-i-LEFT-EIGENVECTOR-BETA", false]], "td-fctl root 0 (h) -> root n (i) magnetic transition dipole moment": [[1776, "psivar-TD-fctl-ROOT-0-h-ROOT-n-i-MAGNETIC-TRANSITION-DIPOLE-MOMENT", false]], "td-fctl root 0 (h) -> root n (i) oscillator strength (len)": [[1776, "psivar-TD-fctl-ROOT-0-h-ROOT-n-i-OSCILLATOR-STRENGTH-LEN", false]], "td-fctl root 0 (h) -> root n (i) oscillator strength (vel)": [[1776, "psivar-TD-fctl-ROOT-0-h-ROOT-n-i-OSCILLATOR-STRENGTH-VEL", false]], "td-fctl root 0 (h) -> root n (i) right eigenvector alpha": [[1776, "psivar-TD-fctl-ROOT-0-h-ROOT-n-i-RIGHT-EIGENVECTOR-ALPHA", false]], "td-fctl root 0 (h) -> root n (i) right eigenvector beta": [[1776, "psivar-TD-fctl-ROOT-0-h-ROOT-n-i-RIGHT-EIGENVECTOR-BETA", false]], "td-fctl root 0 (h) -> root n (i) rotatory strength (len)": [[1776, "psivar-TD-fctl-ROOT-0-h-ROOT-n-i-ROTATORY-STRENGTH-LEN", false]], "td-fctl root 0 (h) -> root n (i) rotatory strength (vel)": [[1776, "psivar-TD-fctl-ROOT-0-h-ROOT-n-i-ROTATORY-STRENGTH-VEL", false]], "td-fctl root 0 (in h) -> root n (in i) electric transition dipole moment (len)": [[1776, "psivar-TD-fctl-ROOT-0-IN-h-ROOT-n-IN-i-ELECTRIC-TRANSITION-DIPOLE-MOMENT-LEN", false]], "td-fctl root 0 (in h) -> root n (in i) electric transition dipole moment (vel)": [[1776, "psivar-TD-fctl-ROOT-0-IN-h-ROOT-n-IN-i-ELECTRIC-TRANSITION-DIPOLE-MOMENT-VEL", false]], "td-fctl root 0 (in h) -> root n (in i) excitation energy": [[1776, "psivar-TD-fctl-ROOT-0-IN-h-ROOT-n-IN-i-EXCITATION-ENERGY", false]], "td-fctl root 0 (in h) -> root n (in i) left eigenvector alpha": [[1776, "psivar-TD-fctl-ROOT-0-IN-h-ROOT-n-IN-i-LEFT-EIGENVECTOR-ALPHA", false]], "td-fctl root 0 (in h) -> root n (in i) left eigenvector beta": [[1776, "psivar-TD-fctl-ROOT-0-IN-h-ROOT-n-IN-i-LEFT-EIGENVECTOR-BETA", false]], "td-fctl root 0 (in h) -> root n (in i) magnetic transition dipole moment": [[1776, "psivar-TD-fctl-ROOT-0-IN-h-ROOT-n-IN-i-MAGNETIC-TRANSITION-DIPOLE-MOMENT", false]], "td-fctl root 0 (in h) -> root n (in i) oscillator strength (len)": [[1776, "psivar-TD-fctl-ROOT-0-IN-h-ROOT-n-IN-i-OSCILLATOR-STRENGTH-LEN", false]], "td-fctl root 0 (in h) -> root n (in i) oscillator strength (vel)": [[1776, "psivar-TD-fctl-ROOT-0-IN-h-ROOT-n-IN-i-OSCILLATOR-STRENGTH-VEL", false]], "td-fctl root 0 (in h) -> root n (in i) right eigenvector alpha": [[1776, "psivar-TD-fctl-ROOT-0-IN-h-ROOT-n-IN-i-RIGHT-EIGENVECTOR-ALPHA", false]], "td-fctl root 0 (in h) -> root n (in i) right eigenvector beta": [[1776, "psivar-TD-fctl-ROOT-0-IN-h-ROOT-n-IN-i-RIGHT-EIGENVECTOR-BETA", false]], "td-fctl root 0 (in h) -> root n (in i) rotatory strength (len)": [[1776, "psivar-TD-fctl-ROOT-0-IN-h-ROOT-n-IN-i-ROTATORY-STRENGTH-LEN", false]], "td-fctl root 0 (in h) -> root n (in i) rotatory strength (vel)": [[1776, "psivar-TD-fctl-ROOT-0-IN-h-ROOT-n-IN-i-ROTATORY-STRENGTH-VEL", false]], "td-fctl root 0 -> root n electric transition dipole moment (len)": [[1776, "psivar-TD-fctl-ROOT-0-ROOT-n-ELECTRIC-TRANSITION-DIPOLE-MOMENT-LEN", false]], "td-fctl root 0 -> root n electric transition dipole moment (len) - h transition": [[1776, "psivar-TD-fctl-ROOT-0-ROOT-n-ELECTRIC-TRANSITION-DIPOLE-MOMENT-LEN-h-TRANSITION", false]], "td-fctl root 0 -> root n electric transition dipole moment (vel)": [[1776, "psivar-TD-fctl-ROOT-0-ROOT-n-ELECTRIC-TRANSITION-DIPOLE-MOMENT-VEL", false]], "td-fctl root 0 -> root n electric transition dipole moment (vel) - h transition": [[1776, "psivar-TD-fctl-ROOT-0-ROOT-n-ELECTRIC-TRANSITION-DIPOLE-MOMENT-VEL-h-TRANSITION", false]], "td-fctl root 0 -> root n excitation energy": [[1776, "psivar-TD-fctl-ROOT-0-ROOT-n-EXCITATION-ENERGY", false]], "td-fctl root 0 -> root n excitation energy - h transition": [[1776, "psivar-TD-fctl-ROOT-0-ROOT-n-EXCITATION-ENERGY-h-TRANSITION", false]], "td-fctl root 0 -> root n left eigenvector alpha": [[1776, "psivar-TD-fctl-ROOT-0-ROOT-n-LEFT-EIGENVECTOR-ALPHA", false]], "td-fctl root 0 -> root n left eigenvector alpha - h transition": [[1776, "psivar-TD-fctl-ROOT-0-ROOT-n-LEFT-EIGENVECTOR-ALPHA-h-TRANSITION", false]], "td-fctl root 0 -> root n left eigenvector beta": [[1776, "psivar-TD-fctl-ROOT-0-ROOT-n-LEFT-EIGENVECTOR-BETA", false]], "td-fctl root 0 -> root n left eigenvector beta - h transition": [[1776, "psivar-TD-fctl-ROOT-0-ROOT-n-LEFT-EIGENVECTOR-BETA-h-TRANSITION", false]], "td-fctl root 0 -> root n magnetic transition dipole moment": [[1776, "psivar-TD-fctl-ROOT-0-ROOT-n-MAGNETIC-TRANSITION-DIPOLE-MOMENT", false]], "td-fctl root 0 -> root n magnetic transition dipole moment - h transition": [[1776, "psivar-TD-fctl-ROOT-0-ROOT-n-MAGNETIC-TRANSITION-DIPOLE-MOMENT-h-TRANSITION", false]], "td-fctl root 0 -> root n oscillator strength (len)": [[1776, "psivar-TD-fctl-ROOT-0-ROOT-n-OSCILLATOR-STRENGTH-LEN", false]], "td-fctl root 0 -> root n oscillator strength (len) - h transition": [[1776, "psivar-TD-fctl-ROOT-0-ROOT-n-OSCILLATOR-STRENGTH-LEN-h-TRANSITION", false]], "td-fctl root 0 -> root n oscillator strength (vel)": [[1776, "psivar-TD-fctl-ROOT-0-ROOT-n-OSCILLATOR-STRENGTH-VEL", false]], "td-fctl root 0 -> root n oscillator strength (vel) - h transition": [[1776, "psivar-TD-fctl-ROOT-0-ROOT-n-OSCILLATOR-STRENGTH-VEL-h-TRANSITION", false]], "td-fctl root 0 -> root n right eigenvector alpha": [[1776, "psivar-TD-fctl-ROOT-0-ROOT-n-RIGHT-EIGENVECTOR-ALPHA", false]], "td-fctl root 0 -> root n right eigenvector alpha - h transition": [[1776, "psivar-TD-fctl-ROOT-0-ROOT-n-RIGHT-EIGENVECTOR-ALPHA-h-TRANSITION", false]], "td-fctl root 0 -> root n right eigenvector beta": [[1776, "psivar-TD-fctl-ROOT-0-ROOT-n-RIGHT-EIGENVECTOR-BETA", false]], "td-fctl root 0 -> root n right eigenvector beta - h transition": [[1776, "psivar-TD-fctl-ROOT-0-ROOT-n-RIGHT-EIGENVECTOR-BETA-h-TRANSITION", false]], "td-fctl root 0 -> root n rotatory strength (len)": [[1776, "psivar-TD-fctl-ROOT-0-ROOT-n-ROTATORY-STRENGTH-LEN", false]], "td-fctl root 0 -> root n rotatory strength (len) - h transition": [[1776, "psivar-TD-fctl-ROOT-0-ROOT-n-ROTATORY-STRENGTH-LEN-h-TRANSITION", false]], "td-fctl root 0 -> root n rotatory strength (vel)": [[1776, "psivar-TD-fctl-ROOT-0-ROOT-n-ROTATORY-STRENGTH-VEL", false]], "td-fctl root 0 -> root n rotatory strength (vel) - h transition": [[1776, "psivar-TD-fctl-ROOT-0-ROOT-n-ROTATORY-STRENGTH-VEL-h-TRANSITION", false]], "td-fctl root n (h) total energy": [[1776, "psivar-TD-fctl-ROOT-n-h-TOTAL-ENERGY", false]], "td-fctl root n (in h) total energy": [[1776, "psivar-TD-fctl-ROOT-n-IN-h-TOTAL-ENERGY", false]], "td-fctl root n total energy": [[1776, "psivar-TD-fctl-ROOT-n-TOTAL-ENERGY", false]], "td-fctl root n total energy - h transition": [[1776, "psivar-TD-fctl-ROOT-n-TOTAL-ENERGY-h-TRANSITION", false]], "tda": [[1841, "index-0", false]], "tddft": [[1841, "index-0", false]], "tdm (detci)": [[1704, "term-TDM-DETCI", true]], "tdscf": [[1841, "index-0", false], [1841, "index-1", false]], "tdscf() (in module psi4.driver)": [[398, "psi4.driver.tdscf", false]], "tdscf_coeff_cutoff (scf)": [[1704, "term-TDSCF_COEFF_CUTOFF-SCF", true]], "tdscf_guess (scf)": [[1704, "term-TDSCF_GUESS-SCF", true]], "tdscf_maxiter (scf)": [[1704, "term-TDSCF_MAXITER-SCF", true]], "tdscf_print (scf)": [[1704, "term-TDSCF_PRINT-SCF", true]], "tdscf_r_convergence (scf)": [[1704, "term-TDSCF_R_CONVERGENCE-SCF", true]], "tdscf_states (scf)": [[1704, "term-TDSCF_STATES-SCF", true]], "tdscf_tda (scf)": [[1704, "term-TDSCF_TDA-SCF", true]], "tdscf_tdm_print (scf)": [[1704, "term-TDSCF_TDM_PRINT-SCF", true]], "tdscf_triplets (scf)": [[1704, "term-TDSCF_TRIPLETS-SCF", true]], "tdscfconvergenceerror": [[277, "psi4.driver.TDSCFConvergenceError", false]], "test_b (optking)": [[1704, "term-TEST_B-OPTKING", true]], "test_derivative_b (optking)": [[1704, "term-TEST_DERIVATIVE_B-OPTKING", true]], "test_functional() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.test_functional", false]], "test_matrix_dpd_interface() (in module psi4.core)": [[256, "psi4.core.test_matrix_dpd_interface", false]], "testcomparisonerror": [[278, "psi4.driver.TestComparisonError", false]], "the total electronic gradient [e_h/a0] of the mp2 level of theory, ({nat}, 3).": [[1776, "psivar-The-total-electronic-gradient-E_h-a0-of-the-MP2-level-of-theory-nat-3-.", false]], "theory": [[0, "index-2", false], [284, "index-0", false], [1740, "index-1", false], [1741, "index-0", false], [1742, "index-0", false], [1753, "index-0", false], [1755, "index-1", false], [1756, "index-1", false], [1757, "index-0", false], [1763, "index-1", false], [1770, "index-0", false], [1789, "index-1", false], [1798, "index-1", false], [1799, "index-0", false], [1837, "index-0", false], [1838, "index-1", false], [1841, "index-1", false]], "thermal energy": [[1776, "psivar-THERMAL-ENERGY", false]], "thermal energy correction": [[1776, "psivar-THERMAL-ENERGY-CORRECTION", false]], "thermo() (in module psi4.driver.qcdb.vib)": [[390, "psi4.driver.qcdb.vib.thermo", false]], "theta_points (scf)": [[1704, "term-THETA_POINTS-SCF", true]], "thickness (scf)": [[1704, "term-THICKNESS-SCF", true]], "threading": [[1767, "index-6", false], [1767, "index-9", false]], "three_particle (dct)": [[1704, "term-THREE_PARTICLE-DCT", true]], "threecenteroverlapint (class in psi4.core)": [[141, "psi4.core.ThreeCenterOverlapInt", false]], "tikhonow_max (psimrcc)": [[1704, "term-TIKHONOW_MAX-PSIMRCC", true]], "tikhonow_omega (dct)": [[1704, "term-TIKHONOW_OMEGA-DCT", true]], "tikhonow_omega (psimrcc)": [[1704, "term-TIKHONOW_OMEGA-PSIMRCC", true]], "tikhonow_triples (psimrcc)": [[1704, "term-TIKHONOW_TRIPLES-PSIMRCC", true]], "tile_sz (scf)": [[1704, "term-TILE_SZ-SCF", true]], "timer_off() (in module psi4.core)": [[257, "psi4.core.timer_off", false]], "timer_on() (in module psi4.core)": [[258, "psi4.core.timer_on", false]], "tlaplacedenominator (class in psi4.core)": [[140, "psi4.core.TLaplaceDenominator", false]], "to_array() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.to_array", false]], "to_array() (psi4.core.vector method)": [[148, "psi4.core.Vector.to_array", false]], "to_arrays() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.to_arrays", false]], "to_dict() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.to_dict", false]], "to_file() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.to_file", false]], "to_schema() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.to_schema", false]], "to_serial() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.to_serial", false]], "to_serial() (psi4.core.vector method)": [[148, "psi4.core.Vector.to_serial", false]], "to_string() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.to_string", false]], "to_tuple() (psi4.core.dimension method)": [[64, "psi4.core.Dimension.to_tuple", false]], "tocclean() (psi4.core.io method)": [[86, "psi4.core.IO.tocclean", false]], "tocentry_exists() (psi4.core.io method)": [[86, "psi4.core.IO.tocentry_exists", false]], "tocprint() (psi4.core.io method)": [[86, "psi4.core.IO.tocprint", false]], "tocscan() (psi4.core.io method)": [[86, "psi4.core.IO.tocscan", false]], "tocwrite() (psi4.core.io method)": [[86, "psi4.core.IO.tocwrite", false]], "total_index() (psi4.core.ccwavefunction method)": [[11, "psi4.core.CCWavefunction.total_index", false]], "tpdm (detci)": [[1704, "term-TPDM-DETCI", true]], "tpdm() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.tpdm", false]], "tpdm_abcd_type (occ)": [[1704, "term-TPDM_ABCD_TYPE-OCC", true]], "trace() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.trace", false]], "trace() (psi4.core.symmetryoperation method)": [[139, "psi4.core.SymmetryOperation.trace", false]], "tracelessquadrupoleint (class in psi4.core)": [[142, "psi4.core.TracelessQuadrupoleInt", false]], "transform() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.transform", false]], "transform() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.transform", false]], "transform() (psi4.core.symmetryoperation method)": [[139, "psi4.core.SymmetryOperation.transform", false]], "transform_ci_integrals() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.transform_ci_integrals", false]], "transform_mcscf_integrals() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.transform_mcscf_integrals", false]], "transform_tei() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.transform_tei", false]], "transform_tei_first_half() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.transform_tei_first_half", false]], "transform_tei_second_half() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.transform_tei_second_half", false]], "transition state": [[1802, "index-2", false]], "translate() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.translate", false]], "translate_psi4 (cfour)": [[1704, "term-TRANSLATE_PSI4-CFOUR", true]], "transpose() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.transpose", false]], "transpose() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.transpose", false]], "transpose() (psi4.core.symmetryoperation method)": [[139, "psi4.core.SymmetryOperation.transpose", false]], "transpose_this() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.transpose_this", false]], "tree_expansion_order (pe)": [[1704, "term-TREE_EXPANSION_ORDER-PE", true]], "tree_theta (pe)": [[1704, "term-TREE_THETA-PE", true]], "triples_algorithm (psimrcc)": [[1704, "term-TRIPLES_ALGORITHM-PSIMRCC", true]], "triples_diis (psimrcc)": [[1704, "term-TRIPLES_DIIS-PSIMRCC", true]], "triples_iabc_type (dfocc)": [[1704, "term-TRIPLES_IABC_TYPE-DFOCC", true]], "triples_low_memory (fnocc)": [[1704, "term-TRIPLES_LOW_MEMORY-FNOCC", true]], "triplet() (in module psi4.core)": [[259, "psi4.core.triplet", false]], "triplet() (psi4.core.matrix static method)": [[100, "psi4.core.Matrix.triplet", false]], "trove (psi4.driver.driver_cbs.compositecomputer attribute)": [[1740, "psi4.driver.driver_cbs.CompositeComputer.trove", false]], "true_atomic_number() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.true_atomic_number", false]], "tstart() (in module psi4.core)": [[260, "psi4.core.tstart", false]], "tstop() (in module psi4.core)": [[261, "psi4.core.tstop", false]], "turn_on_actv (mcscf)": [[1704, "term-TURN_ON_ACTV-MCSCF", true]], "two-electron energy": [[1776, "psivar-TWO-ELECTRON-ENERGY", false]], "twobodyaoint (class in psi4.core)": [[143, "psi4.core.TwoBodyAOInt", false]], "twoel_hx() (psi4.core.hf method)": [[84, "psi4.core.HF.twoel_Hx", false]], "twoel_hx_full() (psi4.core.rhf method)": [[128, "psi4.core.RHF.twoel_Hx_full", false]], "twoelectronint (class in psi4.core)": [[144, "psi4.core.TwoElectronInt", false]], "u (psi4.core.localizer attribute)": [[97, "psi4.core.Localizer.U", false]], "uhf (class in psi4.core)": [[145, "psi4.core.UHF", false]], "uhf_noons (scf)": [[1704, "term-UHF_NOONS-SCF", true]], "uksfunctions (class in psi4.core)": [[146, "psi4.core.UKSFunctions", false]], "uncp-corrected 2-body interaction energy": [[1776, "psivar-UNCP-CORRECTED-2-BODY-INTERACTION-ENERGY", false]], "unfreeze_dihedrals (optking)": [[1704, "term-UNFREEZE_DIHEDRALS-OPTKING", true]], "unify() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.unify", false]], "unify_part2() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.unify_part2", false]], "unit() (psi4.core.symmetryoperation method)": [[139, "psi4.core.SymmetryOperation.unit", false]], "units": [[1833, "index-2", false]], "units() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.units", false]], "unnormalized (psi4.core.primitivetype attribute)": [[122, "psi4.core.PrimitiveType.Unnormalized", false]], "up (psi4.driver.p4util.inpsight attribute)": [[323, "psi4.driver.p4util.InPsight.up", false]], "update (detci)": [[1704, "term-UPDATE-DETCI", true]], "update() (psi4.core.somcscf method)": [[133, "psi4.core.SOMCSCF.update", false]], "update_density() (psi4.core.twobodyaoint method)": [[143, "psi4.core.TwoBodyAOInt.update_density", false]], "update_geometry() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.update_geometry", false]], "update_geometry() (psi4.driver.p4util.inpsight method)": [[323, "psi4.driver.p4util.InPsight.update_geometry", false]], "update_orbitals() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.update_orbitals", false]], "upgradehelper": [[279, "psi4.driver.UpgradeHelper", false]], "use_df_ints (fnocc)": [[1704, "term-USE_DF_INTS-FNOCC", true]], "use_spin_sym (psimrcc)": [[1704, "term-USE_SPIN_SYM-PSIMRCC", true]], "use_spin_symmetry (psimrcc)": [[1704, "term-USE_SPIN_SYMMETRY-PSIMRCC", true]], "using pcm": [[1803, "index-1", false]], "using pe": [[1749, "index-1", false]], "v2rdm_casscf": [[1807, "index-0", false]], "v_potential() (psi4.core.hf method)": [[84, "psi4.core.HF.V_potential", false]], "va() (psi4.core.hf method)": [[84, "psi4.core.HF.Va", false]], "val_ex_level (detci)": [[1704, "term-VAL_EX_LEVEL-DETCI", true]], "valid_methods (psi4.core.oeprop attribute)": [[111, "psi4.core.OEProp.valid_methods", false]], "validate_diis() (psi4.core.hf method)": [[84, "psi4.core.HF.validate_diis", false]], "validate_options() (psi4.core.options method)": [[114, "psi4.core.Options.validate_options", false]], "validationerror": [[280, "psi4.driver.ValidationError", false]], "value (psi4.core.derivcalctype attribute)": [[62, "psi4.core.DerivCalcType.value", false]], "value (psi4.core.diagonalizeorder attribute)": [[63, "psi4.core.DiagonalizeOrder.value", false]], "value (psi4.core.fragmenttype attribute)": [[79, "psi4.core.FragmentType.value", false]], "value (psi4.core.gaussiantype attribute)": [[82, "psi4.core.GaussianType.value", false]], "value (psi4.core.geometryunits attribute)": [[83, "psi4.core.GeometryUnits.value", false]], "value (psi4.core.primitivetype attribute)": [[122, "psi4.core.PrimitiveType.value", false]], "value (psi4.core.psireturntype attribute)": [[126, "psi4.core.PsiReturnType.value", false]], "value (psi4.core.savetype attribute)": [[135, "psi4.core.SaveType.value", false]], "value() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.value", false]], "values() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.values", false]], "variable() (in module psi4.core)": [[262, "psi4.core.variable", false]], "variable() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.variable", false]], "variables() (in module psi4.core)": [[263, "psi4.core.variables", false]], "variables() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.variables", false]], "vb() (psi4.core.hf method)": [[84, "psi4.core.HF.Vb", false]], "vbase (class in psi4.core)": [[147, "psi4.core.VBase", false]], "vdot() (psi4.core.civector method)": [[12, "psi4.core.CIVector.vdot", false]], "vecs_cc3 (cceom)": [[1704, "term-VECS_CC3-CCEOM", true]], "vecs_per_root (cceom)": [[1704, "term-VECS_PER_ROOT-CCEOM", true]], "vector (class in psi4.core)": [[148, "psi4.core.Vector", false]], "vector3 (class in psi4.core)": [[149, "psi4.core.Vector3", false]], "vector_axpy() (psi4.driver.p4util.solverengine method)": [[329, "psi4.driver.p4util.SolverEngine.vector_axpy", false]], "vector_copy() (psi4.driver.p4util.solverengine method)": [[329, "psi4.driver.p4util.SolverEngine.vector_copy", false]], "vector_dot() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.vector_dot", false]], "vector_dot() (psi4.core.vector method)": [[148, "psi4.core.Vector.vector_dot", false]], "vector_dot() (psi4.driver.p4util.solverengine static method)": [[329, "psi4.driver.p4util.SolverEngine.vector_dot", false]], "vector_multiply() (psi4.core.civector method)": [[12, "psi4.core.CIVector.vector_multiply", false]], "vector_scale() (psi4.driver.p4util.solverengine method)": [[329, "psi4.driver.p4util.SolverEngine.vector_scale", false]], "vectors() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.vectors", false]], "verbose (psi4.driver.driver_cbs.compositecomputer attribute)": [[1740, "psi4.driver.driver_cbs.CompositeComputer.verbose", false]], "version() (in module psi4.core)": [[264, "psi4.core.version", false]], "vibanal_wfn() (in module psi4.driver)": [[399, "psi4.driver.vibanal_wfn", false]], "vibrational analysis": [[1772, "index-0", false], [1843, "index-1", false]], "vir() (psi4.core.mospace static method)": [[98, "psi4.core.MOSpace.vir", false]], "visualization": [[1750, "index-0", false], [1791, "index-0", false]], "vmdpath": [[1750, "envvar-VMDPATH", false], [1750, "index-1", false]], "vmfc": [[1794, "index-1", false]], "vmfc (psi4.driver.driver_nbody.bsseenum attribute)": [[1794, "psi4.driver.driver_nbody.BsseEnum.vmfc", false]], "vv10_b() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.vv10_b", false]], "vv10_c() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.vv10_c", false]], "vvals() (psi4.core.oeprop method)": [[111, "psi4.core.OEProp.Vvals", false]], "w() (psi4.core.blockopoints method)": [[9, "psi4.core.BlockOPoints.w", false]], "wabei_lowdisk (cchbar)": [[1704, "term-WABEI_LOWDISK-CCHBAR", true]], "wavefunction (class in psi4.core)": [[150, "psi4.core.Wavefunction", false]], "wcombine (scf)": [[1704, "term-WCOMBINE-SCF", true]], "webmo": [[1791, "index-0", false]], "wfn (ccdensity)": [[1704, "term-WFN-CCDENSITY", true]], "wfn (ccenergy)": [[1704, "term-WFN-CCENERGY", true]], "wfn (cceom)": [[1704, "term-WFN-CCEOM", true]], "wfn (cchbar)": [[1704, "term-WFN-CCHBAR", true]], "wfn (cclambda)": [[1704, "term-WFN-CCLAMBDA", true]], "wfn (ccresponse)": [[1704, "term-WFN-CCRESPONSE", true]], "wfn (cctransort)": [[1704, "term-WFN-CCTRANSORT", true]], "wfn (cctriples)": [[1704, "term-WFN-CCTRIPLES", true]], "wfn (detci)": [[1704, "term-WFN-DETCI", true]], "wfn (globals)": [[1704, "term-WFN-GLOBALS", true]], "wfn (psi4.driver.optimizationconvergenceerror attribute)": [[270, "psi4.driver.OptimizationConvergenceError.wfn", false]], "wfn (psi4.driver.scfconvergenceerror attribute)": [[276, "psi4.driver.SCFConvergenceError.wfn", false]], "wfn (psi4.driver.tdscfconvergenceerror attribute)": [[277, "psi4.driver.TDSCFConvergenceError.wfn", false]], "wfn (scf)": [[1704, "term-WFN-SCF", true]], "wfn_sym (mcscf)": [[1704, "term-WFN_SYM-MCSCF", true]], "wfn_sym (psimrcc)": [[1704, "term-WFN_SYM-PSIMRCC", true]], "wfn_type (dfocc)": [[1704, "term-WFN_TYPE-DFOCC", true]], "wfn_type (occ)": [[1704, "term-WFN_TYPE-OCC", true]], "what (psi4.driver.tdscfconvergenceerror attribute)": [[277, "psi4.driver.TDSCFConvergenceError.what", false]], "wiberg lowdin indices": [[1776, "psivar-WIBERG-LOWDIN-INDICES", false]], "width (psi4.driver.p4util.inpsight attribute)": [[323, "psi4.driver.p4util.InPsight.width", false]], "wk() (psi4.core.jk method)": [[92, "psi4.core.JK.wK", false]], "write() (psi4.core.civector method)": [[12, "psi4.core.CIVector.write", false]], "write() (psi4.core.fchkwriter method)": [[74, "psi4.core.FCHKWriter.write", false]], "write() (psi4.core.moldenwriter method)": [[104, "psi4.core.MoldenWriter.write", false]], "write() (psi4.core.mowriter method)": [[99, "psi4.core.MOWriter.write", false]], "write_molden() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.write_molden", false]], "write_nbo() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.write_nbo", false]], "write_nos (ccdensity)": [[1704, "term-WRITE_NOS-CCDENSITY", true]], "write_opt_history (optking)": [[1704, "term-WRITE_OPT_HISTORY-OPTKING", true]], "write_opt_result (optking)": [[1704, "term-WRITE_OPT_RESULT-OPTKING", true]], "write_scratch_file() (psi4.core.iomanager method)": [[87, "psi4.core.IOManager.write_scratch_file", false]], "write_trajectory (optking)": [[1704, "term-WRITE_TRAJECTORY-OPTKING", true]], "writer_file_label (globals)": [[1704, "term-WRITER_FILE_LABEL-GLOBALS", true]], "x() (psi4.core.blockopoints method)": [[9, "psi4.core.BlockOPoints.x", false]], "x() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.x", false]], "x_alpha() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.x_alpha", false]], "x_beta() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.x_beta", false]], "x_functional() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.x_functional", false]], "x_functionals() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.x_functionals", false]], "x_omega() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.x_omega", false]], "xc_build() (psi4.core.superfunctional static method)": [[138, "psi4.core.SuperFunctional.XC_build", false]], "xclib_description() (psi4.core.libxcfunctional method)": [[96, "psi4.core.LibXCFunctional.xclib_description", false]], "xclib_description() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.xclib_description", false]], "xi (ccdensity)": [[1704, "term-XI-CCDENSITY", true]], "xi_connect (ccdensity)": [[1704, "term-XI_CONNECT-CCDENSITY", true]], "xtpl_highest_1() (in module psi4.driver.driver_cbs_helper)": [[1740, "psi4.driver.driver_cbs_helper.xtpl_highest_1", false]], "xyz (psi4.core.salccomponent attribute)": [[134, "psi4.core.SalcComponent.xyz", false]], "xyz() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.xyz", false]], "y() (psi4.core.blockopoints method)": [[9, "psi4.core.BlockOPoints.y", false]], "y() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.y", false]], "z() (psi4.core.blockopoints method)": [[9, "psi4.core.BlockOPoints.z", false]], "z() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.Z", false], [106, "psi4.core.Molecule.z", false]], "zaptn correlation energy": [[1776, "psivar-ZAPTn-CORRELATION-ENERGY", false]], "zaptn total energy": [[1776, "psivar-ZAPTn-TOTAL-ENERGY", false]], "zero k enthalpy": [[1776, "psivar-ZERO-K-ENTHALPY", false]], "zero() (psi4.core.civector method)": [[12, "psi4.core.CIVector.zero", false]], "zero() (psi4.core.dimension method)": [[64, "psi4.core.Dimension.zero", false]], "zero() (psi4.core.dpdbuf4 method)": [[183, "psi4.core.dpdbuf4.zero", false]], "zero() (psi4.core.dpdfile2 method)": [[184, "psi4.core.dpdfile2.zero", false]], "zero() (psi4.core.intvector method)": [[88, "psi4.core.IntVector.zero", false]], "zero() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.zero", false]], "zero() (psi4.core.symmetryoperation method)": [[139, "psi4.core.SymmetryOperation.zero", false]], "zero() (psi4.core.vector method)": [[148, "psi4.core.Vector.zero", false]], "zero_ao_basis_set() (psi4.core.basisset static method)": [[8, "psi4.core.BasisSet.zero_ao_basis_set", false]], "zero_diagonal() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.zero_diagonal", false]], "zero_internal_amps (psimrcc)": [[1704, "term-ZERO_INTERNAL_AMPS-PSIMRCC", true]], "zero_lower() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.zero_lower", false]], "zero_redundant() (psi4.core.somcscf method)": [[133, "psi4.core.SOMCSCF.zero_redundant", false]], "zero_upper() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.zero_upper", false]], "zeta (ccdensity)": [[1704, "term-ZETA-CCDENSITY", true]], "zeta (cclambda)": [[1704, "term-ZETA-CCLAMBDA", true]], "zoom (psi4.driver.p4util.inpsight attribute)": [[323, "psi4.driver.p4util.InPsight.zoom", false]], "zpve": [[1776, "psivar-ZPVE", false]]}, "objects": {"": [[1776, 9, 1, "psivar-AT-CORRECTION-ENERGY", "(AT) CORRECTION ENERGY"], [1776, 9, 1, "psivar-0", "(T) CORRECTION ENERGY"], [1776, 9, 1, "psivar-2-BODY-PAIRWISE-DISPERSION-CORRECTION-ANALYSIS", "2-BODY PAIRWISE DISPERSION CORRECTION ANALYSIS"], [1776, 9, 1, "psivar-A-T-CORRECTION-ENERGY", "A-(T) CORRECTION ENERGY"], [1776, 9, 1, "psivar-A-CCSD-T-CORRELATION-ENERGY", "A-CCSD(T) CORRELATION ENERGY"], [1776, 9, 1, "psivar-A-CCSD-T-TOTAL-ENERGY", "A-CCSD(T) TOTAL ENERGY"], [1776, 9, 1, "psivar-AAA-T-CORRECTION-ENERGY", "AAA (T) CORRECTION ENERGY"], [1776, 9, 1, "psivar-AAB-T-CORRECTION-ENERGY", "AAB (T) CORRECTION ENERGY"], [1776, 9, 1, "psivar-ABB-T-CORRECTION-ENERGY", "ABB (T) CORRECTION ENERGY"], [1776, 9, 1, "psivar-ACPF-CORRELATION-ENERGY", "ACPF CORRELATION ENERGY"], [1776, 9, 1, "psivar-ACPF-DIPOLE", "ACPF DIPOLE"], [1776, 9, 1, "psivar-ACPF-DOUBLES-ENERGY", "ACPF DOUBLES ENERGY"], [1776, 9, 1, "psivar-ACPF-OPPOSITE-SPIN-CORRELATION-ENERGY", "ACPF OPPOSITE-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-ACPF-QUADRUPOLE", "ACPF QUADRUPOLE"], [1776, 9, 1, "psivar-ACPF-SAME-SPIN-CORRELATION-ENERGY", "ACPF SAME-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-ACPF-SINGLES-ENERGY", "ACPF SINGLES ENERGY"], [1776, 9, 1, "psivar-ACPF-TOTAL-ENERGY", "ACPF TOTAL ENERGY"], [1776, 9, 1, "psivar-ADC-ITERATIONS", "ADC ITERATIONS"], [1776, 9, 1, "psivar-ADC-ROOT-0-IN-h-ROOT-n-IN-i-ELECTRIC-TRANSITION-DIPOLE-MOMENT-LEN", "ADC ROOT 0 (IN h) -&gt; ROOT n (IN i) ELECTRIC TRANSITION DIPOLE MOMENT (LEN)"], [1776, 9, 1, "psivar-ADC-ROOT-0-IN-h-ROOT-n-IN-i-EXCITATION-ENERGY", "ADC ROOT 0 (IN h) -&gt; ROOT n (IN i) EXCITATION ENERGY"], [1776, 9, 1, "psivar-ADC-ROOT-0-IN-h-ROOT-n-IN-i-OSCILLATOR-STRENGTH-LEN", "ADC ROOT 0 (IN h) -&gt; ROOT n (IN i) OSCILLATOR STRENGTH (LEN)"], [1776, 9, 1, "psivar-ADC-ROOT-0-IN-h-ROOT-n-IN-i-OSCILLATOR-STRENGTH-VEL", "ADC ROOT 0 (IN h) -&gt; ROOT n (IN i) OSCILLATOR STRENGTH (VEL)"], [1776, 9, 1, "psivar-ADC-ROOT-0-IN-h-ROOT-n-IN-i-ROTATORY-STRENGTH-VEL", "ADC ROOT 0 (IN h) -&gt; ROOT n (IN i) ROTATORY STRENGTH (VEL)"], [1776, 9, 1, "psivar-ADC-ROOT-0-h-ROOT-n-i-ELECTRIC-TRANSITION-DIPOLE-MOMENT-LEN", "ADC ROOT 0 (h) -&gt; ROOT n (i) ELECTRIC TRANSITION DIPOLE MOMENT (LEN)"], [1776, 9, 1, "psivar-ADC-ROOT-0-h-ROOT-n-i-EXCITATION-ENERGY", "ADC ROOT 0 (h) -&gt; ROOT n (i) EXCITATION ENERGY"], [1776, 9, 1, "psivar-ADC-ROOT-0-h-ROOT-n-i-OSCILLATOR-STRENGTH-LEN", "ADC ROOT 0 (h) -&gt; ROOT n (i) OSCILLATOR STRENGTH (LEN)"], [1776, 9, 1, "psivar-ADC-ROOT-0-h-ROOT-n-i-OSCILLATOR-STRENGTH-VEL", "ADC ROOT 0 (h) -&gt; ROOT n (i) OSCILLATOR STRENGTH (VEL)"], [1776, 9, 1, "psivar-ADC-ROOT-0-h-ROOT-n-i-ROTATORY-STRENGTH-VEL", "ADC ROOT 0 (h) -&gt; ROOT n (i) ROTATORY STRENGTH (VEL)"], [1776, 9, 1, "psivar-ADC-ROOT-0-ROOT-n-ELECTRIC-TRANSITION-DIPOLE-MOMENT-LEN", "ADC ROOT 0 -&gt; ROOT n ELECTRIC TRANSITION DIPOLE MOMENT (LEN)"], [1776, 9, 1, "psivar-ADC-ROOT-0-ROOT-n-ELECTRIC-TRANSITION-DIPOLE-MOMENT-LEN-h-TRANSITION", "ADC ROOT 0 -&gt; ROOT n ELECTRIC TRANSITION DIPOLE MOMENT (LEN) - h TRANSITION"], [1776, 9, 1, "psivar-ADC-ROOT-0-ROOT-n-EXCITATION-ENERGY", "ADC ROOT 0 -&gt; ROOT n EXCITATION ENERGY"], [1776, 9, 1, "psivar-ADC-ROOT-0-ROOT-n-EXCITATION-ENERGY-h-TRANSITION", "ADC ROOT 0 -&gt; ROOT n EXCITATION ENERGY - h TRANSITION"], [1776, 9, 1, "psivar-ADC-ROOT-0-ROOT-n-OSCILLATOR-STRENGTH-LEN", "ADC ROOT 0 -&gt; ROOT n OSCILLATOR STRENGTH (LEN)"], [1776, 9, 1, "psivar-ADC-ROOT-0-ROOT-n-OSCILLATOR-STRENGTH-LEN-h-TRANSITION", "ADC ROOT 0 -&gt; ROOT n OSCILLATOR STRENGTH (LEN) - h TRANSITION"], [1776, 9, 1, "psivar-ADC-ROOT-0-ROOT-n-OSCILLATOR-STRENGTH-VEL", "ADC ROOT 0 -&gt; ROOT n OSCILLATOR STRENGTH (VEL)"], [1776, 9, 1, "psivar-ADC-ROOT-0-ROOT-n-OSCILLATOR-STRENGTH-VEL-h-TRANSITION", "ADC ROOT 0 -&gt; ROOT n OSCILLATOR STRENGTH (VEL) - h TRANSITION"], [1776, 9, 1, "psivar-ADC-ROOT-0-ROOT-n-ROTATORY-STRENGTH-VEL", "ADC ROOT 0 -&gt; ROOT n ROTATORY STRENGTH (VEL)"], [1776, 9, 1, "psivar-ADC-ROOT-0-ROOT-n-ROTATORY-STRENGTH-VEL-h-TRANSITION", "ADC ROOT 0 -&gt; ROOT n ROTATORY STRENGTH (VEL) - h TRANSITION"], [1776, 9, 1, "psivar-AQCC-CORRELATION-ENERGY", "AQCC CORRELATION ENERGY"], [1776, 9, 1, "psivar-AQCC-DIPOLE", "AQCC DIPOLE"], [1776, 9, 1, "psivar-AQCC-DOUBLES-ENERGY", "AQCC DOUBLES ENERGY"], [1776, 9, 1, "psivar-AQCC-OPPOSITE-SPIN-CORRELATION-ENERGY", "AQCC OPPOSITE-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-AQCC-QUADRUPOLE", "AQCC QUADRUPOLE"], [1776, 9, 1, "psivar-AQCC-SAME-SPIN-CORRELATION-ENERGY", "AQCC SAME-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-AQCC-SINGLES-ENERGY", "AQCC SINGLES ENERGY"], [1776, 9, 1, "psivar-AQCC-TOTAL-ENERGY", "AQCC TOTAL ENERGY"], [1776, 9, 1, "psivar-BBB-T-CORRECTION-ENERGY", "BBB (T) CORRECTION ENERGY"], [1735, 10, 1, "-", "BRIANQC_ENABLE"], [1735, 10, 1, "-", "BRIANQC_INSTALL_PATH"], [1735, 10, 1, "-", "BRIANQC_SDK_INSTALL"], [1776, 9, 1, "psivar-BRUECKNER-CONVERGED", "BRUECKNER CONVERGED"], [1776, 9, 1, "psivar-CBS-CORRELATION-ENERGY", "CBS CORRELATION ENERGY"], [1776, 9, 1, "psivar-CBS-NUMBER", "CBS NUMBER"], [1776, 9, 1, "psivar-CBS-REFERENCE-ENERGY", "CBS REFERENCE ENERGY"], [1776, 9, 1, "psivar-CBS-TOTAL-ENERGY", "CBS TOTAL ENERGY"], [1776, 9, 1, "psivar-CC-ALPHA-ALPHA-PAIR-ENERGIES", "CC ALPHA-ALPHA PAIR ENERGIES"], [1776, 9, 1, "psivar-CC-ALPHA-BETA-PAIR-ENERGIES", "CC ALPHA-BETA PAIR ENERGIES"], [1776, 9, 1, "psivar-CC-CORRELATION-ENERGY", "CC CORRELATION ENERGY"], [1776, 9, 1, "psivar-CC-CORRELATION-KINETIC-ENERGY", "CC CORRELATION KINETIC ENERGY"], [1776, 9, 1, "psivar-CC-CORRELATION-POTENTIAL-ENERGY", "CC CORRELATION POTENTIAL ENERGY"], [1776, 9, 1, "psivar-CC-CORRELATION-VIRIAL-RATIO", "CC CORRELATION VIRIAL RATIO"], [1776, 9, 1, "psivar-CC-D1-DIAGNOSTIC", "CC D1 DIAGNOSTIC"], [1776, 9, 1, "psivar-CC-D2-DIAGNOSTIC", "CC D2 DIAGNOSTIC"], [1776, 9, 1, "psivar-CC-DIPOLE", "CC DIPOLE"], [1776, 9, 1, "psivar-CC-NEW-D1-DIAGNOSTIC", "CC NEW D1 DIAGNOSTIC"], [1776, 9, 1, "psivar-CC-SINGLET-PAIR-ENERGIES", "CC SINGLET PAIR ENERGIES"], [1776, 9, 1, "psivar-CC-T1-DIAGNOSTIC", "CC T1 DIAGNOSTIC"], [1776, 9, 1, "psivar-CC-TOTAL-ENERGY", "CC TOTAL ENERGY"], [1776, 9, 1, "psivar-CC-TRIPLET-PAIR-ENERGIES", "CC TRIPLET PAIR ENERGIES"], [1776, 9, 1, "psivar-CC-VIRIAL-RATIO", "CC VIRIAL RATIO"], [1776, 9, 1, "psivar-CC-n-1-n-CORRELATION-ENERGY", "CC(n-1)(n) CORRELATION ENERGY"], [1776, 9, 1, "psivar-CC-n-1-n-TOTAL-ENERGY", "CC(n-1)(n) TOTAL ENERGY"], [1776, 9, 1, "psivar-CC-n-1-n-_L-CORRELATION-ENERGY", "CC(n-1)(n)_L CORRELATION ENERGY"], [1776, 9, 1, "psivar-CC-n-1-n-_L-TOTAL-ENERGY", "CC(n-1)(n)_L TOTAL ENERGY"], [1776, 9, 1, "psivar-CC2-ALPHA-ALPHA-PAIR-ENERGIES", "CC2 ALPHA-ALPHA PAIR ENERGIES"], [1776, 9, 1, "psivar-CC2-ALPHA-BETA-PAIR-ENERGIES", "CC2 ALPHA-BETA PAIR ENERGIES"], [1776, 9, 1, "psivar-CC2-CORRELATION-ENERGY", "CC2 CORRELATION ENERGY"], [1776, 9, 1, "psivar-CC2-DIPOLE-POLARIZABILITY-xNM", "CC2 DIPOLE POLARIZABILITY @ xNM"], [1776, 9, 1, "psivar-CC2-DIPOLE-POLARIZABILITY-TENSOR-xNM", "CC2 DIPOLE POLARIZABILITY TENSOR @ xNM"], [1776, 9, 1, "psivar-CC2-QUADRUPOLE-POLARIZABILITY-xNM", "CC2 QUADRUPOLE POLARIZABILITY @ xNM"], [1776, 9, 1, "psivar-CC2-QUADRUPOLE-POLARIZABILITY-TENSOR-xNM", "CC2 QUADRUPOLE POLARIZABILITY TENSOR @ xNM"], [1776, 9, 1, "psivar-CC2-ROTATION-LEN-ORIGIN-DEPENDENCE-xNM", "CC2 ROTATION (LEN) ORIGIN-DEPENDENCE @ xNM"], [1776, 9, 1, "psivar-CC2-SINGLET-PAIR-ENERGIES", "CC2 SINGLET PAIR ENERGIES"], [1776, 9, 1, "psivar-CC2-SPECIFIC-ROTATION-LEN-xNM", "CC2 SPECIFIC ROTATION (LEN) @ xNM"], [1776, 9, 1, "psivar-CC2-SPECIFIC-ROTATION-MVG-xNM", "CC2 SPECIFIC ROTATION (MVG) @ xNM"], [1776, 9, 1, "psivar-CC2-SPECIFIC-ROTATION-VEL-xNM", "CC2 SPECIFIC ROTATION (VEL) @ xNM"], [1776, 9, 1, "psivar-CC2-TOTAL-ENERGY", "CC2 TOTAL ENERGY"], [1776, 9, 1, "psivar-CC2-TRIPLET-PAIR-ENERGIES", "CC2 TRIPLET PAIR ENERGIES"], [1776, 9, 1, "psivar-CC3-ALPHA-ALPHA-PAIR-ENERGIES", "CC3 ALPHA-ALPHA PAIR ENERGIES"], [1776, 9, 1, "psivar-CC3-ALPHA-BETA-PAIR-ENERGIES", "CC3 ALPHA-BETA PAIR ENERGIES"], [1776, 9, 1, "psivar-CC3-CORRELATION-ENERGY", "CC3 CORRELATION ENERGY"], [1776, 9, 1, "psivar-CC3-SINGLET-PAIR-ENERGIES", "CC3 SINGLET PAIR ENERGIES"], [1776, 9, 1, "psivar-CC3-TOTAL-ENERGY", "CC3 TOTAL ENERGY"], [1776, 9, 1, "psivar-CC3-TRIPLET-PAIR-ENERGIES", "CC3 TRIPLET PAIR ENERGIES"], [1776, 9, 1, "psivar-CC4-CORRELATION-ENERGY", "CC4 CORRELATION ENERGY"], [1776, 9, 1, "psivar-CC4-TOTAL-ENERGY", "CC4 TOTAL ENERGY"], [1776, 9, 1, "psivar-CCD-CORRELATION-ENERGY", "CCD CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCD-DOUBLES-ENERGY", "CCD DOUBLES ENERGY"], [1776, 9, 1, "psivar-CCD-OPPOSITE-SPIN-CORRELATION-ENERGY", "CCD OPPOSITE-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCD-SAME-SPIN-CORRELATION-ENERGY", "CCD SAME-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCD-SINGLES-ENERGY", "CCD SINGLES ENERGY"], [1776, 9, 1, "psivar-CCD-TOTAL-ENERGY", "CCD TOTAL ENERGY"], [1776, 9, 1, "psivar-CCSD-ALPHA-ALPHA-PAIR-ENERGIES", "CCSD ALPHA-ALPHA PAIR ENERGIES"], [1776, 9, 1, "psivar-CCSD-ALPHA-BETA-PAIR-ENERGIES", "CCSD ALPHA-BETA PAIR ENERGIES"], [1776, 9, 1, "psivar-CCSD-CORRELATION-ENERGY", "CCSD CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCSD-DIPOLE-POLARIZABILITY-xNM", "CCSD DIPOLE POLARIZABILITY @ xNM"], [1776, 9, 1, "psivar-CCSD-DIPOLE-POLARIZABILITY-TENSOR-xNM", "CCSD DIPOLE POLARIZABILITY TENSOR @ xNM"], [1776, 9, 1, "psivar-CCSD-DOUBLES-ENERGY", "CCSD DOUBLES ENERGY"], [1776, 9, 1, "psivar-CCSD-ITERATIONS", "CCSD ITERATIONS"], [1776, 9, 1, "psivar-CCSD-OPPOSITE-SPIN-CORRELATION-ENERGY", "CCSD OPPOSITE-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCSD-QUADRUPOLE-POLARIZABILITY-xNM", "CCSD QUADRUPOLE POLARIZABILITY @ xNM"], [1776, 9, 1, "psivar-CCSD-QUADRUPOLE-POLARIZABILITY-TENSOR-xNM", "CCSD QUADRUPOLE POLARIZABILITY TENSOR @ xNM"], [1776, 9, 1, "psivar-CCSD-ROTATION-LEN-ORIGIN-DEPENDENCE-xNM", "CCSD ROTATION (LEN) ORIGIN-DEPENDENCE @ xNM"], [1776, 9, 1, "psivar-CCSD-SAME-SPIN-CORRELATION-ENERGY", "CCSD SAME-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCSD-SINGLES-ENERGY", "CCSD SINGLES ENERGY"], [1776, 9, 1, "psivar-CCSD-SINGLET-PAIR-ENERGIES", "CCSD SINGLET PAIR ENERGIES"], [1776, 9, 1, "psivar-CCSD-SPECIFIC-ROTATION-LEN-xNM", "CCSD SPECIFIC ROTATION (LEN) @ xNM"], [1776, 9, 1, "psivar-CCSD-SPECIFIC-ROTATION-MVG-xNM", "CCSD SPECIFIC ROTATION (MVG) @ xNM"], [1776, 9, 1, "psivar-CCSD-SPECIFIC-ROTATION-VEL-xNM", "CCSD SPECIFIC ROTATION (VEL) @ xNM"], [1776, 9, 1, "psivar-CCSD-TOTAL-ENERGY", "CCSD TOTAL ENERGY"], [1776, 9, 1, "psivar-CCSD-TRIPLET-PAIR-ENERGIES", "CCSD TRIPLET PAIR ENERGIES"], [1776, 9, 1, "psivar-CCSD-AT-CORRELATION-ENERGY", "CCSD(AT) CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCSD-AT-TOTAL-ENERGY", "CCSD(AT) TOTAL ENERGY"], [1776, 9, 1, "psivar-CCSD-T-CORRELATION-ENERGY", "CCSD(T) CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCSD-T-TOTAL-ENERGY", "CCSD(T) TOTAL ENERGY"], [1776, 9, 1, "psivar-CCSD-T-_L-CORRELATION-ENERGY", "CCSD(T)_L CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCSD-T-_L-TOTAL-ENERGY", "CCSD(T)_L TOTAL ENERGY"], [1776, 9, 1, "psivar-CCSDT-CORRELATION-ENERGY", "CCSDT CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCSDT-TOTAL-ENERGY", "CCSDT TOTAL ENERGY"], [1776, 9, 1, "psivar-CCSDT-Q-CORRELATION-ENERGY", "CCSDT(Q) CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCSDT-Q-TOTAL-ENERGY", "CCSDT(Q) TOTAL ENERGY"], [1776, 9, 1, "psivar-CCSDT-Q-A-CORRELATION-ENERGY", "CCSDT(Q)/A CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCSDT-Q-A-TOTAL-ENERGY", "CCSDT(Q)/A TOTAL ENERGY"], [1776, 9, 1, "psivar-CCSDT-Q-B-CORRELATION-ENERGY", "CCSDT(Q)/B CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCSDT-Q-B-TOTAL-ENERGY", "CCSDT(Q)/B TOTAL ENERGY"], [1776, 9, 1, "psivar-CCSDT-Q-_L-CORRELATION-ENERGY", "CCSDT(Q)_L CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCSDT-Q-_L-TOTAL-ENERGY", "CCSDT(Q)_L TOTAL ENERGY"], [1776, 9, 1, "psivar-CCSDT-1a-CORRELATION-ENERGY", "CCSDT-1a CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCSDT-1a-TOTAL-ENERGY", "CCSDT-1a TOTAL ENERGY"], [1776, 9, 1, "psivar-CCSDT-1b-CORRELATION-ENERGY", "CCSDT-1b CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCSDT-1b-TOTAL-ENERGY", "CCSDT-1b TOTAL ENERGY"], [1776, 9, 1, "psivar-CCSDT-3-CORRELATION-ENERGY", "CCSDT-3 CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCSDT-3-TOTAL-ENERGY", "CCSDT-3 TOTAL ENERGY"], [1776, 9, 1, "psivar-CCSDTQ-CORRELATION-ENERGY", "CCSDTQ CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCSDTQ-TOTAL-ENERGY", "CCSDTQ TOTAL ENERGY"], [1776, 9, 1, "psivar-CCSDTQ-1a-CORRELATION-ENERGY", "CCSDTQ-1a CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCSDTQ-1a-TOTAL-ENERGY", "CCSDTQ-1a TOTAL ENERGY"], [1776, 9, 1, "psivar-CCSDTQ-1b-CORRELATION-ENERGY", "CCSDTQ-1b CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCSDTQ-1b-TOTAL-ENERGY", "CCSDTQ-1b TOTAL ENERGY"], [1776, 9, 1, "psivar-CCSDTQ-3-CORRELATION-ENERGY", "CCSDTQ-3 CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCSDTQ-3-TOTAL-ENERGY", "CCSDTQ-3 TOTAL ENERGY"], [1776, 9, 1, "psivar-CCn-CORRELATION-ENERGY", "CCn CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCn-TOTAL-ENERGY", "CCn TOTAL ENERGY"], [1776, 9, 1, "psivar-CCn-1a-CORRELATION-ENERGY", "CCn-1a CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCn-1a-TOTAL-ENERGY", "CCn-1a TOTAL ENERGY"], [1776, 9, 1, "psivar-CCn-1b-CORRELATION-ENERGY", "CCn-1b CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCn-1b-TOTAL-ENERGY", "CCn-1b TOTAL ENERGY"], [1776, 9, 1, "psivar-CCn-3-CORRELATION-ENERGY", "CCn-3 CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCn-3-TOTAL-ENERGY", "CCn-3 TOTAL ENERGY"], [1776, 9, 1, "psivar-CCname-ROOT-m-IN-h-ROOT-n-IN-i-EINSTEIN-A-LEN", "CCname ROOT m (IN h) -&gt; ROOT n (IN i) EINSTEIN A (LEN)"], [1776, 9, 1, "psivar-CCname-ROOT-m-IN-h-ROOT-n-IN-i-EINSTEIN-B-LEN", "CCname ROOT m (IN h) -&gt; ROOT n (IN i) EINSTEIN B (LEN)"], [1776, 9, 1, "psivar-CCname-ROOT-m-IN-h-ROOT-n-IN-i-OSCILLATOR-STRENGTH-LEN", "CCname ROOT m (IN h) -&gt; ROOT n (IN i) OSCILLATOR STRENGTH (LEN)"], [1776, 9, 1, "psivar-CCname-ROOT-m-IN-h-ROOT-n-IN-i-ROTATORY-STRENGTH-LEN", "CCname ROOT m (IN h) -&gt; ROOT n (IN i) ROTATORY STRENGTH (LEN)"], [1776, 9, 1, "psivar-CCname-ROOT-m-IN-h-ROOT-n-IN-i-ROTATORY-STRENGTH-VEL", "CCname ROOT m (IN h) -&gt; ROOT n (IN i) ROTATORY STRENGTH (VEL)"], [1776, 9, 1, "psivar-CCname-ROOT-m-h-ROOT-n-i-EINSTEIN-A-LEN", "CCname ROOT m (h) -&gt; ROOT n (i) EINSTEIN A (LEN)"], [1776, 9, 1, "psivar-CCname-ROOT-m-h-ROOT-n-i-EINSTEIN-B-LEN", "CCname ROOT m (h) -&gt; ROOT n (i) EINSTEIN B (LEN)"], [1776, 9, 1, "psivar-CCname-ROOT-m-h-ROOT-n-i-OSCILLATOR-STRENGTH-LEN", "CCname ROOT m (h) -&gt; ROOT n (i) OSCILLATOR STRENGTH (LEN)"], [1776, 9, 1, "psivar-CCname-ROOT-m-h-ROOT-n-i-ROTATORY-STRENGTH-LEN", "CCname ROOT m (h) -&gt; ROOT n (i) ROTATORY STRENGTH (LEN)"], [1776, 9, 1, "psivar-CCname-ROOT-m-h-ROOT-n-i-ROTATORY-STRENGTH-VEL", "CCname ROOT m (h) -&gt; ROOT n (i) ROTATORY STRENGTH (VEL)"], [1776, 9, 1, "psivar-CCname-ROOT-m-ROOT-n-EINSTEIN-A-LEN", "CCname ROOT m -&gt; ROOT n EINSTEIN A (LEN)"], [1776, 9, 1, "psivar-CCname-ROOT-m-ROOT-n-EINSTEIN-A-LEN-h-TRANSITION", "CCname ROOT m -&gt; ROOT n EINSTEIN A (LEN) - h TRANSITION"], [1776, 9, 1, "psivar-CCname-ROOT-m-ROOT-n-EINSTEIN-B-LEN", "CCname ROOT m -&gt; ROOT n EINSTEIN B (LEN)"], [1776, 9, 1, "psivar-CCname-ROOT-m-ROOT-n-EINSTEIN-B-LEN-h-TRANSITION", "CCname ROOT m -&gt; ROOT n EINSTEIN B (LEN) - h TRANSITION"], [1776, 9, 1, "psivar-CCname-ROOT-m-ROOT-n-OSCILLATOR-STRENGTH-LEN", "CCname ROOT m -&gt; ROOT n OSCILLATOR STRENGTH (LEN)"], [1776, 9, 1, "psivar-CCname-ROOT-m-ROOT-n-OSCILLATOR-STRENGTH-LEN-h-TRANSITION", "CCname ROOT m -&gt; ROOT n OSCILLATOR STRENGTH (LEN) - h TRANSITION"], [1776, 9, 1, "psivar-CCname-ROOT-m-ROOT-n-ROTATORY-STRENGTH-LEN", "CCname ROOT m -&gt; ROOT n ROTATORY STRENGTH (LEN)"], [1776, 9, 1, "psivar-CCname-ROOT-m-ROOT-n-ROTATORY-STRENGTH-LEN-h-TRANSITION", "CCname ROOT m -&gt; ROOT n ROTATORY STRENGTH (LEN) - h TRANSITION"], [1776, 9, 1, "psivar-CCname-ROOT-m-ROOT-n-ROTATORY-STRENGTH-VEL", "CCname ROOT m -&gt; ROOT n ROTATORY STRENGTH (VEL)"], [1776, 9, 1, "psivar-CCname-ROOT-m-ROOT-n-ROTATORY-STRENGTH-VEL-h-TRANSITION", "CCname ROOT m -&gt; ROOT n ROTATORY STRENGTH (VEL) - h TRANSITION"], [1776, 9, 1, "psivar-CCname-ROOT-n-IN-h-CORRELATION-ENERGY", "CCname ROOT n (IN h) CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCname-ROOT-n-IN-h-DIPOLE", "CCname ROOT n (IN h) DIPOLE"], [1776, 9, 1, "psivar-CCname-ROOT-n-IN-h-QUADRUPOLE", "CCname ROOT n (IN h) QUADRUPOLE"], [1776, 9, 1, "psivar-CCname-ROOT-n-IN-h-TOTAL-ENERGY", "CCname ROOT n (IN h) TOTAL ENERGY"], [1776, 9, 1, "psivar-CCname-ROOT-n-h-CORRELATION-ENERGY", "CCname ROOT n (h) CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCname-ROOT-n-h-DIPOLE", "CCname ROOT n (h) DIPOLE"], [1776, 9, 1, "psivar-CCname-ROOT-n-h-QUADRUPOLE", "CCname ROOT n (h) QUADRUPOLE"], [1776, 9, 1, "psivar-CCname-ROOT-n-h-TOTAL-ENERGY", "CCname ROOT n (h) TOTAL ENERGY"], [1776, 9, 1, "psivar-CCname-ROOT-n-CORRELATION-ENERGY", "CCname ROOT n CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCname-ROOT-n-CORRELATION-ENERGY-h-TRANSITION", "CCname ROOT n CORRELATION ENERGY - h TRANSITION"], [1776, 9, 1, "psivar-CCname-ROOT-n-DIPOLE", "CCname ROOT n DIPOLE"], [1776, 9, 1, "psivar-CCname-ROOT-n-DIPOLE-h-TRANSITION", "CCname ROOT n DIPOLE - h TRANSITION"], [1776, 9, 1, "psivar-CCname-ROOT-n-QUADRUPOLE", "CCname ROOT n QUADRUPOLE"], [1776, 9, 1, "psivar-CCname-ROOT-n-QUADRUPOLE-h-TRANSITION", "CCname ROOT n QUADRUPOLE - h TRANSITION"], [1776, 9, 1, "psivar-CCname-ROOT-n-TOTAL-ENERGY", "CCname ROOT n TOTAL ENERGY"], [1776, 9, 1, "psivar-CCname-ROOT-n-TOTAL-ENERGY-h-TRANSITION", "CCname ROOT n TOTAL ENERGY - h TRANSITION"], [1776, 9, 1, "psivar-CCnn-CORRELATION-ENERGY", "CCnn CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCnn-TOTAL-ENERGY", "CCnn TOTAL ENERGY"], [1776, 9, 1, "psivar-CEPA-0-CORRELATION-ENERGY", "CEPA(0) CORRELATION ENERGY"], [1776, 9, 1, "psivar-CEPA-0-DIPOLE", "CEPA(0) DIPOLE"], [1776, 9, 1, "psivar-CEPA-0-DOUBLES-ENERGY", "CEPA(0) DOUBLES ENERGY"], [1776, 9, 1, "psivar-CEPA-0-OPPOSITE-SPIN-CORRELATION-ENERGY", "CEPA(0) OPPOSITE-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-CEPA-0-QUADRUPOLE", "CEPA(0) QUADRUPOLE"], [1776, 9, 1, "psivar-CEPA-0-SAME-SPIN-CORRELATION-ENERGY", "CEPA(0) SAME-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-CEPA-0-SINGLES-ENERGY", "CEPA(0) SINGLES ENERGY"], [1776, 9, 1, "psivar-CEPA-0-TOTAL-ENERGY", "CEPA(0) TOTAL ENERGY"], [1776, 9, 1, "psivar-CEPA-1-CORRELATION-ENERGY", "CEPA(1) CORRELATION ENERGY"], [1776, 9, 1, "psivar-CEPA-1-DOUBLES-ENERGY", "CEPA(1) DOUBLES ENERGY"], [1776, 9, 1, "psivar-CEPA-1-OPPOSITE-SPIN-CORRELATION-ENERGY", "CEPA(1) OPPOSITE-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-CEPA-1-SAME-SPIN-CORRELATION-ENERGY", "CEPA(1) SAME-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-CEPA-1-SINGLES-ENERGY", "CEPA(1) SINGLES ENERGY"], [1776, 9, 1, "psivar-CEPA-1-TOTAL-ENERGY", "CEPA(1) TOTAL ENERGY"], [1776, 9, 1, "psivar-CEPA-2-CORRELATION-ENERGY", "CEPA(2) CORRELATION ENERGY"], [1776, 9, 1, "psivar-CEPA-2-DOUBLES-ENERGY", "CEPA(2) DOUBLES ENERGY"], [1776, 9, 1, "psivar-CEPA-2-OPPOSITE-SPIN-CORRELATION-ENERGY", "CEPA(2) OPPOSITE-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-CEPA-2-SAME-SPIN-CORRELATION-ENERGY", "CEPA(2) SAME-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-CEPA-2-SINGLES-ENERGY", "CEPA(2) SINGLES ENERGY"], [1776, 9, 1, "psivar-CEPA-2-TOTAL-ENERGY", "CEPA(2) TOTAL ENERGY"], [1776, 9, 1, "psivar-CEPA-3-CORRELATION-ENERGY", "CEPA(3) CORRELATION ENERGY"], [1776, 9, 1, "psivar-CEPA-3-DOUBLES-ENERGY", "CEPA(3) DOUBLES ENERGY"], [1776, 9, 1, "psivar-CEPA-3-OPPOSITE-SPIN-CORRELATION-ENERGY", "CEPA(3) OPPOSITE-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-CEPA-3-SAME-SPIN-CORRELATION-ENERGY", "CEPA(3) SAME-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-CEPA-3-SINGLES-ENERGY", "CEPA(3) SINGLES ENERGY"], [1776, 9, 1, "psivar-CEPA-3-TOTAL-ENERGY", "CEPA(3) TOTAL ENERGY"], [1776, 9, 1, "psivar-CFOUR-ERROR-CODE", "CFOUR ERROR CODE"], [1776, 9, 1, "psivar-CI-CORRELATION-ENERGY", "CI CORRELATION ENERGY"], [1776, 9, 1, "psivar-CI-DIPOLE", "CI DIPOLE"], [1776, 9, 1, "psivar-CI-QUADRUPOLE", "CI QUADRUPOLE"], [1776, 9, 1, "psivar-CI-ROOT-n-ROOT-m-DIPOLE", "CI ROOT n -&gt; ROOT m DIPOLE"], [1776, 9, 1, "psivar-CI-ROOT-n-ROOT-m-QUADRUPOLE", "CI ROOT n -&gt; ROOT m QUADRUPOLE"], [1776, 9, 1, "psivar-CI-ROOT-n-CORRELATION-ENERGY", "CI ROOT n CORRELATION ENERGY"], [1776, 9, 1, "psivar-CI-ROOT-n-DIPOLE", "CI ROOT n DIPOLE"], [1776, 9, 1, "psivar-CI-ROOT-n-QUADRUPOLE", "CI ROOT n QUADRUPOLE"], [1776, 9, 1, "psivar-CI-ROOT-n-TOTAL-ENERGY", "CI ROOT n TOTAL ENERGY"], [1776, 9, 1, "psivar-CI-STATE-AVERAGED-CORRELATION-ENERGY", "CI STATE-AVERAGED CORRELATION ENERGY"], [1776, 9, 1, "psivar-CI-STATE-AVERAGED-TOTAL-ENERGY", "CI STATE-AVERAGED TOTAL ENERGY"], [1776, 9, 1, "psivar-CI-TOTAL-ENERGY", "CI TOTAL ENERGY"], [1776, 9, 1, "psivar-CISD-CORRELATION-ENERGY", "CISD CORRELATION ENERGY"], [1776, 9, 1, "psivar-CISD-DIPOLE", "CISD DIPOLE"], [1776, 9, 1, "psivar-CISD-DOUBLES-ENERGY", "CISD DOUBLES ENERGY"], [1776, 9, 1, "psivar-CISD-OPPOSITE-SPIN-CORRELATION-ENERGY", "CISD OPPOSITE-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-CISD-QUADRUPOLE", "CISD QUADRUPOLE"], [1776, 9, 1, "psivar-CISD-SAME-SPIN-CORRELATION-ENERGY", "CISD SAME-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-CISD-SINGLES-ENERGY", "CISD SINGLES ENERGY"], [1776, 9, 1, "psivar-CISD-TOTAL-ENERGY", "CISD TOTAL ENERGY"], [1776, 9, 1, "psivar-CISDT-CORRELATION-ENERGY", "CISDT CORRELATION ENERGY"], [1776, 9, 1, "psivar-CISDT-TOTAL-ENERGY", "CISDT TOTAL ENERGY"], [1776, 9, 1, "psivar-CISDTQ-CORRELATION-ENERGY", "CISDTQ CORRELATION ENERGY"], [1776, 9, 1, "psivar-CISDTQ-TOTAL-ENERGY", "CISDTQ TOTAL ENERGY"], [1776, 9, 1, "psivar-CIn-CORRELATION-ENERGY", "CIn CORRELATION ENERGY"], [1776, 9, 1, "psivar-CIn-TOTAL-ENERGY", "CIn TOTAL ENERGY"], [1767, 10, 1, "-", "CONDA_PREFIX"], [1776, 9, 1, "psivar-CP-CORRECTED-2-BODY-INTERACTION-ENERGY", "CP-CORRECTED 2-BODY INTERACTION ENERGY"], [1738, 10, 1, "-", "CRAYPE_LINK_TYPE"], [1738, 10, 1, "-", "CRAY_ADD_RPATH"], [1776, 9, 1, "psivar-CURRENT-CORRELATION-ENERGY", "CURRENT CORRELATION ENERGY"], [1776, 9, 1, "psivar-CURRENT-DIPOLE", "CURRENT DIPOLE"], [1776, 9, 1, "psivar-CURRENT-DIPOLE-GRADIENT", "CURRENT DIPOLE GRADIENT"], [1776, 9, 1, "psivar-CURRENT-ENERGY", "CURRENT ENERGY"], [1776, 9, 1, "psivar-CURRENT-GRADIENT", "CURRENT GRADIENT"], [1776, 9, 1, "psivar-CURRENT-HESSIAN", "CURRENT HESSIAN"], [1776, 9, 1, "psivar-CURRENT-REFERENCE-ENERGY", "CURRENT REFERENCE ENERGY"], [1776, 9, 1, "psivar-CUSTOM-SCS-LCCD-CORRELATION-ENERGY", "CUSTOM SCS-LCCD CORRELATION ENERGY"], [1776, 9, 1, "psivar-CUSTOM-SCS-LCCD-TOTAL-ENERGY", "CUSTOM SCS-LCCD TOTAL ENERGY"], [1776, 9, 1, "psivar-CUSTOM-SCS-MP2-CORRELATION-ENERGY", "CUSTOM SCS-MP2 CORRELATION ENERGY"], [1776, 9, 1, "psivar-CUSTOM-SCS-MP2-TOTAL-ENERGY", "CUSTOM SCS-MP2 TOTAL ENERGY"], [1776, 9, 1, "psivar-CUSTOM-SCS-MP3-CORRELATION-ENERGY", "CUSTOM SCS-MP3 CORRELATION ENERGY"], [1776, 9, 1, "psivar-CUSTOM-SCS-MP3-TOTAL-ENERGY", "CUSTOM SCS-MP3 TOTAL ENERGY"], [1776, 9, 1, "psivar-CUSTOM-SCS-OLCCD-CORRELATION-ENERGY", "CUSTOM SCS-OLCCD CORRELATION ENERGY"], [1776, 9, 1, "psivar-CUSTOM-SCS-OLCCD-TOTAL-ENERGY", "CUSTOM SCS-OLCCD TOTAL ENERGY"], [1776, 9, 1, "psivar-CUSTOM-SCS-OMP2-CORRELATION-ENERGY", "CUSTOM SCS-OMP2 CORRELATION ENERGY"], [1776, 9, 1, "psivar-CUSTOM-SCS-OMP2-TOTAL-ENERGY", "CUSTOM SCS-OMP2 TOTAL ENERGY"], [1776, 9, 1, "psivar-CUSTOM-SCS-OMP3-CORRELATION-ENERGY", "CUSTOM SCS-OMP3 CORRELATION ENERGY"], [1776, 9, 1, "psivar-CUSTOM-SCS-OMP3-TOTAL-ENERGY", "CUSTOM SCS-OMP3 TOTAL ENERGY"], [1776, 9, 1, "psivar-CUSTOM-SCS-OREMP2-CORRELATION-ENERGY", "CUSTOM SCS-OREMP2 CORRELATION ENERGY"], [1776, 9, 1, "psivar-CUSTOM-SCS-OREMP2-TOTAL-ENERGY", "CUSTOM SCS-OREMP2 TOTAL ENERGY"], [1776, 9, 1, "psivar-CUSTOM-SCS-REMP2-CORRELATION-ENERGY", "CUSTOM SCS-REMP2 CORRELATION ENERGY"], [1776, 9, 1, "psivar-CUSTOM-SCS-REMP2-TOTAL-ENERGY", "CUSTOM SCS-REMP2 TOTAL ENERGY"], [1776, 9, 1, "psivar-DCT-LAMBDA-ENERGY", "DCT LAMBDA ENERGY"], [1776, 9, 1, "psivar-DCT-SCF-ENERGY", "DCT SCF ENERGY"], [1776, 9, 1, "psivar-DCT-THREE-PARTICLE-ENERGY", "DCT THREE-PARTICLE ENERGY"], [1776, 9, 1, "psivar-DCT-TOTAL-ENERGY", "DCT TOTAL ENERGY"], [1776, 9, 1, "psivar-DD-SOLVATION-ENERGY", "DD SOLVATION ENERGY"], [1776, 9, 1, "psivar-DETCI-AVG-DVEC-NORM", "DETCI AVG DVEC NORM"], [1776, 9, 1, "psivar-DFT-DIPOLE-GRADIENT", "DFT DIPOLE GRADIENT"], [1776, 9, 1, "psivar-DFT-FUNCTIONAL-TOTAL-ENERGY", "DFT FUNCTIONAL TOTAL ENERGY"], [1776, 9, 1, "psivar-DFT-TOTAL-ENERGY", "DFT TOTAL ENERGY"], [1776, 9, 1, "psivar-DFT-TOTAL-GRADIENT", "DFT TOTAL GRADIENT"], [1776, 9, 1, "psivar-DFT-TOTAL-HESSIAN", "DFT TOTAL HESSIAN"], [1776, 9, 1, "psivar-DFT-VV10-ENERGY", "DFT VV10 ENERGY"], [1776, 9, 1, "psivar-DFT-XC-ENERGY", "DFT XC ENERGY"], [1776, 9, 1, "psivar-DISPERSION-CORRECTION-ENERGY", "DISPERSION CORRECTION ENERGY"], [1776, 9, 1, "psivar-DMA-DISTRIBUTED-MULTIPOLES", "DMA DISTRIBUTED MULTIPOLES"], [1776, 9, 1, "psivar-DMA-TOTAL-MULTIPOLES", "DMA TOTAL MULTIPOLES"], [1776, 9, 1, "psivar-DMRG-CASPT2-TOTAL-ENERGY", "DMRG-CASPT2 TOTAL ENERGY"], [1776, 9, 1, "psivar-DMRG-SCF-TOTAL-ENERGY", "DMRG-SCF TOTAL ENERGY"], [1776, 9, 1, "psivar-DOUBLE-HYBRID-CORRECTION-ENERGY", "DOUBLE-HYBRID CORRECTION ENERGY"], [1776, 9, 1, "psivar-EFP-DISP-ENERGY", "EFP DISP ENERGY"], [1776, 9, 1, "psivar-EFP-ELST-ENERGY", "EFP ELST ENERGY"], [1776, 9, 1, "psivar-EFP-EXCH-ENERGY", "EFP EXCH ENERGY"], [1776, 9, 1, "psivar-EFP-IND-ENERGY", "EFP IND ENERGY"], [1776, 9, 1, "psivar-EFP-TORQUE", "EFP TORQUE"], [1776, 9, 1, "psivar-EFP-TOTAL-ENERGY", "EFP TOTAL ENERGY"], [1776, 9, 1, "-", "ENTHALPY"], [1776, 9, 1, "psivar-ENTHALPY-CORRECTION", "ENTHALPY CORRECTION"], [1776, 9, 1, "psivar-ESP-AT-CENTER-n", "ESP AT CENTER n"], [1776, 9, 1, "psivar-FCI-CORRELATION-ENERGY", "FCI CORRELATION ENERGY"], [1776, 9, 1, "psivar-FCI-TOTAL-ENERGY", "FCI TOTAL ENERGY"], [1776, 9, 1, "psivar-FINDIF-NUMBER", "FINDIF NUMBER"], [1776, 9, 1, "psivar-GIBBS-FREE-ENERGY", "GIBBS FREE ENERGY"], [1776, 9, 1, "psivar-GIBBS-FREE-ENERGY-CORRECTION", "GIBBS FREE ENERGY CORRECTION"], [1776, 9, 1, "psivar-GRID-ELECTRONS-ALPHA", "GRID ELECTRONS ALPHA"], [1776, 9, 1, "psivar-GRID-ELECTRONS-BETA", "GRID ELECTRONS BETA"], [1776, 9, 1, "psivar-GRID-ELECTRONS-TOTAL", "GRID ELECTRONS TOTAL"], [1776, 9, 1, "psivar-HF-DIPOLE-GRADIENT", "HF DIPOLE GRADIENT"], [1776, 9, 1, "psivar-HF-KINETIC-ENERGY", "HF KINETIC ENERGY"], [1776, 9, 1, "psivar-HF-POTENTIAL-ENERGY", "HF POTENTIAL ENERGY"], [1776, 9, 1, "psivar-HF-TOTAL-ENERGY", "HF TOTAL ENERGY"], [1776, 9, 1, "psivar-HF-TOTAL-GRADIENT", "HF TOTAL GRADIENT"], [1776, 9, 1, "psivar-HF-TOTAL-HESSIAN", "HF TOTAL HESSIAN"], [1776, 9, 1, "psivar-HF-VIRIAL-RATIO", "HF VIRIAL RATIO"], [1767, 10, 1, "-", "HOST"], [1776, 9, 1, "psivar-LCC2-LMP2-TOTAL-ENERGY", "LCC2 (+LMP2) TOTAL ENERGY"], [1776, 9, 1, "psivar-LCCD-CORRELATION-ENERGY", "LCCD CORRELATION ENERGY"], [1776, 9, 1, "psivar-LCCD-DOUBLES-ENERGY", "LCCD DOUBLES ENERGY"], [1776, 9, 1, "psivar-LCCD-OPPOSITE-SPIN-CORRELATION-ENERGY", "LCCD OPPOSITE-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-LCCD-SAME-SPIN-CORRELATION-ENERGY", "LCCD SAME-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-LCCD-SINGLES-ENERGY", "LCCD SINGLES ENERGY"], [1776, 9, 1, "psivar-LCCD-TOTAL-ENERGY", "LCCD TOTAL ENERGY"], [1776, 9, 1, "psivar-LCCSD-LMP2-TOTAL-ENERGY", "LCCSD (+LMP2) TOTAL ENERGY"], [1776, 9, 1, "psivar-LCCSD-CORRELATION-ENERGY", "LCCSD CORRELATION ENERGY"], [1776, 9, 1, "psivar-LCCSD-DOUBLES-ENERGY", "LCCSD DOUBLES ENERGY"], [1776, 9, 1, "psivar-LCCSD-OPPOSITE-SPIN-CORRELATION-ENERGY", "LCCSD OPPOSITE-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-LCCSD-SAME-SPIN-CORRELATION-ENERGY", "LCCSD SAME-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-LCCSD-SINGLES-ENERGY", "LCCSD SINGLES ENERGY"], [1776, 9, 1, "psivar-LCCSD-TOTAL-ENERGY", "LCCSD TOTAL ENERGY"], [1776, 9, 1, "psivar-LEFT-RIGHT-CC2-EIGENVECTOR-OVERLAP", "LEFT-RIGHT CC2 EIGENVECTOR OVERLAP"], [1776, 9, 1, "psivar-LEFT-RIGHT-CC3-EIGENVECTOR-OVERLAP", "LEFT-RIGHT CC3 EIGENVECTOR OVERLAP"], [1776, 9, 1, "psivar-LEFT-RIGHT-CCSD-EIGENVECTOR-OVERLAP", "LEFT-RIGHT CCSD EIGENVECTOR OVERLAP"], [1776, 9, 1, "psivar-LEFT-RIGHT-CCSD-T-EIGENVECTOR-OVERLAP", "LEFT-RIGHT CCSD(T) EIGENVECTOR OVERLAP"], [1776, 9, 1, "psivar-LOWDIN-CHARGES", "LOWDIN CHARGES"], [1738, 10, 1, "-", "MATH_ROOT"], [1776, 9, 1, "psivar-MAYER-INDICES", "MAYER INDICES"], [1776, 9, 1, "psivar-MBIS-CHARGES", "MBIS CHARGES"], [1776, 9, 1, "psivar-MBIS-DIPOLES", "MBIS DIPOLES"], [1776, 9, 1, "psivar-MBIS-FREE-ATOM-n-VOLUME", "MBIS FREE ATOM n VOLUME"], [1776, 9, 1, "psivar-MBIS-OCTUPOLES", "MBIS OCTUPOLES"], [1776, 9, 1, "psivar-MBIS-QUADRUPOLES", "MBIS QUADRUPOLES"], [1776, 9, 1, "psivar-MBIS-RADIAL-MOMENTS-R-3", "MBIS RADIAL MOMENTS &lt;R^3&gt;"], [1776, 9, 1, "psivar-MBIS-VALENCE-WIDTHS", "MBIS VALENCE WIDTHS"], [1776, 9, 1, "psivar-MBIS-VOLUME-RATIOS", "MBIS VOLUME RATIOS"], [1776, 9, 1, "psivar-MCSCF-TOTAL-ENERGY", "MCSCF TOTAL ENERGY"], [1767, 10, 1, "-", "MKL_NUM_THREADS"], [1738, 10, 1, "-", "MKL_ROOT"], [1750, 10, 1, "-", "MONTAGE"], [1776, 9, 1, "psivar-MP2-ALPHA-ALPHA-PAIR-ENERGIES", "MP2 ALPHA-ALPHA PAIR ENERGIES"], [1776, 9, 1, "psivar-MP2-ALPHA-BETA-PAIR-ENERGIES", "MP2 ALPHA-BETA PAIR ENERGIES"], [1776, 9, 1, "psivar-MP2-CORRELATION-ENERGY", "MP2 CORRELATION ENERGY"], [1776, 9, 1, "psivar-MP2-DIPOLE-GRADIENT", "MP2 DIPOLE GRADIENT"], [1776, 9, 1, "psivar-MP2-DOUBLES-ENERGY", "MP2 DOUBLES ENERGY"], [1776, 9, 1, "psivar-MP2-OPPOSITE-SPIN-CORRELATION-ENERGY", "MP2 OPPOSITE-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-MP2-SAME-SPIN-CORRELATION-ENERGY", "MP2 SAME-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-MP2-SINGLES-ENERGY", "MP2 SINGLES ENERGY"], [1776, 9, 1, "psivar-MP2-SINGLET-PAIR-ENERGIES", "MP2 SINGLET PAIR ENERGIES"], [1776, 9, 1, "psivar-MP2-TOTAL-ENERGY", "MP2 TOTAL ENERGY"], [1776, 9, 1, "psivar-MP2-TOTAL-GRADIENT", "MP2 TOTAL GRADIENT"], [1776, 9, 1, "psivar-MP2-TOTAL-HESSIAN", "MP2 TOTAL HESSIAN"], [1776, 9, 1, "psivar-MP2-TRIPLET-PAIR-ENERGIES", "MP2 TRIPLET PAIR ENERGIES"], [1776, 9, 1, "psivar-MP2-CCSD-TOTAL-ENERGY", "MP2-CCSD TOTAL ENERGY"], [1776, 9, 1, "psivar-MP3-CORRELATION-ENERGY", "MP3 CORRELATION ENERGY"], [1776, 9, 1, "psivar-MP3-DOUBLES-ENERGY", "MP3 DOUBLES ENERGY"], [1776, 9, 1, "psivar-MP3-OPPOSITE-SPIN-CORRELATION-ENERGY", "MP3 OPPOSITE-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-MP3-SAME-SPIN-CORRELATION-ENERGY", "MP3 SAME-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-MP3-SINGLES-ENERGY", "MP3 SINGLES ENERGY"], [1776, 9, 1, "psivar-MP3-TOTAL-ENERGY", "MP3 TOTAL ENERGY"], [1776, 9, 1, "psivar-MP4-CORRELATION-ENERGY", "MP4 CORRELATION ENERGY"], [1776, 9, 1, "psivar-MP4-TOTAL-ENERGY", "MP4 TOTAL ENERGY"], [1776, 9, 1, "psivar-MP4-SDQ-CORRELATION-ENERGY", "MP4(SDQ) CORRELATION ENERGY"], [1776, 9, 1, "psivar-MP4-SDQ-TOTAL-ENERGY", "MP4(SDQ) TOTAL ENERGY"], [1776, 9, 1, "psivar-MP4-SDTQ-CORRELATION-ENERGY", "MP4(SDTQ) CORRELATION ENERGY"], [1776, 9, 1, "psivar-MP4-SDTQ-TOTAL-ENERGY", "MP4(SDTQ) TOTAL ENERGY"], [1776, 9, 1, "psivar-MP4-T-CORRECTION-ENERGY", "MP4(T) CORRECTION ENERGY"], [1776, 9, 1, "psivar-MPn-CORRELATION-ENERGY", "MPn CORRELATION ENERGY"], [1776, 9, 1, "psivar-MPn-TOTAL-ENERGY", "MPn TOTAL ENERGY"], [1776, 9, 1, "psivar-MRCC-TOTAL-ENERGY", "MRCC TOTAL ENERGY"], [1776, 9, 1, "psivar-MRPT-TOTAL-ENERGY", "MRPT TOTAL ENERGY"], [1776, 9, 1, "psivar-MULLIKEN-CHARGES", "MULLIKEN CHARGES"], [1776, 9, 1, "psivar-NAUX-CC", "NAUX (CC)"], [1776, 9, 1, "psivar-NAUX-SCF", "NAUX (SCF)"], [1776, 9, 1, "psivar-NBODY-NUMBER", "NBODY NUMBER"], [1776, 9, 1, "psivar-NUCLEAR-REPULSION-ENERGY", "NUCLEAR REPULSION ENERGY"], [1776, 9, 1, "psivar-OCEPA-0-CORRELATION-ENERGY", "OCEPA(0) CORRELATION ENERGY"], [1776, 9, 1, "psivar-OCEPA-0-TOTAL-ENERGY", "OCEPA(0) TOTAL ENERGY"], [1776, 9, 1, "psivar-OLCCD-CORRELATION-ENERGY", "OLCCD CORRELATION ENERGY"], [1776, 9, 1, "psivar-OLCCD-DOUBLES-ENERGY", "OLCCD DOUBLES ENERGY"], [1776, 9, 1, "psivar-OLCCD-OPPOSITE-SPIN-CORRELATION-ENERGY", "OLCCD OPPOSITE-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-OLCCD-REFERENCE-CORRECTION-ENERGY", "OLCCD REFERENCE CORRECTION ENERGY"], [1776, 9, 1, "psivar-OLCCD-SAME-SPIN-CORRELATION-ENERGY", "OLCCD SAME-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-OLCCD-SINGLES-ENERGY", "OLCCD SINGLES ENERGY"], [1776, 9, 1, "psivar-OLCCD-TOTAL-ENERGY", "OLCCD TOTAL ENERGY"], [1776, 9, 1, "psivar-OMP2-CORRELATION-ENERGY", "OMP2 CORRELATION ENERGY"], [1776, 9, 1, "psivar-OMP2-DOUBLES-ENERGY", "OMP2 DOUBLES ENERGY"], [1776, 9, 1, "psivar-OMP2-OPPOSITE-SPIN-CORRELATION-ENERGY", "OMP2 OPPOSITE-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-OMP2-REFERENCE-CORRECTION-ENERGY", "OMP2 REFERENCE CORRECTION ENERGY"], [1776, 9, 1, "psivar-OMP2-SAME-SPIN-CORRELATION-ENERGY", "OMP2 SAME-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-OMP2-TOTAL-ENERGY", "OMP2 TOTAL ENERGY"], [1776, 9, 1, "psivar-OMP3-CORRELATION-ENERGY", "OMP3 CORRELATION ENERGY"], [1776, 9, 1, "psivar-OMP3-DOUBLES-ENERGY", "OMP3 DOUBLES ENERGY"], [1776, 9, 1, "psivar-OMP3-OPPOSITE-SPIN-CORRELATION-ENERGY", "OMP3 OPPOSITE-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-OMP3-REFERENCE-CORRECTION-ENERGY", "OMP3 REFERENCE CORRECTION ENERGY"], [1776, 9, 1, "psivar-OMP3-SAME-SPIN-CORRELATION-ENERGY", "OMP3 SAME-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-OMP3-TOTAL-ENERGY", "OMP3 TOTAL ENERGY"], [1767, 10, 1, "-", "OMP_NESTED"], [1767, 10, 1, "-", "OMP_NUM_THREADS"], [1776, 9, 1, "psivar-ONE-ELECTRON-ENERGY", "ONE-ELECTRON ENERGY"], [1776, 9, 1, "psivar-OPTIMIZATION-ITERATIONS", "OPTIMIZATION ITERATIONS"], [1776, 9, 1, "psivar-OREMP2-CORRELATION-ENERGY", "OREMP2 CORRELATION ENERGY"], [1776, 9, 1, "psivar-OREMP2-DOUBLES-ENERGY", "OREMP2 DOUBLES ENERGY"], [1776, 9, 1, "psivar-OREMP2-OPPOSITE-SPIN-CORRELATION-ENERGY", "OREMP2 OPPOSITE-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-OREMP2-REFERENCE-CORRECTION-ENERGY", "OREMP2 REFERENCE CORRECTION ENERGY"], [1776, 9, 1, "psivar-OREMP2-SAME-SPIN-CORRELATION-ENERGY", "OREMP2 SAME-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-OREMP2-SINGLES-ENERGY", "OREMP2 SINGLES ENERGY"], [1776, 9, 1, "psivar-OREMP2-TOTAL-ENERGY", "OREMP2 TOTAL ENERGY"], [1767, 10, 1, "-", "PATH"], [1776, 9, 1, "psivar-PCM-POLARIZATION-ENERGY", "PCM POLARIZATION ENERGY"], [1776, 9, 1, "psivar-PE-ENERGY", "PE ENERGY"], [1767, 10, 1, "-", "PSIDATADIR"], [1767, 10, 1, "-", "PSIPATH"], [1767, 10, 1, "-", "PSI_SCRATCH"], [1767, 10, 1, "-", "PYTHONPATH"], [1776, 9, 1, "psivar-QCISD-CORRELATION-ENERGY", "QCISD CORRELATION ENERGY"], [1776, 9, 1, "psivar-QCISD-DOUBLES-ENERGY", "QCISD DOUBLES ENERGY"], [1776, 9, 1, "psivar-QCISD-OPPOSITE-SPIN-CORRELATION-ENERGY", "QCISD OPPOSITE-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-QCISD-SAME-SPIN-CORRELATION-ENERGY", "QCISD SAME-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-QCISD-SINGLES-ENERGY", "QCISD SINGLES ENERGY"], [1776, 9, 1, "psivar-QCISD-TOTAL-ENERGY", "QCISD TOTAL ENERGY"], [1776, 9, 1, "psivar-QCISD-T-CORRECTION-ENERGY", "QCISD(T) CORRECTION ENERGY"], [1776, 9, 1, "psivar-QCISD-T-CORRELATION-ENERGY", "QCISD(T) CORRELATION ENERGY"], [1776, 9, 1, "psivar-QCISD-T-TOTAL-ENERGY", "QCISD(T) TOTAL ENERGY"], [1776, 9, 1, "psivar-REMP2-CORRELATION-ENERGY", "REMP2 CORRELATION ENERGY"], [1776, 9, 1, "psivar-REMP2-DOUBLES-ENERGY", "REMP2 DOUBLES ENERGY"], [1776, 9, 1, "psivar-REMP2-OPPOSITE-SPIN-CORRELATION-ENERGY", "REMP2 OPPOSITE-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-REMP2-SAME-SPIN-CORRELATION-ENERGY", "REMP2 SAME-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-REMP2-SINGLES-ENERGY", "REMP2 SINGLES ENERGY"], [1776, 9, 1, "psivar-REMP2-TOTAL-ENERGY", "REMP2 TOTAL ENERGY"], [1776, 9, 1, "psivar-SAPT-ALPHA", "SAPT ALPHA"], [1776, 9, 1, "psivar-SAPT-CT-ENERGY", "SAPT CT ENERGY"], [1776, 9, 1, "psivar-SAPT-DISP-ENERGY", "SAPT DISP ENERGY"], [1776, 9, 1, "psivar-SAPT-DISP2-CCD-ENERGY", "SAPT DISP2(CCD) ENERGY"], [1776, 9, 1, "psivar-SAPT-DISP20-ENERGY", "SAPT DISP20 ENERGY"], [1776, 9, 1, "psivar-SAPT-DISP21-ENERGY", "SAPT DISP21 ENERGY"], [1776, 9, 1, "psivar-SAPT-DISP22-S-CCD-ENERGY", "SAPT DISP22(S)(CCD) ENERGY"], [1776, 9, 1, "psivar-SAPT-DISP22-SDQ-ENERGY", "SAPT DISP22(SDQ) ENERGY"], [1776, 9, 1, "psivar-SAPT-DISP22-T-ENERGY", "SAPT DISP22(T) ENERGY"], [1776, 9, 1, "psivar-SAPT-DISP22-T-CCD-ENERGY", "SAPT DISP22(T)(CCD) ENERGY"], [1776, 9, 1, "psivar-SAPT-DISP30-ENERGY", "SAPT DISP30 ENERGY"], [1776, 9, 1, "psivar-SAPT-ELST-ENERGY", "SAPT ELST ENERGY"], [1776, 9, 1, "psivar-SAPT-ELST-EXTERN-EXTERN-ENERGY", "SAPT ELST EXTERN-EXTERN ENERGY"], [1776, 9, 1, "psivar-SAPT-ELST10-R-ENERGY", "SAPT ELST10,R ENERGY"], [1776, 9, 1, "psivar-SAPT-ELST12-R-ENERGY", "SAPT ELST12,R ENERGY"], [1776, 9, 1, "psivar-SAPT-ELST13-R-ENERGY", "SAPT ELST13,R ENERGY"], [1776, 9, 1, "psivar-SAPT-ENERGY", "SAPT ENERGY"], [1776, 9, 1, "psivar-SAPT-EXCH-ENERGY", "SAPT EXCH ENERGY"], [1776, 9, 1, "psivar-SAPT-EXCH-DISP20-ENERGY", "SAPT EXCH-DISP20 ENERGY"], [1776, 9, 1, "psivar-SAPT-EXCH-DISP20-S-INF-ENERGY", "SAPT EXCH-DISP20(S^INF) ENERGY"], [1776, 9, 1, "psivar-SAPT-EXCH-DISP30-ENERGY", "SAPT EXCH-DISP30 ENERGY"], [1776, 9, 1, "psivar-SAPT-EXCH-IND-DISP30-ENERGY", "SAPT EXCH-IND-DISP30 ENERGY"], [1776, 9, 1, "psivar-SAPT-EXCH-IND20-R-ENERGY", "SAPT EXCH-IND20,R ENERGY"], [1776, 9, 1, "psivar-SAPT-EXCH-IND20-U-ENERGY", "SAPT EXCH-IND20,U ENERGY"], [1776, 9, 1, "psivar-SAPT-EXCH-IND22-ENERGY", "SAPT EXCH-IND22 ENERGY"], [1776, 9, 1, "psivar-SAPT-EXCH-IND30-S-INF-ENERGY", "SAPT EXCH-IND30(S^INF) ENERGY"], [1776, 9, 1, "psivar-SAPT-EXCH-IND30-R-ENERGY", "SAPT EXCH-IND30,R ENERGY"], [1776, 9, 1, "psivar-SAPT-EXCH-IND30-R-S-INF-ENERGY", "SAPT EXCH-IND30,R(S^INF) ENERGY"], [1776, 9, 1, "psivar-SAPT-EXCH10-ENERGY", "SAPT EXCH10 ENERGY"], [1776, 9, 1, "psivar-SAPT-EXCH10-S-2-ENERGY", "SAPT EXCH10(S^2) ENERGY"], [1776, 9, 1, "psivar-SAPT-EXCH11-S-2-ENERGY", "SAPT EXCH11(S^2) ENERGY"], [1776, 9, 1, "psivar-SAPT-EXCH12-S-2-ENERGY", "SAPT EXCH12(S^2) ENERGY"], [1776, 9, 1, "psivar-SAPT-HF-TOTAL-ENERGY", "SAPT HF TOTAL ENERGY"], [1776, 9, 1, "psivar-SAPT-HF-2-ENERGY-A-0", "SAPT HF(2) ENERGY A(0)"], [1776, 9, 1, "psivar-SAPT-HF-2-ENERGY-A-HF", "SAPT HF(2) ENERGY A(HF)"], [1776, 9, 1, "psivar-SAPT-HF-2-ENERGY-AB-HF", "SAPT HF(2) ENERGY AB(HF)"], [1776, 9, 1, "psivar-SAPT-HF-2-ENERGY-ABC-HF", "SAPT HF(2) ENERGY ABC(HF)"], [1776, 9, 1, "psivar-SAPT-HF-2-ENERGY-AC-0", "SAPT HF(2) ENERGY AC(0)"], [1776, 9, 1, "psivar-SAPT-HF-2-ENERGY-AC-HF", "SAPT HF(2) ENERGY AC(HF)"], [1776, 9, 1, "psivar-SAPT-HF-2-ENERGY-B-0", "SAPT HF(2) ENERGY B(0)"], [1776, 9, 1, "psivar-SAPT-HF-2-ENERGY-B-HF", "SAPT HF(2) ENERGY B(HF)"], [1776, 9, 1, "psivar-SAPT-HF-2-ENERGY-BC-0", "SAPT HF(2) ENERGY BC(0)"], [1776, 9, 1, "psivar-SAPT-HF-2-ENERGY-BC-HF", "SAPT HF(2) ENERGY BC(HF)"], [1776, 9, 1, "psivar-SAPT-HF-2-ENERGY-C", "SAPT HF(2) ENERGY C"], [1776, 9, 1, "psivar-SAPT-HF-2-ENERGY-HF", "SAPT HF(2) ENERGY HF"], [1776, 9, 1, "psivar-SAPT-IND-ENERGY", "SAPT IND ENERGY"], [1776, 9, 1, "psivar-SAPT-IND-DISP30-ENERGY", "SAPT IND-DISP30 ENERGY"], [1776, 9, 1, "psivar-SAPT-IND20-R-ENERGY", "SAPT IND20,R ENERGY"], [1776, 9, 1, "psivar-SAPT-IND20-U-ENERGY", "SAPT IND20,U ENERGY"], [1776, 9, 1, "psivar-SAPT-IND22-ENERGY", "SAPT IND22 ENERGY"], [1776, 9, 1, "psivar-SAPT-IND30-R-ENERGY", "SAPT IND30,R ENERGY"], [1776, 9, 1, "psivar-SAPT-MP2-CORRELATION-ENERGY", "SAPT MP2 CORRELATION ENERGY"], [1776, 9, 1, "psivar-SAPT-SAME-SPIN-DISP20-ENERGY", "SAPT SAME-SPIN DISP20 ENERGY"], [1776, 9, 1, "psivar-SAPT-SAME-SPIN-EXCH-DISP20-ENERGY", "SAPT SAME-SPIN EXCH-DISP20 ENERGY"], [1776, 9, 1, "psivar-SAPT-TOTAL-ENERGY", "SAPT TOTAL ENERGY"], [1776, 9, 1, "psivar-SAPT0-DISP-ENERGY", "SAPT0 DISP ENERGY"], [1776, 9, 1, "psivar-SAPT0-ELST-ENERGY", "SAPT0 ELST ENERGY"], [1776, 9, 1, "psivar-SAPT0-EXCH-ENERGY", "SAPT0 EXCH ENERGY"], [1776, 9, 1, "psivar-SAPT0-IND-ENERGY", "SAPT0 IND ENERGY"], [1776, 9, 1, "psivar-SAPT0-TOTAL-ENERGY", "SAPT0 TOTAL ENERGY"], [1776, 9, 1, "psivar-SAPT2-DISP-ENERGY", "SAPT2 DISP ENERGY"], [1776, 9, 1, "psivar-SAPT2-ELST-ENERGY", "SAPT2 ELST ENERGY"], [1776, 9, 1, "psivar-SAPT2-EXCH-ENERGY", "SAPT2 EXCH ENERGY"], [1776, 9, 1, "psivar-SAPT2-IND-ENERGY", "SAPT2 IND ENERGY"], [1776, 9, 1, "psivar-SAPT2-TOTAL-ENERGY", "SAPT2 TOTAL ENERGY"], [1776, 9, 1, "psivar-1", "SAPT2+ DISP ENERGY"], [1776, 9, 1, "psivar-2", "SAPT2+ ELST ENERGY"], [1776, 9, 1, "psivar-3", "SAPT2+ EXCH ENERGY"], [1776, 9, 1, "psivar-4", "SAPT2+ IND ENERGY"], [1776, 9, 1, "psivar-9", "SAPT2+ TOTAL ENERGY"], [1776, 9, 1, "psivar-SAPT2-3-DISP-ENERGY", "SAPT2+(3) DISP ENERGY"], [1776, 9, 1, "psivar-SAPT2-3-ELST-ENERGY", "SAPT2+(3) ELST ENERGY"], [1776, 9, 1, "psivar-SAPT2-3-EXCH-ENERGY", "SAPT2+(3) EXCH ENERGY"], [1776, 9, 1, "psivar-SAPT2-3-IND-ENERGY", "SAPT2+(3) IND ENERGY"], [1776, 9, 1, "psivar-SAPT2-3-TOTAL-ENERGY", "SAPT2+(3) TOTAL ENERGY"], [1776, 9, 1, "psivar-SAPT2-3-CCD-DISP-ENERGY", "SAPT2+(3)(CCD) DISP ENERGY"], [1776, 9, 1, "psivar-SAPT2-3-CCD-ELST-ENERGY", "SAPT2+(3)(CCD) ELST ENERGY"], [1776, 9, 1, "psivar-SAPT2-3-CCD-EXCH-ENERGY", "SAPT2+(3)(CCD) EXCH ENERGY"], [1776, 9, 1, "psivar-SAPT2-3-CCD-IND-ENERGY", "SAPT2+(3)(CCD) IND ENERGY"], [1776, 9, 1, "psivar-SAPT2-3-CCD-TOTAL-ENERGY", "SAPT2+(3)(CCD) TOTAL ENERGY"], [1776, 9, 1, "psivar-SAPT2-3-CCD-DMP2-DISP-ENERGY", "SAPT2+(3)(CCD)DMP2 DISP ENERGY"], [1776, 9, 1, "psivar-SAPT2-3-CCD-DMP2-ELST-ENERGY", "SAPT2+(3)(CCD)DMP2 ELST ENERGY"], [1776, 9, 1, "psivar-SAPT2-3-CCD-DMP2-EXCH-ENERGY", "SAPT2+(3)(CCD)DMP2 EXCH ENERGY"], [1776, 9, 1, "psivar-SAPT2-3-CCD-DMP2-IND-ENERGY", "SAPT2+(3)(CCD)DMP2 IND ENERGY"], [1776, 9, 1, "psivar-SAPT2-3-CCD-DMP2-TOTAL-ENERGY", "SAPT2+(3)(CCD)DMP2 TOTAL ENERGY"], [1776, 9, 1, "psivar-SAPT2-3-DMP2-DISP-ENERGY", "SAPT2+(3)DMP2 DISP ENERGY"], [1776, 9, 1, "psivar-SAPT2-3-DMP2-ELST-ENERGY", "SAPT2+(3)DMP2 ELST ENERGY"], [1776, 9, 1, "psivar-SAPT2-3-DMP2-EXCH-ENERGY", "SAPT2+(3)DMP2 EXCH ENERGY"], [1776, 9, 1, "psivar-SAPT2-3-DMP2-IND-ENERGY", "SAPT2+(3)DMP2 IND ENERGY"], [1776, 9, 1, "psivar-SAPT2-3-DMP2-TOTAL-ENERGY", "SAPT2+(3)DMP2 TOTAL ENERGY"], [1776, 9, 1, "psivar-SAPT2-CCD-DISP-ENERGY", "SAPT2+(CCD) DISP ENERGY"], [1776, 9, 1, "psivar-SAPT2-CCD-ELST-ENERGY", "SAPT2+(CCD) ELST ENERGY"], [1776, 9, 1, "psivar-SAPT2-CCD-EXCH-ENERGY", "SAPT2+(CCD) EXCH ENERGY"], [1776, 9, 1, "psivar-SAPT2-CCD-IND-ENERGY", "SAPT2+(CCD) IND ENERGY"], [1776, 9, 1, "psivar-SAPT2-CCD-TOTAL-ENERGY", "SAPT2+(CCD) TOTAL ENERGY"], [1776, 9, 1, "psivar-SAPT2-CCD-DMP2-DISP-ENERGY", "SAPT2+(CCD)DMP2 DISP ENERGY"], [1776, 9, 1, "psivar-SAPT2-CCD-DMP2-ELST-ENERGY", "SAPT2+(CCD)DMP2 ELST ENERGY"], [1776, 9, 1, "psivar-SAPT2-CCD-DMP2-EXCH-ENERGY", "SAPT2+(CCD)DMP2 EXCH ENERGY"], [1776, 9, 1, "psivar-SAPT2-CCD-DMP2-IND-ENERGY", "SAPT2+(CCD)DMP2 IND ENERGY"], [1776, 9, 1, "psivar-SAPT2-CCD-DMP2-TOTAL-ENERGY", "SAPT2+(CCD)DMP2 TOTAL ENERGY"], [1776, 9, 1, "psivar-5", "SAPT2+3 DISP ENERGY"], [1776, 9, 1, "psivar-6", "SAPT2+3 ELST ENERGY"], [1776, 9, 1, "psivar-7", "SAPT2+3 EXCH ENERGY"], [1776, 9, 1, "psivar-8", "SAPT2+3 IND ENERGY"], [1776, 9, 1, "psivar-10", "SAPT2+3 TOTAL ENERGY"], [1776, 9, 1, "psivar-11", "SAPT2+3(CCD) DISP ENERGY"], [1776, 9, 1, "psivar-12", "SAPT2+3(CCD) ELST ENERGY"], [1776, 9, 1, "psivar-13", "SAPT2+3(CCD) EXCH ENERGY"], [1776, 9, 1, "psivar-14", "SAPT2+3(CCD) IND ENERGY"], [1776, 9, 1, "psivar-15", "SAPT2+3(CCD) TOTAL ENERGY"], [1776, 9, 1, "psivar-16", "SAPT2+3(CCD)DMP2 DISP ENERGY"], [1776, 9, 1, "psivar-17", "SAPT2+3(CCD)DMP2 ELST ENERGY"], [1776, 9, 1, "psivar-18", "SAPT2+3(CCD)DMP2 EXCH ENERGY"], [1776, 9, 1, "psivar-19", "SAPT2+3(CCD)DMP2 IND ENERGY"], [1776, 9, 1, "psivar-20", "SAPT2+3(CCD)DMP2 TOTAL ENERGY"], [1776, 9, 1, "psivar-SAPT2-3DMP2-DISP-ENERGY", "SAPT2+3DMP2 DISP ENERGY"], [1776, 9, 1, "psivar-SAPT2-3DMP2-ELST-ENERGY", "SAPT2+3DMP2 ELST ENERGY"], [1776, 9, 1, "psivar-SAPT2-3DMP2-EXCH-ENERGY", "SAPT2+3DMP2 EXCH ENERGY"], [1776, 9, 1, "psivar-SAPT2-3DMP2-IND-ENERGY", "SAPT2+3DMP2 IND ENERGY"], [1776, 9, 1, "psivar-SAPT2-3DMP2-TOTAL-ENERGY", "SAPT2+3DMP2 TOTAL ENERGY"], [1776, 9, 1, "psivar-SAPT2-DMP2-DISP-ENERGY", "SAPT2+DMP2 DISP ENERGY"], [1776, 9, 1, "psivar-SAPT2-DMP2-ELST-ENERGY", "SAPT2+DMP2 ELST ENERGY"], [1776, 9, 1, "psivar-SAPT2-DMP2-EXCH-ENERGY", "SAPT2+DMP2 EXCH ENERGY"], [1776, 9, 1, "psivar-SAPT2-DMP2-IND-ENERGY", "SAPT2+DMP2 IND ENERGY"], [1776, 9, 1, "psivar-SAPT2-DMP2-TOTAL-ENERGY", "SAPT2+DMP2 TOTAL ENERGY"], [1776, 9, 1, "psivar-SCF-DIPOLE", "SCF DIPOLE"], [1776, 9, 1, "psivar-SCF-DIPOLE-GRADIENT", "SCF DIPOLE GRADIENT"], [1776, 9, 1, "psivar-SCF-ITERATIONS", "SCF ITERATIONS"], [1776, 9, 1, "psivar-SCF-QUADRUPOLE", "SCF QUADRUPOLE"], [1776, 9, 1, "psivar-SCF-STABILITY-EIGENVALUES", "SCF STABILITY EIGENVALUES"], [1776, 9, 1, "psivar-SCF-TOTAL-ENERGY", "SCF TOTAL ENERGY"], [1776, 9, 1, "psivar-SCF-TOTAL-GRADIENT", "SCF TOTAL GRADIENT"], [1776, 9, 1, "psivar-SCF-TOTAL-HESSIAN", "SCF TOTAL HESSIAN"], [1776, 9, 1, "psivar-SCS-N-MP2-CORRELATION-ENERGY", "SCS(N)-MP2 CORRELATION ENERGY"], [1776, 9, 1, "psivar-SCS-N-MP2-TOTAL-ENERGY", "SCS(N)-MP2 TOTAL ENERGY"], [1776, 9, 1, "psivar-SCS-N-OMP2-CORRELATION-ENERGY", "SCS(N)-OMP2 CORRELATION ENERGY"], [1776, 9, 1, "psivar-SCS-N-OMP2-TOTAL-ENERGY", "SCS(N)-OMP2 TOTAL ENERGY"], [1776, 9, 1, "psivar-SCS-CCSD-CORRELATION-ENERGY", "SCS-CCSD CORRELATION ENERGY"], [1776, 9, 1, "psivar-SCS-CCSD-TOTAL-ENERGY", "SCS-CCSD TOTAL ENERGY"], [1776, 9, 1, "psivar-SCS-MP2-CORRELATION-ENERGY", "SCS-MP2 CORRELATION ENERGY"], [1776, 9, 1, "psivar-SCS-MP2-TOTAL-ENERGY", "SCS-MP2 TOTAL ENERGY"], [1776, 9, 1, "psivar-SCS-MP2-VDW-CORRELATION-ENERGY", "SCS-MP2-VDW CORRELATION ENERGY"], [1776, 9, 1, "psivar-SCS-MP2-VDW-TOTAL-ENERGY", "SCS-MP2-VDW TOTAL ENERGY"], [1776, 9, 1, "psivar-SCS-MP3-CORRELATION-ENERGY", "SCS-MP3 CORRELATION ENERGY"], [1776, 9, 1, "psivar-SCS-MP3-TOTAL-ENERGY", "SCS-MP3 TOTAL ENERGY"], [1776, 9, 1, "psivar-SCS-OMP2-CORRELATION-ENERGY", "SCS-OMP2 CORRELATION ENERGY"], [1776, 9, 1, "psivar-SCS-OMP2-TOTAL-ENERGY", "SCS-OMP2 TOTAL ENERGY"], [1776, 9, 1, "psivar-SCS-OMP3-CORRELATION-ENERGY", "SCS-OMP3 CORRELATION ENERGY"], [1776, 9, 1, "psivar-SCS-OMP3-TOTAL-ENERGY", "SCS-OMP3 TOTAL ENERGY"], [1776, 9, 1, "psivar-SCSN-OMP2-CORRELATION-ENERGY", "SCSN-OMP2 CORRELATION ENERGY"], [1776, 9, 1, "psivar-SCSN-OMP2-TOTAL-ENERGY", "SCSN-OMP2 TOTAL ENERGY"], [1776, 9, 1, "psivar-SOS-MP2-CORRELATION-ENERGY", "SOS-MP2 CORRELATION ENERGY"], [1776, 9, 1, "psivar-SOS-MP2-TOTAL-ENERGY", "SOS-MP2 TOTAL ENERGY"], [1776, 9, 1, "psivar-SOS-OMP2-CORRELATION-ENERGY", "SOS-OMP2 CORRELATION ENERGY"], [1776, 9, 1, "psivar-SOS-OMP2-TOTAL-ENERGY", "SOS-OMP2 TOTAL ENERGY"], [1776, 9, 1, "psivar-SOS-OMP3-CORRELATION-ENERGY", "SOS-OMP3 CORRELATION ENERGY"], [1776, 9, 1, "psivar-SOS-OMP3-TOTAL-ENERGY", "SOS-OMP3 TOTAL ENERGY"], [1776, 9, 1, "psivar-SOS-PI-MP2-CORRELATION-ENERGY", "SOS-PI-MP2 CORRELATION ENERGY"], [1776, 9, 1, "psivar-SOS-PI-MP2-TOTAL-ENERGY", "SOS-PI-MP2 TOTAL ENERGY"], [1776, 9, 1, "psivar-SSAPT0-DISP-ENERGY", "SSAPT0 DISP ENERGY"], [1776, 9, 1, "psivar-SSAPT0-ELST-ENERGY", "SSAPT0 ELST ENERGY"], [1776, 9, 1, "psivar-SSAPT0-EXCH-ENERGY", "SSAPT0 EXCH ENERGY"], [1776, 9, 1, "psivar-SSAPT0-IND-ENERGY", "SSAPT0 IND ENERGY"], [1776, 9, 1, "psivar-SSAPT0-TOTAL-ENERGY", "SSAPT0 TOTAL ENERGY"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-IN-h-ROOT-n-IN-i-ELECTRIC-TRANSITION-DIPOLE-MOMENT-LEN", "TD-fctl ROOT 0 (IN h) -&gt; ROOT n (IN i) ELECTRIC TRANSITION DIPOLE MOMENT (LEN)"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-IN-h-ROOT-n-IN-i-ELECTRIC-TRANSITION-DIPOLE-MOMENT-VEL", "TD-fctl ROOT 0 (IN h) -&gt; ROOT n (IN i) ELECTRIC TRANSITION DIPOLE MOMENT (VEL)"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-IN-h-ROOT-n-IN-i-EXCITATION-ENERGY", "TD-fctl ROOT 0 (IN h) -&gt; ROOT n (IN i) EXCITATION ENERGY"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-IN-h-ROOT-n-IN-i-LEFT-EIGENVECTOR-ALPHA", "TD-fctl ROOT 0 (IN h) -&gt; ROOT n (IN i) LEFT EIGENVECTOR ALPHA"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-IN-h-ROOT-n-IN-i-LEFT-EIGENVECTOR-BETA", "TD-fctl ROOT 0 (IN h) -&gt; ROOT n (IN i) LEFT EIGENVECTOR BETA"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-IN-h-ROOT-n-IN-i-MAGNETIC-TRANSITION-DIPOLE-MOMENT", "TD-fctl ROOT 0 (IN h) -&gt; ROOT n (IN i) MAGNETIC TRANSITION DIPOLE MOMENT"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-IN-h-ROOT-n-IN-i-OSCILLATOR-STRENGTH-LEN", "TD-fctl ROOT 0 (IN h) -&gt; ROOT n (IN i) OSCILLATOR STRENGTH (LEN)"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-IN-h-ROOT-n-IN-i-OSCILLATOR-STRENGTH-VEL", "TD-fctl ROOT 0 (IN h) -&gt; ROOT n (IN i) OSCILLATOR STRENGTH (VEL)"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-IN-h-ROOT-n-IN-i-RIGHT-EIGENVECTOR-ALPHA", "TD-fctl ROOT 0 (IN h) -&gt; ROOT n (IN i) RIGHT EIGENVECTOR ALPHA"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-IN-h-ROOT-n-IN-i-RIGHT-EIGENVECTOR-BETA", "TD-fctl ROOT 0 (IN h) -&gt; ROOT n (IN i) RIGHT EIGENVECTOR BETA"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-IN-h-ROOT-n-IN-i-ROTATORY-STRENGTH-LEN", "TD-fctl ROOT 0 (IN h) -&gt; ROOT n (IN i) ROTATORY STRENGTH (LEN)"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-IN-h-ROOT-n-IN-i-ROTATORY-STRENGTH-VEL", "TD-fctl ROOT 0 (IN h) -&gt; ROOT n (IN i) ROTATORY STRENGTH (VEL)"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-h-ROOT-n-i-ELECTRIC-TRANSITION-DIPOLE-MOMENT-LEN", "TD-fctl ROOT 0 (h) -&gt; ROOT n (i) ELECTRIC TRANSITION DIPOLE MOMENT (LEN)"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-h-ROOT-n-i-ELECTRIC-TRANSITION-DIPOLE-MOMENT-VEL", "TD-fctl ROOT 0 (h) -&gt; ROOT n (i) ELECTRIC TRANSITION DIPOLE MOMENT (VEL)"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-h-ROOT-n-i-EXCITATION-ENERGY", "TD-fctl ROOT 0 (h) -&gt; ROOT n (i) EXCITATION ENERGY"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-h-ROOT-n-i-LEFT-EIGENVECTOR-ALPHA", "TD-fctl ROOT 0 (h) -&gt; ROOT n (i) LEFT EIGENVECTOR ALPHA"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-h-ROOT-n-i-LEFT-EIGENVECTOR-BETA", "TD-fctl ROOT 0 (h) -&gt; ROOT n (i) LEFT EIGENVECTOR BETA"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-h-ROOT-n-i-MAGNETIC-TRANSITION-DIPOLE-MOMENT", "TD-fctl ROOT 0 (h) -&gt; ROOT n (i) MAGNETIC TRANSITION DIPOLE MOMENT"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-h-ROOT-n-i-OSCILLATOR-STRENGTH-LEN", "TD-fctl ROOT 0 (h) -&gt; ROOT n (i) OSCILLATOR STRENGTH (LEN)"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-h-ROOT-n-i-OSCILLATOR-STRENGTH-VEL", "TD-fctl ROOT 0 (h) -&gt; ROOT n (i) OSCILLATOR STRENGTH (VEL)"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-h-ROOT-n-i-RIGHT-EIGENVECTOR-ALPHA", "TD-fctl ROOT 0 (h) -&gt; ROOT n (i) RIGHT EIGENVECTOR ALPHA"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-h-ROOT-n-i-RIGHT-EIGENVECTOR-BETA", "TD-fctl ROOT 0 (h) -&gt; ROOT n (i) RIGHT EIGENVECTOR BETA"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-h-ROOT-n-i-ROTATORY-STRENGTH-LEN", "TD-fctl ROOT 0 (h) -&gt; ROOT n (i) ROTATORY STRENGTH (LEN)"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-h-ROOT-n-i-ROTATORY-STRENGTH-VEL", "TD-fctl ROOT 0 (h) -&gt; ROOT n (i) ROTATORY STRENGTH (VEL)"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-ROOT-n-ELECTRIC-TRANSITION-DIPOLE-MOMENT-LEN", "TD-fctl ROOT 0 -&gt; ROOT n ELECTRIC TRANSITION DIPOLE MOMENT (LEN)"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-ROOT-n-ELECTRIC-TRANSITION-DIPOLE-MOMENT-LEN-h-TRANSITION", "TD-fctl ROOT 0 -&gt; ROOT n ELECTRIC TRANSITION DIPOLE MOMENT (LEN) - h TRANSITION"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-ROOT-n-ELECTRIC-TRANSITION-DIPOLE-MOMENT-VEL", "TD-fctl ROOT 0 -&gt; ROOT n ELECTRIC TRANSITION DIPOLE MOMENT (VEL)"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-ROOT-n-ELECTRIC-TRANSITION-DIPOLE-MOMENT-VEL-h-TRANSITION", "TD-fctl ROOT 0 -&gt; ROOT n ELECTRIC TRANSITION DIPOLE MOMENT (VEL) - h TRANSITION"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-ROOT-n-EXCITATION-ENERGY", "TD-fctl ROOT 0 -&gt; ROOT n EXCITATION ENERGY"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-ROOT-n-EXCITATION-ENERGY-h-TRANSITION", "TD-fctl ROOT 0 -&gt; ROOT n EXCITATION ENERGY - h TRANSITION"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-ROOT-n-LEFT-EIGENVECTOR-ALPHA", "TD-fctl ROOT 0 -&gt; ROOT n LEFT EIGENVECTOR ALPHA"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-ROOT-n-LEFT-EIGENVECTOR-ALPHA-h-TRANSITION", "TD-fctl ROOT 0 -&gt; ROOT n LEFT EIGENVECTOR ALPHA - h TRANSITION"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-ROOT-n-LEFT-EIGENVECTOR-BETA", "TD-fctl ROOT 0 -&gt; ROOT n LEFT EIGENVECTOR BETA"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-ROOT-n-LEFT-EIGENVECTOR-BETA-h-TRANSITION", "TD-fctl ROOT 0 -&gt; ROOT n LEFT EIGENVECTOR BETA - h TRANSITION"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-ROOT-n-MAGNETIC-TRANSITION-DIPOLE-MOMENT", "TD-fctl ROOT 0 -&gt; ROOT n MAGNETIC TRANSITION DIPOLE MOMENT"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-ROOT-n-MAGNETIC-TRANSITION-DIPOLE-MOMENT-h-TRANSITION", "TD-fctl ROOT 0 -&gt; ROOT n MAGNETIC TRANSITION DIPOLE MOMENT - h TRANSITION"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-ROOT-n-OSCILLATOR-STRENGTH-LEN", "TD-fctl ROOT 0 -&gt; ROOT n OSCILLATOR STRENGTH (LEN)"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-ROOT-n-OSCILLATOR-STRENGTH-LEN-h-TRANSITION", "TD-fctl ROOT 0 -&gt; ROOT n OSCILLATOR STRENGTH (LEN) - h TRANSITION"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-ROOT-n-OSCILLATOR-STRENGTH-VEL", "TD-fctl ROOT 0 -&gt; ROOT n OSCILLATOR STRENGTH (VEL)"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-ROOT-n-OSCILLATOR-STRENGTH-VEL-h-TRANSITION", "TD-fctl ROOT 0 -&gt; ROOT n OSCILLATOR STRENGTH (VEL) - h TRANSITION"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-ROOT-n-RIGHT-EIGENVECTOR-ALPHA", "TD-fctl ROOT 0 -&gt; ROOT n RIGHT EIGENVECTOR ALPHA"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-ROOT-n-RIGHT-EIGENVECTOR-ALPHA-h-TRANSITION", "TD-fctl ROOT 0 -&gt; ROOT n RIGHT EIGENVECTOR ALPHA - h TRANSITION"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-ROOT-n-RIGHT-EIGENVECTOR-BETA", "TD-fctl ROOT 0 -&gt; ROOT n RIGHT EIGENVECTOR BETA"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-ROOT-n-RIGHT-EIGENVECTOR-BETA-h-TRANSITION", "TD-fctl ROOT 0 -&gt; ROOT n RIGHT EIGENVECTOR BETA - h TRANSITION"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-ROOT-n-ROTATORY-STRENGTH-LEN", "TD-fctl ROOT 0 -&gt; ROOT n ROTATORY STRENGTH (LEN)"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-ROOT-n-ROTATORY-STRENGTH-LEN-h-TRANSITION", "TD-fctl ROOT 0 -&gt; ROOT n ROTATORY STRENGTH (LEN) - h TRANSITION"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-ROOT-n-ROTATORY-STRENGTH-VEL", "TD-fctl ROOT 0 -&gt; ROOT n ROTATORY STRENGTH (VEL)"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-ROOT-n-ROTATORY-STRENGTH-VEL-h-TRANSITION", "TD-fctl ROOT 0 -&gt; ROOT n ROTATORY STRENGTH (VEL) - h TRANSITION"], [1776, 9, 1, "psivar-TD-fctl-ROOT-n-IN-h-TOTAL-ENERGY", "TD-fctl ROOT n (IN h) TOTAL ENERGY"], [1776, 9, 1, "psivar-TD-fctl-ROOT-n-h-TOTAL-ENERGY", "TD-fctl ROOT n (h) TOTAL ENERGY"], [1776, 9, 1, "psivar-TD-fctl-ROOT-n-TOTAL-ENERGY", "TD-fctl ROOT n TOTAL ENERGY"], [1776, 9, 1, "psivar-TD-fctl-ROOT-n-TOTAL-ENERGY-h-TRANSITION", "TD-fctl ROOT n TOTAL ENERGY - h TRANSITION"], [1776, 9, 1, "psivar-THERMAL-ENERGY", "THERMAL ENERGY"], [1776, 9, 1, "psivar-THERMAL-ENERGY-CORRECTION", "THERMAL ENERGY CORRECTION"], [1776, 9, 1, "psivar-TWO-ELECTRON-ENERGY", "TWO-ELECTRON ENERGY"], [1776, 9, 1, "psivar-UNCP-CORRECTED-2-BODY-INTERACTION-ENERGY", "UNCP-CORRECTED 2-BODY INTERACTION ENERGY"], [1750, 10, 1, "-", "VMDPATH"], [1776, 9, 1, "psivar-WIBERG-LOWDIN-INDICES", "WIBERG LOWDIN INDICES"], [1776, 9, 1, "psivar-ZAPTn-CORRELATION-ENERGY", "ZAPTn CORRELATION ENERGY"], [1776, 9, 1, "psivar-ZAPTn-TOTAL-ENERGY", "ZAPTn TOTAL ENERGY"], [1776, 9, 1, "psivar-ZERO-K-ENTHALPY", "ZERO K ENTHALPY"], [1776, 9, 1, "-", "ZPVE"], [1776, 9, 1, "psivar-T-CORRECTION-ENERGY", "[T] CORRECTION ENERGY"], [1776, 9, 1, "psivar-db_name-DATABASE-MEAN-ABSOLUTE-DEVIATION", "db_name DATABASE MEAN ABSOLUTE DEVIATION"], [1776, 9, 1, "psivar-db_name-DATABASE-MEAN-SIGNED-DEVIATION", "db_name DATABASE MEAN SIGNED DEVIATION"], [1776, 9, 1, "psivar-db_name-DATABASE-ROOT-MEAN-SQUARE-DEVIATION", "db_name DATABASE ROOT-MEAN-SQUARE DEVIATION"], [1776, 9, 1, "psivar-fctl-DISPERSION-CORRECTION-ENERGY", "fctl DISPERSION CORRECTION ENERGY"], [1776, 9, 1, "psivar-mtd-128-POLE", "mtd 128-POLE"], [1776, 9, 1, "psivar-mtd-32-POLE", "mtd 32-POLE"], [1776, 9, 1, "psivar-mtd-64-POLE", "mtd 64-POLE"], [1776, 9, 1, "psivar-mtd-DIPOLE", "mtd DIPOLE"], [1776, 9, 1, "psivar-mtd-HEXADECAPOLE", "mtd HEXADECAPOLE"], [1776, 9, 1, "psivar-mtd-OCTUPOLE", "mtd OCTUPOLE"], [1776, 9, 1, "psivar-mtd-QUADRUPOLE", "mtd QUADRUPOLE"]], "CUSTOM SCS-MP2": [[1776, 9, 1, "psivar-CUSTOM-SCS-MP2.5-CORRELATION-ENERGY", "5 CORRELATION ENERGY"], [1776, 9, 1, "psivar-CUSTOM-SCS-MP2.5-TOTAL-ENERGY", "5 TOTAL ENERGY"]], "CUSTOM SCS-OMP2": [[1776, 9, 1, "psivar-CUSTOM-SCS-OMP2.5-CORRELATION-ENERGY", "5 CORRELATION ENERGY"], [1776, 9, 1, "psivar-CUSTOM-SCS-OMP2.5-TOTAL-ENERGY", "5 TOTAL ENERGY"]], "MP2": [[1776, 9, 1, "psivar-MP2.5-CORRELATION-ENERGY", "5 CORRELATION ENERGY"], [1776, 9, 1, "psivar-MP2.5-DOUBLES-ENERGY", "5 DOUBLES ENERGY"], [1776, 9, 1, "psivar-MP2.5-OPPOSITE-SPIN-CORRELATION-ENERGY", "5 OPPOSITE-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-MP2.5-SAME-SPIN-CORRELATION-ENERGY", "5 SAME-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-MP2.5-SINGLES-ENERGY", "5 SINGLES ENERGY"], [1776, 9, 1, "psivar-MP2.5-TOTAL-ENERGY", "5 TOTAL ENERGY"]], "NBODY (i, j, ..., k)@(a, b, ..": [[1776, 9, 1, "psivar-NBODY-i-j-...-k-a-b-...-c-TOTAL-ENERGY", ", c) TOTAL ENERGY"]], "OMP2": [[1776, 9, 1, "psivar-OMP2.5-CORRELATION-ENERGY", "5 CORRELATION ENERGY"], [1776, 9, 1, "psivar-OMP2.5-DOUBLES-ENERGY", "5 DOUBLES ENERGY"], [1776, 9, 1, "psivar-OMP2.5-OPPOSITE-SPIN-CORRELATION-ENERGY", "5 OPPOSITE-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-OMP2.5-REFERENCE-CORRECTION-ENERGY", "5 REFERENCE CORRECTION ENERGY"], [1776, 9, 1, "psivar-OMP2.5-SAME-SPIN-CORRELATION-ENERGY", "5 SAME-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-OMP2.5-TOTAL-ENERGY", "5 TOTAL ENERGY"]], "SAPT EST": [[1776, 9, 1, "psivar-SAPT-EST.DISP22-T-ENERGY", "DISP22(T) ENERGY"], [1776, 9, 1, "psivar-SAPT-EST.DISP22-T-CCD-ENERGY", "DISP22(T)(CCD) ENERGY"]], "The total electronic gradient [E_h/a0] of the MP2 level of theory, ({nat}, 3)": [[1776, 9, 1, "psivar-The-total-electronic-gradient-E_h-a0-of-the-MP2-level-of-theory-nat-3-.", ""]], "psi4": [[2, 0, 1, "", "compare"], [2, 0, 1, "", "compare_cubes"], [2, 0, 1, "", "compare_fchkfiles"], [2, 0, 1, "", "compare_fcidumps"], [2, 0, 1, "", "compare_integers"], [2, 0, 1, "", "compare_matrices"], [2, 0, 1, "", "compare_moldenfiles"], [2, 0, 1, "", "compare_molrecs"], [2, 0, 1, "", "compare_recursive"], [2, 0, 1, "", "compare_values"], [2, 0, 1, "", "compare_vectors"], [2, 0, 1, "", "compare_wavefunctions"], [1827, 1, 0, "-", "core"], [1827, 1, 0, "-", "driver"], [1768, 0, 1, "", "set_output_file"], [1767, 11, 1, "cmdoption-psi4-a", "--append"], [1767, 11, 1, "cmdoption-psi4-h", "--help"], [1767, 11, 1, "cmdoption-psi4-inplace", "--inplace"], [1767, 11, 1, "cmdoption-psi4-i", "--input"], [1767, 11, 1, "cmdoption-psi4-loglevel", "--loglevel"], [1767, 11, 1, "cmdoption-psi4-memory", "--memory"], [1767, 11, 1, "cmdoption-psi4-m", "--messy"], [1767, 11, 1, "cmdoption-psi4-module", "--module"], [1767, 11, 1, "cmdoption-psi4-n", "--nthread"], [1767, 11, 1, "cmdoption-psi4-o", "--output"], [1767, 11, 1, "cmdoption-psi4-psiapi-path", "--psiapi-path"], [1767, 11, 1, "cmdoption-psi4-l", "--psidatadir"], [1767, 11, 1, "cmdoption-psi4-qcschema", "--qcschema"], [1767, 11, 1, "cmdoption-psi4-qcschema", "--schema"], [1767, 11, 1, "cmdoption-psi4-s", "--scratch"], [1767, 11, 1, "cmdoption-psi4-k", "--skip-preprocessor"], [1767, 11, 1, "cmdoption-psi4-t", "--test"], [1767, 11, 1, "cmdoption-psi4-v", "--verbose"], [1767, 11, 1, "cmdoption-psi4-V", "--version"], [1767, 11, 1, "cmdoption-psi4-V", "-V"], [1767, 11, 1, "cmdoption-psi4-a", "-a"], [1767, 11, 1, "cmdoption-psi4-h", "-h"], [1767, 11, 1, "cmdoption-psi4-i", "-i"], [1767, 11, 1, "cmdoption-psi4-k", "-k"], [1767, 11, 1, "cmdoption-psi4-l", "-l"], [1767, 11, 1, "cmdoption-psi4-m", "-m"], [1767, 11, 1, "cmdoption-psi4-n", "-n"], [1767, 11, 1, "cmdoption-psi4-o", "-o"], [1767, 11, 1, "cmdoption-psi4-s", "-s"], [1767, 11, 1, "cmdoption-psi4-t", "-t"], [1767, 11, 1, "cmdoption-psi4-v", "-v"]], "psi4.core": [[3, 2, 1, "", "AOShellCombinationsIterator"], [4, 2, 1, "", "AngularMomentumInt"], [5, 2, 1, "", "BSVec"], [6, 2, 1, "", "BasisExtents"], [7, 2, 1, "", "BasisFunctions"], [8, 2, 1, "", "BasisSet"], [9, 2, 1, "", "BlockOPoints"], [10, 2, 1, "", "BoysLocalizer"], [11, 2, 1, "", "CCWavefunction"], [12, 2, 1, "", "CIVector"], [13, 2, 1, "", "CIWavefunction"], [14, 2, 1, "", "CUHF"], [15, 2, 1, "", "CdSalc"], [16, 2, 1, "", "CdSalcList"], [17, 2, 1, "", "CharacterTable"], [18, 2, 1, "", "CompositeJK"], [19, 2, 1, "", "CorrelationFactor"], [20, 2, 1, "", "CorrelationTable"], [21, 2, 1, "", "CubeProperties"], [22, 0, 1, "", "DASUM"], [23, 0, 1, "", "DAXPY"], [24, 0, 1, "", "DCOPY"], [25, 0, 1, "", "DDOT"], [26, 2, 1, "", "DFEP2Wavefunction"], [27, 2, 1, "", "DFHelper"], [28, 2, 1, "", "DFSOMCSCF"], [29, 2, 1, "", "DFTGrid"], [30, 2, 1, "", "DFTensor"], [31, 0, 1, "", "DGBMV"], [32, 0, 1, "", "DGEEV"], [33, 0, 1, "", "DGEMM"], [34, 0, 1, "", "DGEMV"], [35, 0, 1, "", "DGER"], [36, 0, 1, "", "DGETRF"], [37, 0, 1, "", "DGETRI"], [38, 0, 1, "", "DGETRS"], [39, 0, 1, "", "DNRM2"], [40, 0, 1, "", "DPOTRF"], [41, 0, 1, "", "DPOTRI"], [42, 0, 1, "", "DPOTRS"], [43, 0, 1, "", "DROT"], [44, 0, 1, "", "DSBMV"], [45, 0, 1, "", "DSCAL"], [46, 0, 1, "", "DSWAP"], [47, 0, 1, "", "DSYEV"], [48, 0, 1, "", "DSYMM"], [49, 0, 1, "", "DSYMV"], [50, 0, 1, "", "DSYR"], [51, 0, 1, "", "DSYR2"], [52, 0, 1, "", "DSYR2K"], [53, 0, 1, "", "DSYRK"], [54, 0, 1, "", "DSYSV"], [55, 0, 1, "", "DTBMV"], [56, 0, 1, "", "DTBSV"], [57, 0, 1, "", "DTRMM"], [58, 0, 1, "", "DTRMV"], [59, 0, 1, "", "DTRSM"], [60, 0, 1, "", "DTRSV"], [61, 2, 1, "", "Deriv"], [62, 2, 1, "", "DerivCalcType"], [63, 2, 1, "", "DiagonalizeOrder"], [64, 2, 1, "", "Dimension"], [65, 2, 1, "", "DipoleInt"], [66, 2, 1, "", "DirectJK"], [67, 2, 1, "", "DiskSOMCSCF"], [68, 2, 1, "", "Dispersion"], [69, 2, 1, "", "ERI"], [70, 2, 1, "", "ESPPropCalc"], [71, 2, 1, "", "ElectricFieldInt"], [72, 2, 1, "", "ElectrostaticInt"], [73, 2, 1, "", "ExternalPotential"], [74, 2, 1, "", "FCHKWriter"], [75, 2, 1, "", "FDDS_Dispersion"], [76, 2, 1, "", "FISAPT"], [77, 2, 1, "", "FittedSlaterCorrelationFactor"], [78, 2, 1, "", "FittingMetric"], [79, 2, 1, "", "FragmentType"], [80, 2, 1, "", "Functional"], [81, 2, 1, "", "GaussianShell"], [82, 2, 1, "", "GaussianType"], [83, 2, 1, "", "GeometryUnits"], [84, 2, 1, "", "HF"], [85, 0, 1, "", "IDAMAX"], [86, 2, 1, "", "IO"], [87, 2, 1, "", "IOManager"], [88, 2, 1, "", "IntVector"], [89, 2, 1, "", "IntegralFactory"], [90, 2, 1, "", "IntegralTransform"], [91, 2, 1, "", "IrreducibleRepresentation"], [92, 2, 1, "", "JK"], [93, 2, 1, "", "KineticInt"], [94, 2, 1, "", "LS_THC_Computer"], [95, 2, 1, "", "LaplaceDenominator"], [96, 2, 1, "", "LibXCFunctional"], [97, 2, 1, "", "Localizer"], [98, 2, 1, "", "MOSpace"], [99, 2, 1, "", "MOWriter"], [100, 2, 1, "", "Matrix"], [101, 2, 1, "", "MatrixFactory"], [102, 2, 1, "", "MemDFJK"], [103, 2, 1, "", "MintsHelper"], [104, 2, 1, "", "MoldenWriter"], [105, 2, 1, "", "MolecularGrid"], [106, 2, 1, "", "Molecule"], [107, 2, 1, "", "MultipoleInt"], [108, 2, 1, "", "MultipoleSymmetry"], [109, 2, 1, "", "NablaInt"], [110, 2, 1, "", "NumIntHelper"], [111, 2, 1, "", "OEProp"], [112, 2, 1, "", "OneBodyAOInt"], [113, 2, 1, "", "OneBodySOInt"], [114, 2, 1, "", "Options"], [115, 2, 1, "", "OrbitalSpace"], [116, 2, 1, "", "OverlapInt"], [117, 2, 1, "", "PMLocalizer"], [118, 2, 1, "", "PetiteList"], [119, 2, 1, "", "PointFunctions"], [120, 2, 1, "", "PointGroup"], [121, 2, 1, "", "PotentialInt"], [122, 2, 1, "", "PrimitiveType"], [123, 2, 1, "", "Prop"], [124, 2, 1, "", "ProtoIntVector"], [125, 2, 1, "", "ProtoVector"], [126, 2, 1, "", "PsiReturnType"], [127, 2, 1, "", "QuadrupoleInt"], [128, 2, 1, "", "RHF"], [129, 2, 1, "", "RKSFunctions"], [130, 2, 1, "", "ROHF"], [131, 2, 1, "", "SADGuess"], [132, 2, 1, "", "SOBasisSet"], [133, 2, 1, "", "SOMCSCF"], [134, 2, 1, "", "SalcComponent"], [135, 2, 1, "", "SaveType"], [136, 2, 1, "", "ShellInfo"], [137, 2, 1, "", "Slice"], [138, 2, 1, "", "SuperFunctional"], [139, 2, 1, "", "SymmetryOperation"], [140, 2, 1, "", "TLaplaceDenominator"], [141, 2, 1, "", "ThreeCenterOverlapInt"], [142, 2, 1, "", "TracelessQuadrupoleInt"], [143, 2, 1, "", "TwoBodyAOInt"], [144, 2, 1, "", "TwoElectronInt"], [145, 2, 1, "", "UHF"], [146, 2, 1, "", "UKSFunctions"], [147, 2, 1, "", "VBase"], [148, 2, 1, "", "Vector"], [149, 2, 1, "", "Vector3"], [150, 2, 1, "", "Wavefunction"], [151, 0, 1, "", "array_variable"], [152, 0, 1, "", "array_variables"], [153, 0, 1, "", "be_quiet"], [154, 0, 1, "", "benchmark_blas1"], [155, 0, 1, "", "benchmark_blas2"], [156, 0, 1, "", "benchmark_blas3"], [157, 0, 1, "", "benchmark_disk"], [158, 0, 1, "", "benchmark_integrals"], [159, 0, 1, "", "benchmark_math"], [160, 0, 1, "", "ccdensity"], [161, 0, 1, "", "ccenergy"], [162, 0, 1, "", "cceom"], [163, 0, 1, "", "cchbar"], [164, 0, 1, "", "cclambda"], [165, 0, 1, "", "ccresponse"], [166, 0, 1, "", "cctransort"], [167, 0, 1, "", "cctriples"], [168, 0, 1, "", "clean"], [169, 0, 1, "", "clean_options"], [170, 0, 1, "", "clean_timers"], [171, 0, 1, "", "clean_variables"], [172, 0, 1, "", "close_outfile"], [173, 0, 1, "", "dct"], [174, 0, 1, "", "del_array_variable"], [175, 0, 1, "", "del_scalar_variable"], [176, 0, 1, "", "del_variable"], [177, 0, 1, "", "detci"], [178, 0, 1, "", "dfmp2"], [179, 0, 1, "", "dfocc"], [180, 0, 1, "", "dlpno"], [181, 0, 1, "", "dmrg"], [182, 0, 1, "", "doublet"], [183, 2, 1, "", "dpdbuf4"], [184, 2, 1, "", "dpdfile2"], [185, 0, 1, "", "dummy_einsums"], [186, 0, 1, "", "dummy_integratorxx"], [187, 0, 1, "", "fcidump_tei_helper"], [188, 0, 1, "", "finalize"], [189, 0, 1, "", "flush_outfile"], [190, 0, 1, "", "fnocc"], [191, 0, 1, "", "get_active_molecule"], [192, 0, 1, "", "get_array_variable"], [193, 0, 1, "", "get_array_variables"], [194, 0, 1, "", "get_datadir"], [195, 0, 1, "", "get_global_option"], [196, 0, 1, "", "get_global_option_list"], [197, 0, 1, "", "get_local_option"], [198, 0, 1, "", "get_memory"], [199, 0, 1, "", "get_num_threads"], [200, 0, 1, "", "get_option"], [201, 0, 1, "", "get_options"], [202, 0, 1, "", "get_output_file"], [203, 0, 1, "", "get_variable"], [204, 0, 1, "", "get_variables"], [205, 0, 1, "", "get_writer_file_prefix"], [206, 0, 1, "", "git_version"], [207, 0, 1, "", "has_array_variable"], [208, 0, 1, "", "has_global_option_changed"], [209, 0, 1, "", "has_local_option_changed"], [210, 0, 1, "", "has_option_changed"], [211, 0, 1, "", "has_scalar_variable"], [212, 0, 1, "", "has_variable"], [213, 0, 1, "", "initialize"], [214, 0, 1, "", "libint2_solid_harmonics_ordering"], [215, 0, 1, "", "mcscf"], [216, 0, 1, "", "mrcc_generate_input"], [217, 0, 1, "", "mrcc_load_densities"], [218, 0, 1, "", "occ"], [219, 0, 1, "", "option_exists_in_module"], [220, 0, 1, "", "options_to_python"], [221, 0, 1, "", "outfile_name"], [222, 0, 1, "", "plugin"], [223, 0, 1, "", "plugin_close"], [224, 0, 1, "", "plugin_close_all"], [225, 0, 1, "", "plugin_load"], [226, 0, 1, "", "prepare_options_for_module"], [227, 0, 1, "", "print_global_options"], [228, 0, 1, "", "print_options"], [229, 0, 1, "", "print_out"], [230, 0, 1, "", "print_variables"], [231, 0, 1, "", "psi_top_srcdir"], [232, 0, 1, "", "psimrcc"], [233, 2, 1, "", "psio_entry"], [234, 0, 1, "", "reopen_outfile"], [235, 0, 1, "", "revoke_global_option_changed"], [236, 0, 1, "", "revoke_local_option_changed"], [237, 0, 1, "", "sapt"], [238, 0, 1, "", "scalar_variable"], [239, 0, 1, "", "scalar_variables"], [240, 0, 1, "", "scatter"], [241, 0, 1, "", "scfgrad"], [242, 0, 1, "", "scfhess"], [243, 0, 1, "", "set_active_molecule"], [244, 0, 1, "", "set_array_variable"], [245, 0, 1, "", "set_datadir"], [246, 0, 1, "", "set_global_option"], [247, 0, 1, "", "set_global_option_python"], [248, 0, 1, "", "set_local_option"], [249, 0, 1, "", "set_local_option_python"], [250, 0, 1, "", "set_memory_bytes"], [251, 0, 1, "", "set_num_threads"], [252, 0, 1, "", "set_output_file"], [253, 0, 1, "", "set_psi_file_prefix"], [254, 0, 1, "", "set_scalar_variable"], [255, 0, 1, "", "set_variable"], [256, 0, 1, "", "test_matrix_dpd_interface"], [257, 0, 1, "", "timer_off"], [258, 0, 1, "", "timer_on"], [259, 0, 1, "", "triplet"], [260, 0, 1, "", "tstart"], [261, 0, 1, "", "tstop"], [262, 0, 1, "", "variable"], [263, 0, 1, "", "variables"], [264, 0, 1, "", "version"]], "psi4.core.AOShellCombinationsIterator": [[3, 3, 1, "", "first"], [3, 3, 1, "", "is_done"], [3, 3, 1, "", "next"], [3, 4, 1, "", "p"], [3, 4, 1, "", "q"], [3, 4, 1, "", "r"], [3, 4, 1, "", "s"]], "psi4.core.BSVec": [[5, 3, 1, "", "append"], [5, 3, 1, "", "clear"], [5, 3, 1, "", "count"], [5, 3, 1, "", "extend"], [5, 3, 1, "", "insert"], [5, 3, 1, "", "pop"], [5, 3, 1, "", "remove"]], "psi4.core.BasisExtents": [[6, 3, 1, "", "basis"], [6, 3, 1, "", "delta"], [6, 3, 1, "", "maxR"], [6, 3, 1, "", "set_delta"], [6, 3, 1, "", "shell_extents"]], "psi4.core.BasisFunctions": [[7, 3, 1, "", "basis_values"], [7, 3, 1, "", "compute_functions"], [7, 3, 1, "", "deriv"], [7, 3, 1, "", "max_functions"], [7, 3, 1, "", "max_points"], [7, 3, 1, "", "set_deriv"]], "psi4.core.BasisSet": [[8, 3, 1, "", "ao_to_shell"], [8, 3, 1, "", "blend"], [8, 3, 1, "", "build"], [8, 3, 1, "", "compute_phi"], [8, 3, 1, "", "construct_from_pydict"], [8, 3, 1, "", "ecp_shell"], [8, 3, 1, "", "ecp_shell_on_center"], [8, 3, 1, "", "function_to_center"], [8, 3, 1, "", "function_to_shell"], [8, 3, 1, "", "genbas"], [8, 3, 1, "", "has_ECP"], [8, 3, 1, "", "has_puream"], [8, 3, 1, "", "make_filename"], [8, 3, 1, "", "max_am"], [8, 3, 1, "", "max_function_per_shell"], [8, 3, 1, "", "max_nprimitive"], [8, 3, 1, "", "molecule"], [8, 3, 1, "", "move_atom"], [8, 3, 1, "", "n_ecp_core"], [8, 3, 1, "", "n_ecp_shell_on_center"], [8, 3, 1, "", "n_frozen_core"], [8, 3, 1, "", "name"], [8, 3, 1, "", "nao"], [8, 3, 1, "", "nbf"], [8, 3, 1, "", "nprimitive"], [8, 3, 1, "", "nshell"], [8, 3, 1, "", "nshell_on_center"], [8, 3, 1, "", "print_detail_out"], [8, 3, 1, "", "print_out"], [8, 3, 1, "", "shell"], [8, 3, 1, "", "shell_on_center"], [8, 3, 1, "", "shell_to_ao_function"], [8, 3, 1, "", "shell_to_basis_function"], [8, 3, 1, "", "shell_to_center"], [8, 3, 1, "", "zero_ao_basis_set"]], "psi4.core.BlockOPoints": [[9, 3, 1, "", "functions_local_to_global"], [9, 3, 1, "", "npoints"], [9, 3, 1, "", "parent_atom"], [9, 3, 1, "", "print_out"], [9, 3, 1, "", "refresh"], [9, 3, 1, "", "shells_local_to_global"], [9, 3, 1, "", "w"], [9, 3, 1, "", "x"], [9, 3, 1, "", "y"], [9, 3, 1, "", "z"]], "psi4.core.CCWavefunction": [[11, 3, 1, "", "get_amplitudes"], [11, 3, 1, "", "total_index"]], "psi4.core.CIVector": [[12, 3, 1, "", "axpy"], [12, 3, 1, "", "close_io_files"], [12, 3, 1, "", "copy"], [12, 3, 1, "", "dcalc"], [12, 3, 1, "", "divide"], [12, 3, 1, "", "init_io_files"], [12, 3, 1, "", "norm"], [12, 4, 1, "", "np"], [12, 3, 1, "", "read"], [12, 3, 1, "", "scale"], [12, 3, 1, "", "set_nvec"], [12, 3, 1, "", "shift"], [12, 3, 1, "", "symnormalize"], [12, 3, 1, "", "vdot"], [12, 3, 1, "", "vector_multiply"], [12, 3, 1, "", "write"], [12, 3, 1, "", "zero"]], "psi4.core.CIWavefunction": [[13, 3, 1, "", "D_vector"], [13, 3, 1, "", "Hd_vector"], [13, 3, 1, "", "ci_nat_orbs"], [13, 3, 1, "", "cleanup_ci"], [13, 3, 1, "", "cleanup_dpd"], [13, 3, 1, "", "compute_state_transfer"], [13, 3, 1, "", "diag_h"], [13, 3, 1, "", "form_opdm"], [13, 3, 1, "", "form_tpdm"], [13, 3, 1, "", "get_dimension"], [13, 3, 1, "", "get_opdm"], [13, 3, 1, "", "get_orbitals"], [13, 3, 1, "", "get_tpdm"], [13, 3, 1, "", "hamiltonian"], [13, 3, 1, "", "mcscf_object"], [13, 3, 1, "", "ndet"], [13, 3, 1, "", "new_civector"], [13, 3, 1, "", "opdm"], [13, 3, 1, "", "pitzer_to_ci_order_onel"], [13, 3, 1, "", "pitzer_to_ci_order_twoel"], [13, 3, 1, "", "print_vector"], [13, 3, 1, "", "reset_ci_H0block"], [13, 3, 1, "", "rotate_mcscf_integrals"], [13, 3, 1, "", "semicanonical_orbs"], [13, 3, 1, "", "set_ci_guess"], [13, 3, 1, "", "set_orbitals"], [13, 3, 1, "", "sigma"], [13, 3, 1, "", "tpdm"], [13, 3, 1, "", "transform_ci_integrals"], [13, 3, 1, "", "transform_mcscf_integrals"]], "psi4.core.CUHF": [[14, 3, 1, "", "c1_deep_copy"], [14, 3, 1, "", "compute_orbital_gradient"], [14, 3, 1, "", "diis"], [14, 3, 1, "", "mintshelper"]], "psi4.core.CdSalc": [[15, 3, 1, "", "irrep"], [15, 3, 1, "", "irrep_index"], [15, 3, 1, "", "print_out"]], "psi4.core.CdSalcList": [[16, 3, 1, "", "create_matrices"], [16, 3, 1, "", "matrix"], [16, 3, 1, "", "matrix_irrep"], [16, 3, 1, "", "ncd"], [16, 3, 1, "", "nirrep"], [16, 3, 1, "", "print_out"], [16, 3, 1, "", "salc_name"]], "psi4.core.CharacterTable": [[17, 3, 1, "", "gamma"], [17, 3, 1, "", "order"], [17, 3, 1, "", "symm_operation"]], "psi4.core.CompositeJK": [[18, 3, 1, "", "clear_D_prev"], [18, 3, 1, "", "do_incfock_iter"], [18, 3, 1, "", "get_COSX_grid"], [18, 3, 1, "", "get_snLinK_max_am"], [18, 3, 1, "", "set_COSX_grid"]], "psi4.core.CorrelationFactor": [[19, 3, 1, "", "set_params"]], "psi4.core.CorrelationTable": [[20, 3, 1, "", "degen"], [20, 3, 1, "", "group"], [20, 3, 1, "", "n"], [20, 3, 1, "", "ngamma"], [20, 3, 1, "", "subdegen"], [20, 3, 1, "", "subgroup"], [20, 3, 1, "", "subn"]], "psi4.core.CubeProperties": [[21, 3, 1, "", "basisset"], [21, 3, 1, "", "compute_density"], [21, 3, 1, "", "compute_orbitals"], [21, 3, 1, "", "compute_properties"], [21, 3, 1, "", "raw_compute_properties"]], "psi4.core.DFEP2Wavefunction": [[26, 3, 1, "", "compute"]], "psi4.core.DFHelper": [[27, 3, 1, "", "add_space"], [27, 3, 1, "", "add_transformation"], [27, 3, 1, "", "clear_all"], [27, 3, 1, "", "clear_spaces"], [27, 3, 1, "", "get_AO_core"], [27, 3, 1, "", "get_AO_size"], [27, 3, 1, "", "get_MO_core"], [27, 3, 1, "", "get_memory"], [27, 3, 1, "", "get_method"], [27, 3, 1, "", "get_schwarz_cutoff"], [27, 3, 1, "", "get_space_size"], [27, 3, 1, "", "get_tensor"], [27, 3, 1, "", "get_tensor_shape"], [27, 3, 1, "", "get_tensor_size"], [27, 3, 1, "", "hold_met"], [27, 3, 1, "", "initialize"], [27, 3, 1, "", "print_header"], [27, 3, 1, "", "set_AO_core"], [27, 3, 1, "", "set_MO_core"], [27, 3, 1, "", "set_memory"], [27, 3, 1, "", "set_method"], [27, 3, 1, "", "set_nthreads"], [27, 3, 1, "", "set_schwarz_cutoff"], [27, 3, 1, "", "set_subalgo"], [27, 3, 1, "", "transform"], [27, 3, 1, "", "transpose"]], "psi4.core.DFTGrid": [[29, 3, 1, "", "build"]], "psi4.core.DFTensor": [[30, 3, 1, "", "Idfmo"], [30, 3, 1, "", "Imo"], [30, 3, 1, "", "Qmo"], [30, 3, 1, "", "Qoo"], [30, 3, 1, "", "Qov"], [30, 3, 1, "", "Qso"], [30, 3, 1, "", "Qvv"]], "psi4.core.Deriv": [[61, 3, 1, "", "compute"], [61, 3, 1, "", "compute_df"], [61, 3, 1, "", "set_deriv_density_backtransformed"], [61, 3, 1, "", "set_ignore_reference"], [61, 3, 1, "", "set_tpdm_presorted"]], "psi4.core.DerivCalcType": [[62, 4, 1, "", "Correlated"], [62, 4, 1, "", "Default"], [62, 4, 1, "", "name"], [62, 4, 1, "", "value"]], "psi4.core.DiagonalizeOrder": [[63, 4, 1, "", "Ascending"], [63, 4, 1, "", "Descending"], [63, 4, 1, "", "name"], [63, 4, 1, "", "value"]], "psi4.core.Dimension": [[64, 3, 1, "", "fill"], [64, 3, 1, "", "from_list"], [64, 3, 1, "", "init"], [64, 3, 1, "", "max"], [64, 3, 1, "", "n"], [64, 4, 1, "", "name"], [64, 3, 1, "", "print_out"], [64, 3, 1, "", "sum"], [64, 3, 1, "", "to_tuple"], [64, 3, 1, "", "zero"]], "psi4.core.DirectJK": [[66, 3, 1, "", "do_incfock_iter"]], "psi4.core.Dispersion": [[68, 3, 1, "", "a1"], [68, 3, 1, "", "a2"], [68, 3, 1, "", "bibtex"], [68, 3, 1, "", "build"], [68, 3, 1, "", "citation"], [68, 3, 1, "", "compute_energy"], [68, 3, 1, "", "compute_gradient"], [68, 3, 1, "", "compute_hessian"], [68, 3, 1, "", "d"], [68, 3, 1, "", "description"], [68, 3, 1, "", "name"], [68, 3, 1, "", "print_energy"], [68, 3, 1, "", "print_gradient"], [68, 3, 1, "", "print_hessian"], [68, 3, 1, "", "print_out"], [68, 3, 1, "", "s6"], [68, 3, 1, "", "s8"], [68, 3, 1, "", "set_bibtex"], [68, 3, 1, "", "set_citation"], [68, 3, 1, "", "set_description"], [68, 3, 1, "", "set_name"], [68, 3, 1, "", "sr6"]], "psi4.core.ESPPropCalc": [[70, 3, 1, "", "compute_esp_over_grid_in_memory"], [70, 3, 1, "", "compute_field_over_grid_in_memory"]], "psi4.core.ExternalPotential": [[73, 3, 1, "", "addBasis"], [73, 3, 1, "", "addCharge"], [73, 3, 1, "", "appendCharges"], [73, 3, 1, "", "clear"], [73, 3, 1, "", "computeExternExternInteraction"], [73, 3, 1, "", "computeNuclearEnergy"], [73, 3, 1, "", "computePotentialMatrix"], [73, 3, 1, "", "getCharges"], [73, 3, 1, "", "gradient_on_charges"], [73, 3, 1, "", "print_out"], [73, 3, 1, "", "setName"]], "psi4.core.FCHKWriter": [[74, 3, 1, "", "SCF_Dtot"], [74, 3, 1, "", "set_postscf_density_label"], [74, 3, 1, "", "write"]], "psi4.core.FDDS_Dispersion": [[75, 3, 1, "", "R_A"], [75, 3, 1, "", "R_B"], [75, 3, 1, "", "aux_overlap"], [75, 3, 1, "", "form_aux_matrices"], [75, 3, 1, "", "form_unc_amplitude"], [75, 3, 1, "", "get_tensor_pqQ"], [75, 3, 1, "", "metric"], [75, 3, 1, "", "metric_inv"], [75, 3, 1, "", "print_tensor_pqQ"], [75, 3, 1, "", "project_densities"]], "psi4.core.FISAPT": [[76, 3, 1, "", "coulomb"], [76, 3, 1, "", "dHF"], [76, 3, 1, "", "disp"], [76, 3, 1, "", "do_cubes"], [76, 3, 1, "", "elst"], [76, 3, 1, "", "exch"], [76, 3, 1, "", "fdisp"], [76, 3, 1, "", "felst"], [76, 3, 1, "", "fexch"], [76, 3, 1, "", "find"], [76, 3, 1, "", "flocalize"], [76, 3, 1, "", "freeze_core"], [76, 3, 1, "", "ind"], [76, 3, 1, "", "kinetic"], [76, 3, 1, "", "localize"], [76, 3, 1, "", "matrices"], [76, 3, 1, "", "molecule"], [76, 3, 1, "", "nuclear"], [76, 3, 1, "", "overlap"], [76, 3, 1, "", "partition"], [76, 3, 1, "", "print_header"], [76, 3, 1, "", "print_trailer"], [76, 3, 1, "", "raw_plot"], [76, 3, 1, "", "scalars"], [76, 3, 1, "", "scf"], [76, 3, 1, "", "sinf_disp"], [76, 3, 1, "", "unify"], [76, 3, 1, "", "unify_part2"], [76, 3, 1, "", "vectors"]], "psi4.core.FittedSlaterCorrelationFactor": [[77, 3, 1, "", "exponent"]], "psi4.core.FittingMetric": [[78, 3, 1, "", "form_QR_inverse"], [78, 3, 1, "", "form_cholesky_inverse"], [78, 3, 1, "", "form_eig_inverse"], [78, 3, 1, "", "form_fitting_metric"], [78, 3, 1, "", "form_full_inverse"], [78, 3, 1, "", "get_algorithm"], [78, 3, 1, "", "get_metric"], [78, 3, 1, "", "get_pivots"], [78, 3, 1, "", "get_reverse_pivots"], [78, 3, 1, "", "is_inverted"], [78, 3, 1, "", "is_poisson"]], "psi4.core.FragmentType": [[79, 4, 1, "", "Absent"], [79, 4, 1, "", "Ghost"], [79, 4, 1, "", "Real"], [79, 4, 1, "", "name"], [79, 4, 1, "", "value"]], "psi4.core.Functional": [[80, 3, 1, "", "alpha"], [80, 3, 1, "", "build_base"], [80, 3, 1, "", "citation"], [80, 3, 1, "", "compute_functional"], [80, 3, 1, "", "density_cutoff"], [80, 3, 1, "", "description"], [80, 3, 1, "", "is_gga"], [80, 3, 1, "", "is_lrc"], [80, 3, 1, "", "is_meta"], [80, 3, 1, "", "lsda_cutoff"], [80, 3, 1, "", "meta_cutoff"], [80, 3, 1, "", "name"], [80, 3, 1, "", "omega"], [80, 3, 1, "", "print_detail"], [80, 3, 1, "", "print_out"], [80, 3, 1, "", "set_alpha"], [80, 3, 1, "", "set_citation"], [80, 3, 1, "", "set_density_cutoff"], [80, 3, 1, "", "set_description"], [80, 3, 1, "", "set_gga"], [80, 3, 1, "", "set_lsda_cutoff"], [80, 3, 1, "", "set_meta"], [80, 3, 1, "", "set_meta_cutoff"], [80, 3, 1, "", "set_name"], [80, 3, 1, "", "set_omega"], [80, 3, 1, "", "set_parameter"]], "psi4.core.GaussianShell": [[81, 4, 1, "", "AMCHAR"], [81, 4, 1, "", "am"], [81, 4, 1, "", "amchar"], [81, 3, 1, "", "coef"], [81, 3, 1, "", "coord"], [81, 3, 1, "", "erd_coef"], [81, 3, 1, "", "exp"], [81, 4, 1, "", "function_index"], [81, 3, 1, "", "is_cartesian"], [81, 3, 1, "", "is_pure"], [81, 4, 1, "", "ncartesian"], [81, 4, 1, "", "ncenter"], [81, 4, 1, "", "nfunction"], [81, 4, 1, "", "nprimitive"], [81, 3, 1, "", "original_coef"]], "psi4.core.GaussianType": [[82, 4, 1, "", "Cartesian"], [82, 4, 1, "", "Pure"], [82, 4, 1, "", "name"], [82, 4, 1, "", "value"]], "psi4.core.GeometryUnits": [[83, 4, 1, "", "Angstrom"], [83, 4, 1, "", "Bohr"], [83, 4, 1, "", "name"], [83, 4, 1, "", "value"]], "psi4.core.HF": [[84, 4, 1, "", "MOM_excited_"], [84, 4, 1, "", "MOM_performed_"], [84, 3, 1, "", "V_potential"], [84, 3, 1, "", "Va"], [84, 3, 1, "", "Vb"], [84, 4, 1, "", "attempt_number_"], [84, 3, 1, "", "check_phases"], [84, 3, 1, "", "clear_external_cpscf_perturbations"], [84, 3, 1, "", "clear_external_potentials"], [84, 3, 1, "", "compute_E"], [84, 3, 1, "", "compute_energy"], [84, 3, 1, "", "compute_fvpi"], [84, 3, 1, "", "compute_initial_E"], [84, 3, 1, "", "compute_orbital_gradient"], [84, 3, 1, "", "compute_spin_contamination"], [84, 3, 1, "", "cphf_Hx"], [84, 3, 1, "", "cphf_converged"], [84, 3, 1, "", "cphf_solve"], [84, 3, 1, "", "damping_update"], [84, 3, 1, "", "diis"], [84, 4, 1, "", "diis_enabled_"], [84, 4, 1, "", "diis_manager_"], [84, 4, 1, "", "diis_start_"], [84, 3, 1, "", "finalize"], [84, 3, 1, "", "finalize_energy"], [84, 3, 1, "", "find_occupation"], [84, 3, 1, "", "form_C"], [84, 3, 1, "", "form_D"], [84, 3, 1, "", "form_F"], [84, 3, 1, "", "form_FDSmSDF"], [84, 3, 1, "", "form_G"], [84, 3, 1, "", "form_H"], [84, 3, 1, "", "form_Shalf"], [84, 3, 1, "", "form_V"], [84, 3, 1, "", "form_initial_C"], [84, 3, 1, "", "form_initial_F"], [84, 4, 1, "", "frac_performed_"], [84, 3, 1, "", "frac_renormalize"], [84, 3, 1, "", "functional"], [84, 3, 1, "", "get_energies"], [84, 3, 1, "", "guess"], [84, 3, 1, "", "guess_Ca"], [84, 3, 1, "", "guess_Cb"], [84, 3, 1, "", "initialize"], [84, 3, 1, "", "initialize_gtfock_jk"], [84, 3, 1, "", "initialize_jk"], [84, 4, 1, "", "initialized_diis_manager_"], [84, 4, 1, "", "iteration_"], [84, 4, 1, "", "iteration_energies"], [84, 3, 1, "", "iterations"], [84, 3, 1, "", "jk"], [84, 3, 1, "", "occupation_a"], [84, 3, 1, "", "occupation_b"], [84, 3, 1, "", "onel_Hx"], [84, 3, 1, "", "print_energies"], [84, 3, 1, "", "print_header"], [84, 3, 1, "", "print_orbitals"], [84, 3, 1, "", "print_preiterations"], [84, 3, 1, "", "print_stability_analysis"], [84, 3, 1, "", "push_back_external_potential"], [84, 4, 1, "", "reset_occ_"], [84, 3, 1, "", "reset_occupation"], [84, 3, 1, "", "rotate_orbitals"], [84, 4, 1, "", "sad_"], [84, 3, 1, "", "save_density_and_energy"], [84, 3, 1, "", "scf_type"], [84, 3, 1, "", "semicanonicalize"], [84, 3, 1, "", "set_energies"], [84, 3, 1, "", "set_external_cpscf_perturbation"], [84, 3, 1, "", "set_jk"], [84, 3, 1, "", "set_sad_basissets"], [84, 3, 1, "", "set_sad_fitting_basissets"], [84, 3, 1, "", "soscf_update"], [84, 3, 1, "", "stability_analysis"], [84, 3, 1, "", "twoel_Hx"], [84, 3, 1, "", "validate_diis"]], "psi4.core.IO": [[86, 3, 1, "", "change_file_namespace"], [86, 3, 1, "", "close"], [86, 3, 1, "", "exists"], [86, 3, 1, "", "get_default_namespace"], [86, 3, 1, "", "getpid"], [86, 3, 1, "", "open"], [86, 3, 1, "", "open_check"], [86, 3, 1, "", "rehash"], [86, 3, 1, "", "set_default_namespace"], [86, 3, 1, "", "set_pid"], [86, 3, 1, "", "shared_object"], [86, 3, 1, "", "state"], [86, 3, 1, "", "tocclean"], [86, 3, 1, "", "tocentry_exists"], [86, 3, 1, "", "tocprint"], [86, 3, 1, "", "tocscan"], [86, 3, 1, "", "tocwrite"]], "psi4.core.IOManager": [[87, 3, 1, "", "crashclean"], [87, 3, 1, "", "get_default_path"], [87, 3, 1, "", "get_file_path"], [87, 3, 1, "", "mark_file_for_retention"], [87, 3, 1, "", "print_out"], [87, 3, 1, "", "psiclean"], [87, 3, 1, "", "set_default_path"], [87, 3, 1, "", "set_specific_path"], [87, 3, 1, "", "set_specific_retention"], [87, 3, 1, "", "shared_object"], [87, 3, 1, "", "write_scratch_file"]], "psi4.core.IntVector": [[88, 3, 1, "", "add"], [88, 3, 1, "", "clone"], [88, 3, 1, "", "copy"], [88, 3, 1, "", "dim"], [88, 3, 1, "", "dimpi"], [88, 3, 1, "", "get"], [88, 3, 1, "", "get_block"], [88, 3, 1, "", "init"], [88, 3, 1, "", "iota"], [88, 4, 1, "", "name"], [88, 3, 1, "", "nirrep"], [88, 3, 1, "", "print_out"], [88, 3, 1, "", "set"], [88, 3, 1, "", "set_block"], [88, 3, 1, "", "zero"]], "psi4.core.IntegralFactory": [[89, 3, 1, "", "ao_angular_momentum"], [89, 3, 1, "", "ao_dipole"], [89, 3, 1, "", "ao_kinetic"], [89, 3, 1, "", "ao_multipole_potential"], [89, 3, 1, "", "ao_multipoles"], [89, 3, 1, "", "ao_nabla"], [89, 3, 1, "", "ao_overlap"], [89, 3, 1, "", "ao_potential"], [89, 3, 1, "", "ao_quadrupole"], [89, 3, 1, "", "ao_traceless_quadrupole"], [89, 3, 1, "", "electric_field"], [89, 3, 1, "", "electrostatic"], [89, 3, 1, "", "erf_complement_eri"], [89, 3, 1, "", "erf_eri"], [89, 3, 1, "", "eri"], [89, 3, 1, "", "f12"], [89, 3, 1, "", "f12_double_commutator"], [89, 3, 1, "", "f12_squared"], [89, 3, 1, "", "f12g12"], [89, 3, 1, "", "overlap_3c"], [89, 3, 1, "", "shells_iterator"], [89, 3, 1, "", "so_angular_momentum"], [89, 3, 1, "", "so_dipole"], [89, 3, 1, "", "so_kinetic"], [89, 3, 1, "", "so_multipoles"], [89, 3, 1, "", "so_nabla"], [89, 3, 1, "", "so_overlap"], [89, 3, 1, "", "so_potential"], [89, 3, 1, "", "so_quadrupole"], [89, 3, 1, "", "so_traceless_quadrupole"]], "psi4.core.IntegralTransform": [[90, 3, 1, "", "DPD_ID"], [90, 3, 1, "", "alpha_corr_to_pitzer"], [90, 3, 1, "", "backtransform_density"], [90, 3, 1, "", "backtransform_tpdm_restricted"], [90, 3, 1, "", "backtransform_tpdm_unrestricted"], [90, 3, 1, "", "beta_corr_to_pitzer"], [90, 3, 1, "", "compute_fock_like_matrices"], [90, 3, 1, "", "get_dpd_id"], [90, 3, 1, "", "get_frozen_core_energy"], [90, 3, 1, "", "get_keep_dpd_so_ints"], [90, 3, 1, "", "get_keep_ht_ints"], [90, 3, 1, "", "get_keep_iwl_so_ints"], [90, 3, 1, "", "get_memory"], [90, 3, 1, "", "get_print"], [90, 3, 1, "", "get_psio"], [90, 3, 1, "", "get_tei_already_presorted"], [90, 3, 1, "", "initialize"], [90, 3, 1, "", "nirrep"], [90, 3, 1, "", "presort_so_tei"], [90, 3, 1, "", "print_dpd_lookup"], [90, 3, 1, "", "reset_so_int"], [90, 3, 1, "", "set_aa_int_name"], [90, 3, 1, "", "set_ab_int_name"], [90, 3, 1, "", "set_bb_int_name"], [90, 3, 1, "", "set_dpd_id"], [90, 3, 1, "", "set_dpd_int_file"], [90, 3, 1, "", "set_keep_dpd_so_ints"], [90, 3, 1, "", "set_keep_ht_ints"], [90, 3, 1, "", "set_keep_iwl_so_ints"], [90, 3, 1, "", "set_memory"], [90, 3, 1, "", "set_orbitals"], [90, 3, 1, "", "set_print"], [90, 3, 1, "", "set_psio"], [90, 3, 1, "", "set_so_tei_file"], [90, 3, 1, "", "set_tei_already_presorted"], [90, 3, 1, "", "set_tpdm_already_presorted"], [90, 3, 1, "", "set_write_dpd_so_tpdm"], [90, 3, 1, "", "transform_tei"], [90, 3, 1, "", "transform_tei_first_half"], [90, 3, 1, "", "transform_tei_second_half"], [90, 3, 1, "", "update_orbitals"]], "psi4.core.IrreducibleRepresentation": [[91, 3, 1, "", "character"], [91, 3, 1, "", "symbol"]], "psi4.core.JK": [[92, 3, 1, "", "C_add"], [92, 3, 1, "", "C_clear"], [92, 3, 1, "", "C_left_add"], [92, 3, 1, "", "C_right_add"], [92, 3, 1, "", "D"], [92, 3, 1, "", "J"], [92, 3, 1, "", "K"], [92, 3, 1, "", "basisset"], [92, 3, 1, "", "build"], [92, 3, 1, "", "build_JK"], [92, 3, 1, "", "compute"], [92, 3, 1, "", "computed_shells_per_iter"], [92, 3, 1, "", "finalize"], [92, 3, 1, "", "get_omega"], [92, 3, 1, "", "get_omega_alpha"], [92, 3, 1, "", "get_omega_beta"], [92, 3, 1, "", "get_wcombine"], [92, 3, 1, "", "initialize"], [92, 3, 1, "", "memory_estimate"], [92, 3, 1, "", "name"], [92, 3, 1, "", "print_header"], [92, 3, 1, "", "set_cutoff"], [92, 3, 1, "", "set_do_J"], [92, 3, 1, "", "set_do_K"], [92, 3, 1, "", "set_do_wK"], [92, 3, 1, "", "set_memory"], [92, 3, 1, "", "set_omega"], [92, 3, 1, "", "set_omega_alpha"], [92, 3, 1, "", "set_omega_beta"], [92, 3, 1, "", "set_omp_nthread"], [92, 3, 1, "", "set_print"], [92, 3, 1, "", "set_wcombine"], [92, 3, 1, "", "wK"]], "psi4.core.LS_THC_Computer": [[94, 3, 1, "", "compute_thc_factorization"], [94, 3, 1, "", "get_Z"], [94, 3, 1, "", "get_x1"], [94, 3, 1, "", "get_x2"], [94, 3, 1, "", "get_x3"], [94, 3, 1, "", "get_x4"]], "psi4.core.LaplaceDenominator": [[95, 3, 1, "", "denominator_occ"], [95, 3, 1, "", "denominator_vir"]], "psi4.core.LibXCFunctional": [[96, 3, 1, "", "density_cutoff"], [96, 3, 1, "", "get_mix_data"], [96, 3, 1, "", "query_libxc"], [96, 3, 1, "", "set_density_cutoff"], [96, 3, 1, "", "set_omega"], [96, 3, 1, "", "set_tweak"], [96, 3, 1, "", "xclib_description"]], "psi4.core.Localizer": [[97, 4, 1, "", "L"], [97, 4, 1, "", "U"], [97, 3, 1, "", "build"], [97, 4, 1, "", "converged"], [97, 3, 1, "", "localize"]], "psi4.core.MOSpace": [[98, 3, 1, "", "aIndex"], [98, 3, 1, "", "aOrbs"], [98, 3, 1, "", "all"], [98, 3, 1, "", "bIndex"], [98, 3, 1, "", "bOrbs"], [98, 3, 1, "", "dum"], [98, 3, 1, "", "fzc"], [98, 3, 1, "", "fzv"], [98, 3, 1, "", "label"], [98, 3, 1, "", "nil"], [98, 3, 1, "", "occ"], [98, 3, 1, "", "vir"]], "psi4.core.MOWriter": [[99, 3, 1, "", "write"]], "psi4.core.Matrix": [[100, 3, 1, "", "absmax"], [100, 3, 1, "", "accumulate_product"], [100, 3, 1, "", "add"], [100, 3, 1, "", "add_and_orthogonalize_row"], [100, 3, 1, "", "apply_denominator"], [100, 3, 1, "", "array_interface"], [100, 3, 1, "", "axpy"], [100, 3, 1, "", "back_transform"], [100, 3, 1, "", "chain_dot"], [100, 3, 1, "", "cholesky_factorize"], [100, 3, 1, "", "clone"], [100, 3, 1, "", "coldim"], [100, 3, 1, "", "cols"], [100, 3, 1, "", "copy"], [100, 3, 1, "", "copy_lower_to_upper"], [100, 3, 1, "", "copy_upper_to_lower"], [100, 3, 1, "", "diagonalize"], [100, 3, 1, "", "doublet"], [100, 3, 1, "", "from_array"], [100, 3, 1, "", "from_list"], [100, 3, 1, "", "from_serial"], [100, 3, 1, "", "gemm"], [100, 3, 1, "", "general_invert"], [100, 3, 1, "", "get"], [100, 3, 1, "", "get_block"], [100, 3, 1, "", "hermitivitize"], [100, 3, 1, "", "hermitize"], [100, 3, 1, "", "identity"], [100, 3, 1, "", "invert"], [100, 3, 1, "", "load"], [100, 3, 1, "", "load_mpqc"], [100, 4, 1, "", "name"], [100, 3, 1, "", "nirrep"], [100, 4, 1, "", "np"], [100, 3, 1, "", "np_read"], [100, 3, 1, "", "np_write"], [100, 4, 1, "", "nph"], [100, 3, 1, "", "partial_cholesky_factorize"], [100, 3, 1, "", "power"], [100, 3, 1, "", "print_atom_vector"], [100, 3, 1, "", "print_out"], [100, 3, 1, "", "pseudoinverse"], [100, 3, 1, "", "remove_symmetry"], [100, 3, 1, "", "rms"], [100, 3, 1, "", "rotate_columns"], [100, 3, 1, "", "rowdim"], [100, 3, 1, "", "rows"], [100, 3, 1, "", "save"], [100, 3, 1, "", "scale"], [100, 3, 1, "", "scale_column"], [100, 3, 1, "", "scale_row"], [100, 3, 1, "", "schmidt"], [100, 3, 1, "", "set"], [100, 3, 1, "", "set_block"], [100, 4, 1, "", "shape"], [100, 3, 1, "", "subtract"], [100, 3, 1, "", "sum_of_squares"], [100, 3, 1, "", "symmetrize_gradient"], [100, 3, 1, "", "symmetry"], [100, 3, 1, "", "to_array"], [100, 3, 1, "", "to_serial"], [100, 3, 1, "", "trace"], [100, 3, 1, "", "transform"], [100, 3, 1, "", "transpose"], [100, 3, 1, "", "transpose_this"], [100, 3, 1, "", "triplet"], [100, 3, 1, "", "vector_dot"], [100, 3, 1, "", "zero"], [100, 3, 1, "", "zero_diagonal"], [100, 3, 1, "", "zero_lower"], [100, 3, 1, "", "zero_upper"]], "psi4.core.MatrixFactory": [[101, 3, 1, "", "create_matrix"]], "psi4.core.MemDFJK": [[102, 3, 1, "", "dfh"]], "psi4.core.MintsHelper": [[103, 3, 1, "", "ao_3center_deriv1"], [103, 3, 1, "", "ao_3coverlap"], [103, 3, 1, "", "ao_angular_momentum"], [103, 3, 1, "", "ao_dipole"], [103, 3, 1, "", "ao_dkh"], [103, 3, 1, "", "ao_efp_multipole_potential"], [103, 3, 1, "", "ao_elec_dip_deriv1"], [103, 3, 1, "", "ao_erf_eri"], [103, 3, 1, "", "ao_eri"], [103, 3, 1, "", "ao_eri_shell"], [103, 3, 1, "", "ao_f12"], [103, 3, 1, "", "ao_f12_double_commutator"], [103, 3, 1, "", "ao_f12_squared"], [103, 3, 1, "", "ao_f12g12"], [103, 3, 1, "", "ao_kinetic"], [103, 3, 1, "", "ao_metric_deriv1"], [103, 3, 1, "", "ao_multipole_potential"], [103, 3, 1, "", "ao_multipoles"], [103, 3, 1, "", "ao_nabla"], [103, 3, 1, "", "ao_oei_deriv1"], [103, 3, 1, "", "ao_oei_deriv2"], [103, 3, 1, "", "ao_overlap"], [103, 3, 1, "", "ao_overlap_half_deriv1"], [103, 3, 1, "", "ao_potential"], [103, 3, 1, "", "ao_potential_erf"], [103, 3, 1, "", "ao_potential_erf_complement"], [103, 3, 1, "", "ao_pvp"], [103, 3, 1, "", "ao_quadrupole"], [103, 3, 1, "", "ao_tei_deriv1"], [103, 3, 1, "", "ao_tei_deriv2"], [103, 3, 1, "", "ao_traceless_quadrupole"], [103, 3, 1, "", "basisset"], [103, 3, 1, "", "cdsalcs"], [103, 3, 1, "", "core_hamiltonian_grad"], [103, 3, 1, "", "dipole_grad"], [103, 3, 1, "", "electric_field"], [103, 3, 1, "", "electric_field_value"], [103, 3, 1, "", "electrostatic_potential_value"], [103, 3, 1, "", "f12_cgtg"], [103, 3, 1, "", "factory"], [103, 3, 1, "", "induction_operator"], [103, 3, 1, "", "integral"], [103, 3, 1, "", "integrals"], [103, 3, 1, "", "integrals_erf"], [103, 3, 1, "", "integrals_erfc"], [103, 3, 1, "", "kinetic_grad"], [103, 3, 1, "", "mo_elec_dip_deriv1"], [103, 3, 1, "", "mo_erf_eri"], [103, 3, 1, "", "mo_eri"], [103, 3, 1, "", "mo_f12"], [103, 3, 1, "", "mo_f12_double_commutator"], [103, 3, 1, "", "mo_f12_squared"], [103, 3, 1, "", "mo_f12g12"], [103, 3, 1, "", "mo_oei_deriv1"], [103, 3, 1, "", "mo_oei_deriv2"], [103, 3, 1, "", "mo_overlap_half_deriv1"], [103, 3, 1, "", "mo_spin_eri"], [103, 3, 1, "", "mo_tei_deriv1"], [103, 3, 1, "", "mo_tei_deriv2"], [103, 3, 1, "", "mo_transform"], [103, 3, 1, "", "multipole_grad"], [103, 3, 1, "", "nbf"], [103, 3, 1, "", "one_electron_integrals"], [103, 3, 1, "", "overlap_grad"], [103, 3, 1, "", "perturb_grad"], [103, 3, 1, "", "petite_list"], [103, 3, 1, "", "petite_list1"], [103, 3, 1, "", "play"], [103, 3, 1, "", "potential_grad"], [103, 3, 1, "", "set_basisset"], [103, 3, 1, "", "set_print"], [103, 3, 1, "", "so_angular_momentum"], [103, 3, 1, "", "so_dipole"], [103, 3, 1, "", "so_dkh"], [103, 3, 1, "", "so_kinetic"], [103, 3, 1, "", "so_nabla"], [103, 3, 1, "", "so_overlap"], [103, 3, 1, "", "so_potential"], [103, 3, 1, "", "so_quadrupole"], [103, 3, 1, "", "so_traceless_quadrupole"], [103, 3, 1, "", "sobasisset"]], "psi4.core.MoldenWriter": [[104, 3, 1, "", "write"]], "psi4.core.MolecularGrid": [[105, 3, 1, "", "atomic_blocks"], [105, 3, 1, "", "blocks"], [105, 3, 1, "", "collocation_size"], [105, 3, 1, "", "max_functions"], [105, 3, 1, "", "max_points"], [105, 3, 1, "", "npoints"], [105, 3, 1, "", "orientation"], [105, 3, 1, "", "print"]], "psi4.core.Molecule": [[106, 3, 1, "", "B787"], [106, 3, 1, "", "BFS"], [106, 3, 1, "", "Z"], [106, 3, 1, "", "activate_all_fragments"], [106, 3, 1, "", "add_atom"], [106, 3, 1, "", "atom_at_position"], [106, 3, 1, "", "basis_on_atom"], [106, 3, 1, "", "center_of_mass"], [106, 3, 1, "", "charge"], [106, 3, 1, "", "clone"], [106, 3, 1, "", "com_fixed"], [106, 3, 1, "", "comment"], [106, 3, 1, "", "connectivity"], [106, 3, 1, "", "create_psi4_string_from_molecule"], [106, 3, 1, "", "deactivate_all_fragments"], [106, 3, 1, "", "distance_matrix"], [106, 3, 1, "", "extract_subsets"], [106, 3, 1, "", "fZ"], [106, 3, 1, "", "fcharge"], [106, 3, 1, "", "find_highest_point_group"], [106, 3, 1, "", "find_point_group"], [106, 3, 1, "", "fix_com"], [106, 3, 1, "", "fix_orientation"], [106, 3, 1, "", "flabel"], [106, 3, 1, "", "fmass"], [106, 3, 1, "", "form_symmetry_information"], [106, 3, 1, "", "format_molecule_for_mol"], [106, 3, 1, "", "from_arrays"], [106, 3, 1, "", "from_dict"], [106, 3, 1, "", "from_schema"], [106, 3, 1, "", "from_string"], [106, 3, 1, "", "fsymbol"], [106, 3, 1, "", "ftrue_atomic_number"], [106, 3, 1, "", "full_geometry"], [106, 3, 1, "", "full_pg_n"], [106, 3, 1, "", "fx"], [106, 3, 1, "", "fy"], [106, 3, 1, "", "fz"], [106, 3, 1, "", "geometry"], [106, 3, 1, "", "get_fragment_charges"], [106, 3, 1, "", "get_fragment_multiplicities"], [106, 3, 1, "", "get_fragment_types"], [106, 3, 1, "", "get_fragments"], [106, 3, 1, "", "get_full_point_group"], [106, 3, 1, "", "get_full_point_group_with_n"], [106, 3, 1, "", "get_variable"], [106, 3, 1, "", "has_zmatrix"], [106, 3, 1, "", "inertia_tensor"], [106, 3, 1, "", "input_units_to_au"], [106, 3, 1, "", "irrep_labels"], [106, 3, 1, "", "is_variable"], [106, 3, 1, "", "label"], [106, 3, 1, "", "mass"], [106, 3, 1, "", "mass_number"], [106, 3, 1, "", "molecular_charge"], [106, 3, 1, "", "move_to_com"], [106, 3, 1, "", "multiplicity"], [106, 3, 1, "", "nallatom"], [106, 3, 1, "", "name"], [106, 3, 1, "", "natom"], [106, 3, 1, "", "nfragments"], [106, 3, 1, "", "nuclear_dipole"], [106, 3, 1, "", "nuclear_repulsion_energy"], [106, 3, 1, "", "nuclear_repulsion_energy_deriv1"], [106, 3, 1, "", "nuclear_repulsion_energy_deriv2"], [106, 3, 1, "", "orientation_fixed"], [106, 3, 1, "", "point_group"], [106, 3, 1, "", "print_bond_angles"], [106, 3, 1, "", "print_cluster"], [106, 3, 1, "", "print_distances"], [106, 3, 1, "", "print_in_input_format"], [106, 3, 1, "", "print_out"], [106, 3, 1, "", "print_out_in_angstrom"], [106, 3, 1, "", "print_out_in_bohr"], [106, 3, 1, "", "print_out_of_planes"], [106, 3, 1, "", "print_rotational_constants"], [106, 3, 1, "", "provenance"], [106, 3, 1, "", "reinterpret_coordentry"], [106, 3, 1, "", "reset_point_group"], [106, 3, 1, "", "rotational_constants"], [106, 3, 1, "", "rotational_symmetry_number"], [106, 3, 1, "", "rotor_type"], [106, 3, 1, "", "run_dftd3"], [106, 3, 1, "", "run_dftd4"], [106, 3, 1, "", "run_gcp"], [106, 3, 1, "", "save_string_xyz"], [106, 3, 1, "", "save_string_xyz_file"], [106, 3, 1, "", "save_xyz_file"], [106, 3, 1, "", "schoenflies_symbol"], [106, 3, 1, "", "scramble"], [106, 3, 1, "", "set_active_fragment"], [106, 3, 1, "", "set_active_fragments"], [106, 3, 1, "", "set_basis_all_atoms"], [106, 3, 1, "", "set_basis_by_label"], [106, 3, 1, "", "set_basis_by_number"], [106, 3, 1, "", "set_basis_by_symbol"], [106, 3, 1, "", "set_comment"], [106, 3, 1, "", "set_connectivity"], [106, 3, 1, "", "set_full_geometry"], [106, 3, 1, "", "set_geometry"], [106, 3, 1, "", "set_ghost_fragment"], [106, 3, 1, "", "set_ghost_fragments"], [106, 3, 1, "", "set_input_units_to_au"], [106, 3, 1, "", "set_mass"], [106, 3, 1, "", "set_molecular_charge"], [106, 3, 1, "", "set_multiplicity"], [106, 3, 1, "", "set_name"], [106, 3, 1, "", "set_nuclear_charge"], [106, 3, 1, "", "set_point_group"], [106, 3, 1, "", "set_provenance"], [106, 3, 1, "", "set_units"], [106, 3, 1, "", "set_variable"], [106, 3, 1, "", "symbol"], [106, 3, 1, "", "symmetrize"], [106, 3, 1, "", "symmetry_from_input"], [106, 3, 1, "", "to_arrays"], [106, 3, 1, "", "to_dict"], [106, 3, 1, "", "to_schema"], [106, 3, 1, "", "to_string"], [106, 3, 1, "", "translate"], [106, 3, 1, "", "true_atomic_number"], [106, 3, 1, "", "units"], [106, 3, 1, "", "update_geometry"], [106, 3, 1, "", "x"], [106, 3, 1, "", "xyz"], [106, 3, 1, "", "y"], [106, 3, 1, "", "z"]], "psi4.core.MultipoleSymmetry": [[108, 3, 1, "", "create_matrices"]], "psi4.core.NumIntHelper": [[110, 3, 1, "", "dd_density_integral"], [110, 3, 1, "", "density_integral"], [110, 3, 1, "", "numint_grid"], [110, 3, 1, "", "potential_integral"]], "psi4.core.OEProp": [[111, 3, 1, "", "Exvals"], [111, 3, 1, "", "Eyvals"], [111, 3, 1, "", "Ezvals"], [111, 3, 1, "", "Vvals"], [111, 3, 1, "", "add"], [111, 3, 1, "", "clear"], [111, 3, 1, "", "compute"], [111, 3, 1, "", "set_Da_ao"], [111, 3, 1, "", "set_Da_mo"], [111, 3, 1, "", "set_Da_so"], [111, 3, 1, "", "set_Db_ao"], [111, 3, 1, "", "set_Db_mo"], [111, 3, 1, "", "set_Db_so"], [111, 3, 1, "", "set_names"], [111, 3, 1, "", "set_title"], [111, 4, 1, "", "valid_methods"]], "psi4.core.OneBodyAOInt": [[112, 4, 1, "", "basis"], [112, 4, 1, "", "basis1"], [112, 4, 1, "", "basis2"], [112, 3, 1, "", "compute"], [112, 3, 1, "", "compute_shell"], [112, 4, 1, "", "origin"]], "psi4.core.OneBodySOInt": [[113, 4, 1, "", "basis"], [113, 4, 1, "", "basis1"], [113, 4, 1, "", "basis2"]], "psi4.core.Options": [[114, 3, 1, "", "add_array"], [114, 3, 1, "", "add_bool"], [114, 3, 1, "", "add_int"], [114, 3, 1, "", "add_str"], [114, 3, 1, "", "add_str_i"], [114, 3, 1, "", "get_bool"], [114, 3, 1, "", "get_current_module"], [114, 3, 1, "", "get_double"], [114, 3, 1, "", "get_int"], [114, 3, 1, "", "get_int_vector"], [114, 3, 1, "", "get_str"], [114, 3, 1, "", "print_global_options"], [114, 3, 1, "", "print_module_options"], [114, 3, 1, "", "read_globals"], [114, 3, 1, "", "set_array"], [114, 3, 1, "", "set_bool"], [114, 3, 1, "", "set_current_module"], [114, 3, 1, "", "set_double"], [114, 3, 1, "", "set_int"], [114, 3, 1, "", "set_read_globals"], [114, 3, 1, "", "set_str"], [114, 3, 1, "", "set_str_i"], [114, 3, 1, "", "validate_options"]], "psi4.core.OrbitalSpace": [[115, 3, 1, "", "C"], [115, 3, 1, "", "basisset"], [115, 3, 1, "", "build_cabs_space"], [115, 3, 1, "", "build_ri_space"], [115, 3, 1, "", "dim"], [115, 3, 1, "", "evals"], [115, 3, 1, "", "id"], [115, 3, 1, "", "integral"], [115, 3, 1, "", "name"], [115, 3, 1, "", "nirrep"], [115, 3, 1, "", "print_out"]], "psi4.core.PetiteList": [[118, 3, 1, "", "aotoso"], [118, 3, 1, "", "print"], [118, 3, 1, "", "sotoao"]], "psi4.core.PointFunctions": [[119, 3, 1, "", "ansatz"], [119, 3, 1, "", "compute_points"], [119, 3, 1, "", "orbital_values"], [119, 3, 1, "", "point_values"], [119, 3, 1, "", "print_out"], [119, 3, 1, "", "set_ansatz"], [119, 3, 1, "", "set_pointers"]], "psi4.core.PointGroup": [[120, 3, 1, "", "bits"], [120, 3, 1, "", "char_table"], [120, 3, 1, "", "full_name"], [120, 3, 1, "", "order"], [120, 3, 1, "", "symbol"]], "psi4.core.PrimitiveType": [[122, 4, 1, "", "Normalized"], [122, 4, 1, "", "Unnormalized"], [122, 4, 1, "", "name"], [122, 4, 1, "", "value"]], "psi4.core.PsiReturnType": [[126, 4, 1, "", "Failure"], [126, 4, 1, "", "Success"], [126, 4, 1, "", "name"], [126, 4, 1, "", "value"]], "psi4.core.RHF": [[128, 3, 1, "", "c1_deep_copy"], [128, 3, 1, "", "compute_orbital_gradient"], [128, 3, 1, "", "diis"], [128, 3, 1, "", "mintshelper"], [128, 3, 1, "", "twoel_Hx_full"]], "psi4.core.ROHF": [[130, 3, 1, "", "Ct"], [130, 3, 1, "", "c1_deep_copy"], [130, 3, 1, "", "compute_orbital_gradient"], [130, 3, 1, "", "diis"], [130, 3, 1, "", "mintshelper"], [130, 3, 1, "", "moFa"], [130, 3, 1, "", "moFb"], [130, 3, 1, "", "moFeff"], [130, 3, 1, "", "soFeff"]], "psi4.core.SADGuess": [[131, 3, 1, "", "Ca"], [131, 3, 1, "", "Cb"], [131, 3, 1, "", "Da"], [131, 3, 1, "", "Db"], [131, 3, 1, "", "build_SAD"], [131, 3, 1, "", "compute_guess"], [131, 3, 1, "", "set_atomic_fit_bases"], [131, 3, 1, "", "set_debug"], [131, 3, 1, "", "set_print"]], "psi4.core.SOBasisSet": [[132, 3, 1, "", "petite_list"]], "psi4.core.SOMCSCF": [[133, 3, 1, "", "Ck"], [133, 3, 1, "", "H_approx_diag"], [133, 3, 1, "", "approx_solve"], [133, 3, 1, "", "compute_AFock"], [133, 3, 1, "", "compute_Hk"], [133, 3, 1, "", "compute_Q"], [133, 3, 1, "", "compute_Qk"], [133, 3, 1, "", "current_AFock"], [133, 3, 1, "", "current_IFock"], [133, 3, 1, "", "current_ci_energy"], [133, 3, 1, "", "current_docc_energy"], [133, 3, 1, "", "current_total_energy"], [133, 3, 1, "", "form_rotation_matrix"], [133, 3, 1, "", "gradient"], [133, 3, 1, "", "gradient_rms"], [133, 3, 1, "", "rhf_energy"], [133, 3, 1, "", "solve"], [133, 3, 1, "", "update"], [133, 3, 1, "", "zero_redundant"]], "psi4.core.SalcComponent": [[134, 4, 1, "", "atom"], [134, 4, 1, "", "coef"], [134, 4, 1, "", "xyz"]], "psi4.core.SaveType": [[135, 4, 1, "", "Full"], [135, 4, 1, "", "LowerTriangle"], [135, 4, 1, "", "SubBlocks"], [135, 4, 1, "", "name"], [135, 4, 1, "", "value"]], "psi4.core.Slice": [[137, 3, 1, "", "begin"], [137, 3, 1, "", "end"]], "psi4.core.SuperFunctional": [[138, 3, 1, "", "XC_build"], [138, 3, 1, "", "add_c_functional"], [138, 3, 1, "", "add_x_functional"], [138, 3, 1, "", "allocate"], [138, 3, 1, "", "ansatz"], [138, 3, 1, "", "blank"], [138, 3, 1, "", "c_alpha"], [138, 3, 1, "", "c_functional"], [138, 3, 1, "", "c_functionals"], [138, 3, 1, "", "c_omega"], [138, 3, 1, "", "c_os_alpha"], [138, 3, 1, "", "c_ss_alpha"], [138, 3, 1, "", "citation"], [138, 3, 1, "", "compute_functional"], [138, 3, 1, "", "density_tolerance"], [138, 3, 1, "", "deriv"], [138, 3, 1, "", "description"], [138, 3, 1, "", "grac_alpha"], [138, 3, 1, "", "grac_beta"], [138, 3, 1, "", "grac_shift"], [138, 3, 1, "", "is_c_hybrid"], [138, 3, 1, "", "is_c_lrc"], [138, 3, 1, "", "is_c_scs_hybrid"], [138, 3, 1, "", "is_gga"], [138, 3, 1, "", "is_libxc_func"], [138, 3, 1, "", "is_meta"], [138, 3, 1, "", "is_x_hybrid"], [138, 3, 1, "", "is_x_lrc"], [138, 3, 1, "", "max_points"], [138, 3, 1, "", "name"], [138, 3, 1, "", "needs_grac"], [138, 3, 1, "", "needs_vv10"], [138, 3, 1, "", "needs_xc"], [138, 3, 1, "", "print_density_threshold"], [138, 3, 1, "", "print_detail"], [138, 3, 1, "", "print_out"], [138, 3, 1, "", "set_c_alpha"], [138, 3, 1, "", "set_c_omega"], [138, 3, 1, "", "set_c_os_alpha"], [138, 3, 1, "", "set_c_ss_alpha"], [138, 3, 1, "", "set_citation"], [138, 3, 1, "", "set_density_tolerance"], [138, 3, 1, "", "set_deriv"], [138, 3, 1, "", "set_description"], [138, 3, 1, "", "set_do_vv10"], [138, 3, 1, "", "set_grac_alpha"], [138, 3, 1, "", "set_grac_beta"], [138, 3, 1, "", "set_grac_shift"], [138, 3, 1, "", "set_lock"], [138, 3, 1, "", "set_max_points"], [138, 3, 1, "", "set_name"], [138, 3, 1, "", "set_vv10_b"], [138, 3, 1, "", "set_vv10_c"], [138, 3, 1, "", "set_x_alpha"], [138, 3, 1, "", "set_x_beta"], [138, 3, 1, "", "set_x_omega"], [138, 3, 1, "", "set_xclib_description"], [138, 3, 1, "", "test_functional"], [138, 3, 1, "", "value"], [138, 3, 1, "", "values"], [138, 3, 1, "", "vv10_b"], [138, 3, 1, "", "vv10_c"], [138, 3, 1, "", "x_alpha"], [138, 3, 1, "", "x_beta"], [138, 3, 1, "", "x_functional"], [138, 3, 1, "", "x_functionals"], [138, 3, 1, "", "x_omega"], [138, 3, 1, "", "xclib_description"]], "psi4.core.SymmetryOperation": [[139, 3, 1, "", "E"], [139, 3, 1, "", "c2_x"], [139, 3, 1, "", "c2_y"], [139, 3, 1, "", "c2_z"], [139, 3, 1, "", "i"], [139, 3, 1, "", "matrix"], [139, 3, 1, "", "operate"], [139, 3, 1, "", "rotate_n"], [139, 3, 1, "", "rotate_theta"], [139, 3, 1, "", "sigma_xy"], [139, 3, 1, "", "sigma_xz"], [139, 3, 1, "", "sigma_yz"], [139, 3, 1, "", "trace"], [139, 3, 1, "", "transform"], [139, 3, 1, "", "transpose"], [139, 3, 1, "", "unit"], [139, 3, 1, "", "zero"]], "psi4.core.TLaplaceDenominator": [[140, 3, 1, "", "denominator_occ"], [140, 3, 1, "", "denominator_vir"]], "psi4.core.ThreeCenterOverlapInt": [[141, 3, 1, "", "compute_shell"]], "psi4.core.TwoBodyAOInt": [[143, 3, 1, "", "compute_shell"], [143, 3, 1, "", "shell_significant"], [143, 3, 1, "", "update_density"]], "psi4.core.TwoElectronInt": [[144, 3, 1, "", "compute_shell"], [144, 3, 1, "", "shell_significant"]], "psi4.core.UHF": [[145, 3, 1, "", "c1_deep_copy"], [145, 3, 1, "", "compute_orbital_gradient"], [145, 3, 1, "", "diis"], [145, 3, 1, "", "mintshelper"], [145, 3, 1, "", "stability_analysis"]], "psi4.core.VBase": [[147, 3, 1, "", "Dao"], [147, 3, 1, "", "basis"], [147, 3, 1, "", "build"], [147, 3, 1, "", "build_collocation_cache"], [147, 3, 1, "", "clear_collocation_cache"], [147, 3, 1, "", "compute_V"], [147, 3, 1, "", "compute_Vx"], [147, 3, 1, "", "compute_gradient"], [147, 3, 1, "", "compute_hessain"], [147, 3, 1, "", "finalize"], [147, 3, 1, "", "functional"], [147, 3, 1, "", "get_block"], [147, 3, 1, "", "get_np_xyzw"], [147, 3, 1, "", "grid"], [147, 3, 1, "", "initialize"], [147, 3, 1, "", "nblocks"], [147, 3, 1, "", "print_header"], [147, 3, 1, "", "properties"], [147, 3, 1, "", "quadrature_values"], [147, 3, 1, "", "set_D"], [147, 3, 1, "", "set_debug"], [147, 3, 1, "", "set_print"]], "psi4.core.Vector": [[148, 3, 1, "", "add"], [148, 3, 1, "", "array_interface"], [148, 3, 1, "", "axpby"], [148, 3, 1, "", "axpy"], [148, 3, 1, "", "clone"], [148, 3, 1, "", "copy"], [148, 3, 1, "", "dim"], [148, 3, 1, "", "dimpi"], [148, 3, 1, "", "from_array"], [148, 3, 1, "", "from_list"], [148, 3, 1, "", "from_serial"], [148, 3, 1, "", "get"], [148, 3, 1, "", "get_block"], [148, 3, 1, "", "init"], [148, 3, 1, "", "load"], [148, 4, 1, "", "name"], [148, 3, 1, "", "nirrep"], [148, 4, 1, "", "np"], [148, 3, 1, "", "np_read"], [148, 3, 1, "", "np_write"], [148, 4, 1, "", "nph"], [148, 3, 1, "", "print_out"], [148, 3, 1, "", "save"], [148, 3, 1, "", "scale"], [148, 3, 1, "", "set"], [148, 3, 1, "", "set_block"], [148, 4, 1, "", "shape"], [148, 3, 1, "", "to_array"], [148, 3, 1, "", "to_serial"], [148, 3, 1, "", "vector_dot"], [148, 3, 1, "", "zero"]], "psi4.core.Vector3": [[149, 3, 1, "", "cross"], [149, 3, 1, "", "distance"], [149, 3, 1, "", "dot"], [149, 3, 1, "", "norm"], [149, 3, 1, "", "normalize"]], "psi4.core.Wavefunction": [[150, 3, 1, "", "Ca"], [150, 3, 1, "", "Ca_subset"], [150, 3, 1, "", "Cb"], [150, 3, 1, "", "Cb_subset"], [150, 3, 1, "", "Da"], [150, 3, 1, "", "Da_subset"], [150, 3, 1, "", "Db"], [150, 3, 1, "", "Db_subset"], [150, 3, 1, "", "Fa"], [150, 3, 1, "", "Fa_subset"], [150, 3, 1, "", "Fb"], [150, 3, 1, "", "Fb_subset"], [150, 3, 1, "", "H"], [150, 3, 1, "", "PCM_enabled"], [150, 3, 1, "", "S"], [150, 3, 1, "", "alpha_orbital_space"], [150, 3, 1, "", "aotoso"], [150, 3, 1, "", "array_variable"], [150, 3, 1, "", "array_variables"], [150, 3, 1, "", "arrays"], [150, 3, 1, "", "atomic_point_charges"], [150, 3, 1, "", "basis_projection"], [150, 3, 1, "", "basisset"], [150, 3, 1, "", "beta_orbital_space"], [150, 3, 1, "", "build"], [150, 3, 1, "", "c1_deep_copy"], [150, 3, 1, "", "compute_energy"], [150, 3, 1, "", "compute_gradient"], [150, 3, 1, "", "compute_hessian"], [150, 3, 1, "", "deep_copy"], [150, 3, 1, "", "del_array_variable"], [150, 3, 1, "", "del_potential_variable"], [150, 3, 1, "", "del_scalar_variable"], [150, 3, 1, "", "del_variable"], [150, 3, 1, "", "doccpi"], [150, 3, 1, "", "efzc"], [150, 3, 1, "", "energy"], [150, 3, 1, "", "epsilon_a"], [150, 3, 1, "", "epsilon_a_subset"], [150, 3, 1, "", "epsilon_b"], [150, 3, 1, "", "epsilon_b_subset"], [150, 3, 1, "", "esp_at_nuclei"], [150, 3, 1, "", "external_pot"], [150, 3, 1, "", "force_occpi"], [150, 3, 1, "", "frequencies"], [150, 3, 1, "", "from_file"], [150, 3, 1, "", "frzcpi"], [150, 3, 1, "", "frzvpi"], [150, 3, 1, "", "get_array"], [150, 3, 1, "", "get_basisset"], [150, 3, 1, "", "get_density"], [150, 3, 1, "", "get_dipole_field_strength"], [150, 3, 1, "", "get_print"], [150, 3, 1, "", "get_scratch_filename"], [150, 3, 1, "", "get_variable"], [150, 3, 1, "", "gradient"], [150, 3, 1, "", "has_array_variable"], [150, 3, 1, "", "has_potential_variable"], [150, 3, 1, "", "has_scalar_variable"], [150, 3, 1, "", "has_variable"], [150, 3, 1, "", "hessian"], [150, 3, 1, "", "lagrangian"], [150, 3, 1, "", "mintshelper"], [150, 3, 1, "", "mo_extents"], [150, 3, 1, "", "module"], [150, 3, 1, "", "molecule"], [150, 3, 1, "", "nalpha"], [150, 3, 1, "", "nalphapi"], [150, 3, 1, "", "name"], [150, 3, 1, "", "nbeta"], [150, 3, 1, "", "nbetapi"], [150, 3, 1, "", "nfrzc"], [150, 3, 1, "", "nirrep"], [150, 3, 1, "", "nmo"], [150, 3, 1, "", "nmopi"], [150, 3, 1, "", "no_occupations"], [150, 3, 1, "", "nso"], [150, 3, 1, "", "nsopi"], [150, 3, 1, "", "options"], [150, 3, 1, "", "potential_variable"], [150, 3, 1, "", "potential_variables"], [150, 3, 1, "", "reference_wavefunction"], [150, 3, 1, "", "same_a_b_dens"], [150, 3, 1, "", "same_a_b_orbs"], [150, 3, 1, "", "scalar_variable"], [150, 3, 1, "", "scalar_variables"], [150, 3, 1, "", "set_array"], [150, 3, 1, "", "set_array_variable"], [150, 3, 1, "", "set_basisset"], [150, 3, 1, "", "set_energy"], [150, 3, 1, "", "set_external_potential"], [150, 3, 1, "", "set_gradient"], [150, 3, 1, "", "set_hessian"], [150, 3, 1, "", "set_lagrangian"], [150, 3, 1, "", "set_module"], [150, 3, 1, "", "set_name"], [150, 3, 1, "", "set_potential_variable"], [150, 3, 1, "", "set_print"], [150, 3, 1, "", "set_reference_wavefunction"], [150, 3, 1, "", "set_scalar_variable"], [150, 3, 1, "", "set_variable"], [150, 3, 1, "", "shallow_copy"], [150, 3, 1, "", "sobasisset"], [150, 3, 1, "", "soccpi"], [150, 3, 1, "", "to_file"], [150, 3, 1, "", "variable"], [150, 3, 1, "", "variables"], [150, 3, 1, "", "write_molden"], [150, 3, 1, "", "write_nbo"]], "psi4.core.dpdbuf4": [[183, 3, 1, "", "axpy_matrix"], [183, 3, 1, "", "coldim"], [183, 3, 1, "", "rowdim"], [183, 3, 1, "", "zero"]], "psi4.core.dpdfile2": [[184, 3, 1, "", "axpy_matrix"], [184, 3, 1, "", "coldim"], [184, 3, 1, "", "rowdim"], [184, 3, 1, "", "zero"]], "psi4.driver": [[265, 5, 1, "", "AtomicComputer"], [266, 8, 1, "", "ConvergenceError"], [267, 2, 1, "", "EmpiricalDispersion"], [268, 8, 1, "", "ManagedMethodError"], [269, 8, 1, "", "MissingMethodError"], [270, 8, 1, "", "OptimizationConvergenceError"], [271, 8, 1, "", "ParsingError"], [272, 8, 1, "", "PastureRequiredError"], [273, 8, 1, "", "PsiException"], [274, 2, 1, "", "QMMM"], [275, 2, 1, "", "QMMMbohr"], [276, 8, 1, "", "SCFConvergenceError"], [277, 8, 1, "", "TDSCFConvergenceError"], [278, 8, 1, "", "TestComparisonError"], [279, 8, 1, "", "UpgradeHelper"], [280, 8, 1, "", "ValidationError"], [281, 0, 1, "", "activate"], [282, 0, 1, "", "banner"], [283, 0, 1, "", "basis_helper"], [284, 0, 1, "", "cbs"], [285, 0, 1, "", "compare_fchkfiles"], [286, 0, 1, "", "compare_fcidumps"], [287, 0, 1, "", "compare_moldenfiles"], [288, 0, 1, "", "copy_file_from_scratch"], [289, 0, 1, "", "copy_file_to_scratch"], [290, 0, 1, "", "create_plugin"], [291, 0, 1, "", "cubeprop"], [292, 0, 1, "", "docs_table_link"], [293, 0, 1, "", "dynamic_variable_bind"], [294, 0, 1, "", "energies_from_fcidump"], [295, 0, 1, "", "energy"], [296, 0, 1, "", "fchk"], [297, 0, 1, "", "fcidump"], [298, 0, 1, "", "fcidump_from_file"], [299, 0, 1, "", "find_approximate_string_matches"], [300, 0, 1, "", "freq"], [301, 0, 1, "", "frequencies"], [302, 0, 1, "", "frequency"], [303, 0, 1, "", "gdma"], [304, 0, 1, "", "geometry"], [305, 0, 1, "", "get_memory"], [306, 0, 1, "", "gradient"], [307, 0, 1, "", "hessian"], [308, 0, 1, "", "ipi_broker"], [309, 0, 1, "", "levenshtein"], [310, 0, 1, "", "libint2_configuration"], [311, 0, 1, "", "libint2_print_out"], [312, 0, 1, "", "mdi_run"], [313, 0, 1, "", "message_box"], [314, 0, 1, "", "molden"], [315, 0, 1, "", "molecule_get_attr"], [316, 0, 1, "", "molecule_set_attr"], [317, 0, 1, "", "oeprop"], [318, 0, 1, "", "opt"], [319, 0, 1, "", "optimize"], [320, 0, 1, "", "optimize_geometric"], [1827, 1, 0, "-", "p4util"], [379, 0, 1, "", "pcm_helper"], [380, 0, 1, "", "process_input"], [381, 0, 1, "", "prop"], [382, 0, 1, "", "properties"], [391, 0, 1, "", "sanitize_method"], [392, 0, 1, "", "sanitize_name"], [393, 0, 1, "", "scf_helper"], [394, 0, 1, "", "scf_wavefunction_factory"], [395, 0, 1, "", "set_memory"], [396, 0, 1, "", "set_module_options"], [397, 0, 1, "", "set_options"], [398, 0, 1, "", "tdscf"], [399, 0, 1, "", "vibanal_wfn"]], "psi4.driver.AtomicComputer": [[265, 6, 1, "", "basis"], [265, 3, 1, "", "compute"], [265, 6, 1, "", "computed"], [265, 6, 1, "", "driver"], [265, 3, 1, "", "get_results"], [265, 6, 1, "", "keywords"], [265, 6, 1, "", "method"], [265, 6, 1, "", "molecule"], [265, 6, 1, "", "owner_group"], [265, 3, 1, "", "plan"], [265, 6, 1, "", "priority"], [265, 6, 1, "", "protocols"], [265, 6, 1, "", "result"], [265, 6, 1, "", "result_id"], [265, 7, 1, "", "set_basis"], [265, 7, 1, "", "set_keywords"], [265, 7, 1, "", "set_method"], [265, 6, 1, "", "tag"]], "psi4.driver.ConvergenceError": [[266, 4, 1, "", "iteration"], [266, 4, 1, "", "message"]], "psi4.driver.EmpiricalDispersion": [[267, 3, 1, "", "compute_energy"], [267, 3, 1, "", "compute_gradient"], [267, 3, 1, "", "compute_hessian"], [267, 4, 1, "", "dashcoeff_supplement"], [267, 4, 1, "", "dashlevel"], [267, 4, 1, "", "dashlevel_citation"], [267, 4, 1, "", "dashparams"], [267, 4, 1, "", "dashparams_citation"], [267, 4, 1, "", "description"], [267, 4, 1, "", "disp"], [267, 4, 1, "", "engine"], [267, 4, 1, "", "fctldash"], [267, 4, 1, "", "ordered_params"], [267, 3, 1, "", "print_out"]], "psi4.driver.ManagedMethodError": [[268, 4, 1, "", "message"], [268, 4, 1, "", "stats"]], "psi4.driver.MissingMethodError": [[269, 4, 1, "", "message"]], "psi4.driver.OptimizationConvergenceError": [[270, 4, 1, "", "iteration"], [270, 4, 1, "", "message"], [270, 4, 1, "", "wfn"]], "psi4.driver.QMMMbohr": [[275, 3, 1, "", "addChargeAngstrom"], [275, 3, 1, "", "addChargeBohr"], [275, 3, 1, "", "addDiffuse"], [275, 3, 1, "", "populateExtern"]], "psi4.driver.SCFConvergenceError": [[276, 4, 1, "", "d_conv"], [276, 4, 1, "", "e_conv"], [276, 4, 1, "", "iteration"], [276, 4, 1, "", "message"], [276, 4, 1, "", "wfn"]], "psi4.driver.TDSCFConvergenceError": [[277, 4, 1, "", "iteration"], [277, 4, 1, "", "message"], [277, 4, 1, "", "stats"], [277, 4, 1, "", "wfn"], [277, 4, 1, "", "what"]], "psi4.driver.TestComparisonError": [[278, 4, 1, "", "message"]], "psi4.driver.ValidationError": [[280, 4, 1, "", "message"]], "psi4.driver.aliases": [[1740, 0, 1, "", "allen_focal_point"], [1740, 0, 1, "", "sherrill_gold_standard"]], "psi4.driver.diatomic": [[1761, 0, 1, "", "anharmonicity"]], "psi4.driver.driver_cbs": [[1740, 5, 1, "", "CompositeComputer"], [1740, 0, 1, "", "_get_default_xtpl"]], "psi4.driver.driver_cbs.CompositeComputer": [[1740, 6, 1, "", "basis"], [1740, 3, 1, "", "build_tasks"], [1740, 6, 1, "", "cbsrec"], [1740, 3, 1, "", "compute"], [1740, 6, 1, "", "compute_list"], [1740, 6, 1, "", "driver"], [1740, 3, 1, "", "get_psi_results"], [1740, 3, 1, "", "get_results"], [1740, 6, 1, "", "keywords"], [1740, 6, 1, "", "metadata"], [1740, 6, 1, "", "metameta"], [1740, 6, 1, "", "method"], [1740, 6, 1, "", "molecule"], [1740, 3, 1, "", "plan"], [1740, 6, 1, "", "results_list"], [1740, 7, 1, "", "set_molecule"], [1740, 6, 1, "", "task_list"], [1740, 6, 1, "", "trove"], [1740, 6, 1, "", "verbose"]], "psi4.driver.driver_cbs_helper": [[1740, 0, 1, "", "corl_xtpl_helgaker_2"], [1740, 0, 1, "", "register_composite_function"], [1740, 0, 1, "", "register_xtpl_function"], [1740, 0, 1, "", "scf_xtpl_helgaker_2"], [1740, 0, 1, "", "scf_xtpl_helgaker_3"], [1740, 0, 1, "", "scf_xtpl_karton_2"], [1740, 0, 1, "", "scf_xtpl_truhlar_2"], [1740, 0, 1, "", "xtpl_highest_1"]], "psi4.driver.driver_findif": [[1772, 5, 1, "", "FiniteDifferenceComputer"]], "psi4.driver.driver_findif.FiniteDifferenceComputer": [[1772, 3, 1, "", "build_tasks"], [1772, 3, 1, "", "compute"], [1772, 4, 1, "", "computer"], [1772, 6, 1, "", "driver"], [1772, 6, 1, "", "findifrec"], [1772, 3, 1, "", "get_psi_results"], [1772, 3, 1, "", "get_results"], [1772, 6, 1, "", "metameta"], [1772, 6, 1, "", "method"], [1772, 6, 1, "", "molecule"], [1772, 3, 1, "", "plan"], [1772, 7, 1, "", "set_driver"], [1772, 7, 1, "", "set_molecule"], [1772, 6, 1, "", "task_list"]], "psi4.driver.driver_nbody": [[1794, 2, 1, "", "BsseEnum"], [1794, 5, 1, "", "ManyBodyComputer"], [1768, 4, 1, "", "SubTaskComputers"], [1794, 0, 1, "", "nbody"]], "psi4.driver.driver_nbody.BsseEnum": [[1794, 4, 1, "", "cp"], [1794, 4, 1, "", "nocp"], [1794, 4, 1, "", "vmfc"]], "psi4.driver.driver_nbody.ManyBodyComputer": [[1794, 6, 1, "", "basis"], [1794, 6, 1, "", "bsse_type"], [1794, 3, 1, "", "build_tasks"], [1794, 3, 1, "", "compute"], [1794, 6, 1, "", "driver"], [1794, 6, 1, "", "embedding_charges"], [1794, 3, 1, "", "get_psi_results"], [1794, 3, 1, "", "get_results"], [1794, 6, 1, "", "keywords"], [1794, 6, 1, "", "max_nbody"], [1794, 6, 1, "", "method"], [1794, 6, 1, "", "molecule"], [1794, 6, 1, "", "nbodies_per_mc_level"], [1794, 6, 1, "", "nfragments"], [1794, 3, 1, "", "plan"], [1794, 3, 1, "", "prepare_results"], [1794, 6, 1, "", "quiet"], [1794, 6, 1, "", "return_total_data"], [1794, 7, 1, "", "set_bsse_type"], [1794, 7, 1, "", "set_embedding_charges"], [1794, 7, 1, "", "set_max_nbody"], [1794, 7, 1, "", "set_molecule"], [1794, 7, 1, "", "set_nfragments"], [1794, 7, 1, "", "set_return_total_data"], [1794, 6, 1, "", "task_list"]], "psi4.driver.frac": [[1768, 0, 1, "", "frac_nuke"], [1768, 0, 1, "", "frac_traverse"], [1768, 0, 1, "", "ip_fitting"]], "psi4.driver.inputparser": [[1768, 0, 1, "", "process_input"]], "psi4.driver.ipi_broker": [[1768, 2, 1, "", "IPIBroker"]], "psi4.driver.p4util": [[321, 2, 1, "", "DIIS"], [322, 2, 1, "", "Gaussian"], [323, 2, 1, "", "InPsight"], [324, 2, 1, "", "Lineshape"], [325, 2, 1, "", "Lorentzian"], [326, 2, 1, "", "OptionState"], [327, 2, 1, "", "OptionsState"], [328, 0, 1, "", "OptionsStateCM"], [329, 2, 1, "", "SolverEngine"], [330, 0, 1, "", "all_casings"], [331, 0, 1, "", "array_to_matrix"], [332, 0, 1, "", "banner"], [333, 0, 1, "", "basis_helper"], [334, 0, 1, "", "block_diagonal_array"], [335, 0, 1, "", "cg_solver"], [336, 0, 1, "", "compare_fchkfiles"], [337, 0, 1, "", "compare_fcidumps"], [338, 0, 1, "", "compare_moldenfiles"], [339, 0, 1, "", "copy_file_from_scratch"], [340, 0, 1, "", "copy_file_to_scratch"], [341, 0, 1, "", "cubeprop"], [342, 0, 1, "", "davidson_solver"], [343, 0, 1, "", "docs_table_link"], [344, 0, 1, "", "drop_duplicates"], [345, 0, 1, "", "energies_from_fcidump"], [346, 0, 1, "", "expand_psivars"], [347, 0, 1, "", "fcidump"], [348, 0, 1, "", "fcidump_from_file"], [349, 0, 1, "", "find_approximate_string_matches"], [350, 0, 1, "", "format_molecule_for_input"], [351, 0, 1, "", "format_options_for_input"], [352, 0, 1, "", "free_atom_volumes"], [353, 0, 1, "", "get_memory"], [354, 0, 1, "", "get_psifile"], [355, 0, 1, "", "getattr_ignorecase"], [356, 0, 1, "", "hamiltonian_solver"], [357, 0, 1, "", "hold_options_state"], [358, 0, 1, "", "import_ignorecase"], [359, 0, 1, "", "kwargs_lower"], [360, 0, 1, "", "levenshtein"], [361, 0, 1, "", "libint2_configuration"], [362, 0, 1, "", "libint2_print_out"], [363, 0, 1, "", "mat2arr"], [364, 0, 1, "", "message_box"], [365, 0, 1, "", "oeprop"], [366, 0, 1, "", "pcm_helper"], [367, 0, 1, "", "plump_qcvar"], [368, 0, 1, "", "prefactor_ecd"], [369, 0, 1, "", "prefactor_opa"], [370, 0, 1, "", "prepare_options_for_modules"], [371, 0, 1, "", "prepare_options_for_set_options"], [372, 0, 1, "", "provenance_stamp"], [373, 0, 1, "", "sanitize_method"], [374, 0, 1, "", "set_memory"], [375, 0, 1, "", "set_module_options"], [376, 0, 1, "", "set_options"], [377, 0, 1, "", "spectrum"], [378, 0, 1, "", "state_to_atomicinput"]], "psi4.driver.p4util.DIIS": [[321, 3, 1, "", "add"], [321, 3, 1, "", "extrapolate"]], "psi4.driver.p4util.Gaussian": [[322, 3, 1, "", "lineshape"], [322, 3, 1, "", "maximum"]], "psi4.driver.p4util.InPsight": [[323, 4, 1, "", "atoms"], [323, 4, 1, "", "azimuth"], [323, 4, 1, "", "bohr_per_ang"], [323, 4, 1, "", "bond_width"], [323, 4, 1, "", "bonding_alpha"], [323, 4, 1, "", "bonds"], [323, 4, 1, "", "colors"], [323, 4, 1, "", "defines"], [323, 4, 1, "", "elevation"], [323, 4, 1, "", "height"], [323, 4, 1, "", "light"], [323, 4, 1, "", "light_color"], [323, 4, 1, "", "location"], [323, 4, 1, "", "look_at"], [323, 3, 1, "", "position_camera"], [323, 4, 1, "", "radial_scale"], [323, 4, 1, "", "radii"], [323, 4, 1, "", "right"], [323, 3, 1, "", "save_density"], [323, 3, 1, "", "save_molecule"], [323, 3, 1, "", "set_camera"], [323, 3, 1, "", "set_color"], [323, 3, 1, "", "set_define"], [323, 3, 1, "", "set_radius"], [323, 3, 1, "", "set_size"], [323, 3, 1, "", "set_view"], [323, 4, 1, "", "sky"], [323, 4, 1, "", "up"], [323, 3, 1, "", "update_geometry"], [323, 4, 1, "", "width"], [323, 4, 1, "", "zoom"]], "psi4.driver.p4util.Lineshape": [[324, 4, 1, "", "domain"], [324, 4, 1, "", "gamma"], [324, 3, 1, "", "lineshape"], [324, 3, 1, "", "maximum"]], "psi4.driver.p4util.Lorentzian": [[325, 3, 1, "", "lineshape"], [325, 3, 1, "", "maximum"]], "psi4.driver.p4util.OptionState": [[326, 3, 1, "", "restore"]], "psi4.driver.p4util.OptionsState": [[327, 3, 1, "", "add_option"], [327, 3, 1, "", "restore"]], "psi4.driver.p4util.SolverEngine": [[329, 3, 1, "", "compute_products"], [329, 3, 1, "", "new_vector"], [329, 3, 1, "", "precondition"], [329, 3, 1, "", "residue"], [329, 3, 1, "", "vector_axpy"], [329, 3, 1, "", "vector_copy"], [329, 3, 1, "", "vector_dot"], [329, 3, 1, "", "vector_scale"]], "psi4.driver.p4util.numpy_helper": [[1797, 0, 1, "", "_to_array"], [1797, 0, 1, "", "array_to_matrix"]], "psi4.driver.procrouting.empirical_dispersion": [[1759, 2, 1, "", "EmpiricalDispersion"]], "psi4.driver.procrouting.empirical_dispersion.EmpiricalDispersion": [[1759, 4, 1, "", "dashcoeff_supplement"], [1759, 4, 1, "", "dashlevel"], [1759, 4, 1, "", "dashlevel_citation"], [1759, 4, 1, "", "dashparams"], [1759, 4, 1, "", "dashparams_citation"], [1759, 4, 1, "", "description"], [1759, 4, 1, "", "disp"], [1759, 4, 1, "", "engine"], [1759, 4, 1, "", "fctldash"], [1759, 4, 1, "", "ordered_params"]], "psi4.driver.procrouting.interface_cfour": [[1743, 0, 1, "", "run_cfour"]], "psi4.driver.qcdb": [[1768, 2, 1, "", "Molecule"], [1772, 1, 0, "-", "vib"]], "psi4.driver.qcdb.vib": [[383, 0, 1, "", "compare_vibinfos"], [384, 0, 1, "", "filter_nonvib"], [385, 0, 1, "", "filter_omega_to_real"], [386, 0, 1, "", "harmonic_analysis"], [387, 0, 1, "", "hessian_symmetrize"], [388, 0, 1, "", "print_molden_vibs"], [389, 0, 1, "", "print_vibs"], [390, 0, 1, "", "thermo"]], "psi4.driver.task_base": [[1768, 5, 1, "", "BaseComputer"]], "psi4.driver.task_base.BaseComputer": [[1768, 3, 1, "", "compute"], [1768, 3, 1, "", "plan"]], "psi4.driver.task_planner": [[1768, 4, 1, "", "TaskComputers"], [1768, 0, 1, "", "expand_cbs_methods"], [1768, 0, 1, "", "task_planner"]], "psi4.driver.wrapper_autofrag": [[1768, 0, 1, "", "auto_fragments"]], "psi4.driver.wrapper_database": [[1752, 0, 1, "", "database"]], "qcdb": [[2, 0, 1, "", "compare_vibinfos"]], "qcdb.Molecule": [[1759, 0, 1, "", "run_dftd3"], [1759, 0, 1, "", "run_dftd4"], [1774, 0, 1, "", "run_gcp"]]}, "objnames": {"0": ["py", "function", "Python function"], "1": ["py", "module", "Python module"], "2": ["py", "class", "Python class"], "3": ["py", "method", "Python method"], "4": ["py", "attribute", "Python attribute"], "5": ["py", "pydantic_model", "Python model"], "6": ["py", "pydantic_field", "Python field"], "7": ["py", "pydantic_validator", "Python validator"], "8": ["py", "exception", "Python exception"], "9": ["std", "psivar", "psivar"], "10": ["std", "envvar", "environment variable"], "11": ["std", "cmdoption", "program option"]}, "objtypes": {"0": "py:function", "1": "py:module", "2": "py:class", "3": "py:method", "4": "py:attribute", "5": "py:pydantic_model", "6": "py:pydantic_field", "7": "py:pydantic_validator", "8": "py:exception", "9": "std:psivar", "10": "std:envvar", "11": "std:cmdoption"}, "terms": {"": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1736, 1737, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1828, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "0": [0, 1, 2, 8, 11, 13, 15, 17, 61, 62, 68, 79, 82, 83, 84, 86, 88, 89, 91, 100, 103, 106, 111, 122, 126, 134, 135, 148, 150, 225, 262, 265, 268, 278, 284, 285, 287, 291, 295, 296, 300, 301, 302, 303, 314, 318, 319, 323, 331, 336, 338, 341, 342, 346, 356, 368, 369, 374, 377, 380, 381, 382, 384, 386, 390, 395, 401, 406, 413, 433, 442, 443, 450, 466, 479, 489, 507, 514, 518, 519, 542, 543, 568, 570, 573, 575, 577, 579, 584, 586, 587, 590, 592, 596, 597, 598, 599, 600, 602, 608, 609, 610, 611, 612, 613, 614, 615, 617, 619, 621, 622, 623, 625, 626, 627, 635, 637, 639, 640, 641, 642, 643, 644, 647, 648, 652, 656, 658, 660, 664, 667, 668, 669, 674, 675, 676, 678, 679, 681, 682, 683, 688, 690, 691, 696, 697, 698, 699, 700, 701, 702, 703, 705, 706, 707, 708, 709, 711, 712, 714, 716, 729, 738, 744, 752, 759, 761, 774, 779, 780, 781, 783, 800, 819, 828, 832, 833, 835, 837, 842, 852, 855, 862, 865, 870, 873, 884, 890, 895, 901, 902, 903, 904, 905, 906, 907, 908, 923, 928, 933, 936, 939, 943, 955, 957, 987, 988, 992, 993, 1023, 1032, 1033, 1034, 1051, 1053, 1058, 1070, 1078, 1082, 1084, 1101, 1104, 1110, 1115, 1116, 1118, 1125, 1126, 1148, 1149, 1184, 1188, 1193, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1215, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1228, 1229, 1230, 1231, 1237, 1238, 1239, 1241, 1242, 1256, 1265, 1269, 1271, 1272, 1275, 1289, 1302, 1304, 1305, 1323, 1332, 1333, 1335, 1340, 1343, 1344, 1345, 1348, 1352, 1353, 1363, 1396, 1400, 1405, 1425, 1427, 1463, 1469, 1473, 1474, 1476, 1481, 1482, 1485, 1490, 1499, 1503, 1504, 1508, 1511, 1512, 1513, 1516, 1519, 1520, 1522, 1523, 1525, 1529, 1530, 1531, 1538, 1539, 1540, 1545, 1555, 1556, 1561, 1562, 1570, 1576, 1580, 1588, 1598, 1608, 1618, 1650, 1660, 1668, 1679, 1680, 1690, 1692, 1694, 1695, 1696, 1697, 1698, 1700, 1701, 1702, 1703, 1704, 1706, 1707, 1714, 1730, 1731, 1732, 1738, 1739, 1740, 1742, 1743, 1746, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1763, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1774, 1775, 1776, 1779, 1781, 1782, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1796, 1797, 1798, 1800, 1801, 1802, 1803, 1805, 1806, 1808, 1810, 1814, 1817, 1819, 1826, 1828, 1829, 1832, 1833, 1834, 1836, 1837, 1838, 1841, 1842, 1844], "00": [284, 1226, 1331, 1704, 1730, 1740, 1789], "000": [651, 1206, 1704, 1706, 1763, 1802, 1828, 1844], "0000": [278, 1833, 1841], "000000": [1695, 1696, 1697, 1700, 1702, 1758, 1828, 1833, 1837, 1841, 1844], "0000000": 1743, "00000000": 1833, "0000000000": [1743, 1754, 1803], "000000000000": [1743, 1828, 1844], "00000000000000": 1833, "0000000000000001": 1756, "0000000000e": 1838, "0000000001": [1743, 1754, 1803], "000000004262": 1743, "000000439070": 1743, "00000064": 1752, "00000066": 1743, "00000098": 1743, "000001": 1795, "0000012398419739": 1706, "0000012566370614": 1706, "0000031668105": 1706, "00000371": 1743, "00000622": 1743, "000010060942": 1844, "000010063363": 1828, "000011663787": 1706, "00001205883214": 1706, "00001495e": 1706, "000018117284": 1743, "000025691": 1706, "00003577": 1743, "00004307": 1743, "00004802": 1752, "000057883818012": 1706, "000077480917310": 1706, "00008485": 1844, "00008488": 1828, "000086173303": 1706, "00008926": 1743, "000092278158": 1771, "00009889": 1743, "0000e": 1841, "0001": [342, 356, 1838], "0001134289257": 1706, "0001370933554798": 1706, "00014016": 1844, "00014019": 1828, "0001819200062203": 1706, "0001819543074854": 1706, "0002": 1841, "00024762": 1759, "0002623068456699684": 1752, "0002724437107484": 1706, "000287592": 1706, "00036369475486": 1706, "00036582690": 1706, "000389931104": 1828, "000389933562": 1844, "0004": 1752, "00040256": 1743, "0004046": 1734, "00044621": 1844, "00044738": 1828, "0004664345535": 1706, "0004669754554": 1706, "00048446": 1743, "00054386734428": 1706, "000544617021352": 1706, "000548579909070": 1706, "0006": 1706, "0006002": [1734, 1781], "0006910051439986686": 1752, "0007": 1841, "00070447": 1743, "00072738950972": 1706, "00077146": 1743, "00077279": 1844, "00077463": 1828, "000819116338": 1771, "0009": 1734, "000911394496": 1771, "001": [106, 323, 1226, 1345, 1704, 1706, 1768, 1785, 1802], "0010": [297, 347, 1706], "001007276466879": 1706, "00100866491588": 1706, "00104066882": 1706, "00104187563": 1706, "0011": 1706, "001158671471": 1706, "001158740958": 1706, "00115965218091": 1706, "00116592089": 1706, "0012": [1706, 1841], "0013": 1706, "00137841898": 1706, "00138844900": 1706, "0014": 1706, "00142923": 1844, "00142946": 1828, "0014825844040612934": 1752, "0015": 1706, "001506179127": 1706, "001520993128": 1706, "0015210322053": 1706, "0016": [1706, 1841], "00160359": 1743, "0016223936616": 1706, "0017": [1706, 1841], "00178749": 1844, "00178779": 1828, "00179": 1740, "0018": 1706, "0019": [1706, 1841], "00190749": 1706, "002": [1757, 1781], "0020": 1706, "002013553212745": 1706, "00207697e": 1706, "00209952e": 1706, "0021": 1706, "0022355825227244703": 1828, "00231930436182": 1706, "0023318418": 1706, "0024": 1706, "00241281": 1743, "0024741470062974724": 1752, "0025": 1706, "0026": 1706, "00268970802641242": 1776, "00268976": [1734, 1781], "00269": 1770, "0027": 1706, "0028": [1706, 1740], "0028977729": 1706, "0029": 1706, "0030": 1706, "00301493224673": 1706, "00301550071632": 1706, "0031": 1706, "0032": 1706, "0033": 1706, "0034": 1706, "0035470557928363178": 1752, "0035811": 1734, "0036": 1706, "0037": 1706, "0040": 1841, "004001506179127": 1706, "0040021": 1734, "0040992802": 1743, "0040993": 1743, "0042": 1706, "0043793": [1692, 1752], "0046": 1706, "0048": 1706, "00483633170": 1706, "00484197048": 1706, "005": [1023, 1217, 1704, 1740], "0050": 1706, "005063183e": 1706, "0051191833": 1743, "0051192": 1743, "00516e": 1838, "0053": 1706, "0057": 1706, "0058": 1706, "0059": 1706, "00594840": 1844, "00594928": 1828, "0061": 1706, "006412700e": 1706, "0064609": 1770, "0066": 1706, "006623618183": 1706, "0067": 1706, "0069": 1706, "007": [295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1758, 1766, 1770, 1800], "0070": 1752, "0071056": 1770, "0072": [1706, 1837], "007200": 1837, "007263598030": 1743, "007276466879": 1706, "0072973525664": 1706, "007356665e": 1706, "0075": 1752, "0076": 1706, "007825": [1828, 1833, 1844], "007a9b6": 1786, "008": [1714, 1743, 1842], "0081285": 1734, "00817094": 1837, "0082": 1841, "00839486625709": 1833, "0085": 1706, "00866": 1740, "00866491588": 1706, "00869851": 1740, "00881949": 1743, "0088666856": 1743, "0088667": 1743, "0089": 1706, "0090": 1706, "00901553": 1837, "0092": 1706, "0093": 1760, "0096": 1841, "0097": [1706, 1841], "0098": 1706, "00985995185668": [150, 262], "00e": [1743, 1802], "01": [0, 1, 2, 278, 285, 287, 336, 338, 401, 543, 943, 1197, 1203, 1213, 1226, 1335, 1704, 1743, 1781, 1802, 1837, 1838, 1841], "010": 1706, "01007985": 1844, "01008137": 1828, "0102383666": 1743, "0102384": 1743, "01036": 1734, "0105313323529": 1833, "011": 1706, "01144207": 1837, "0115002693348": 1752, "011500269334817403": 1752, "01152445": 1837, "012": [323, 1706, 1781], "012097": 1802, "0122978": 1743, "0122978407": 1743, "01234": 1733, "0123456789": 1730, "01245744": 1844, "01245755": 1828, "01247162": 1837, "012516": [1734, 1838], "0129": 1743, "013": 1706, "0133026": [295, 1695, 1698, 1700, 1701, 1734, 1758, 1766], "0135": 1841, "013553212745": 1706, "014": [1706, 1743, 1833], "014000": 1833, "014101": [1734, 1781, 1828, 1837, 1844], "014101779": 1833, "014103": [1734, 1774], "014306": 1740, "01436394": 1833, "0143877736": 1706, "0144": 1841, "0145": 1752, "01493224673": 1706, "015": 1706, "01507630": 1743, "0151070": 1734, "01523505": 1844, "01523518": 1828, "01550071632": 1706, "015687": 1844, "0158": 1841, "015968": 1828, "016": 1706, "016033": 1802, "01604927": 1833, "0161": 1752, "016215": 1828, "016264": 1844, "016265984132": [1828, 1844], "017": 1706, "0170834423405521": 1756, "0175": 1841, "018": 1706, "01800": 1749, "01823410": 1837, "018305": 1802, "01836538": 1837, "0188": 1743, "019": [1706, 1781], "0192889141131474": 1836, "01928891411315": 1836, "0195357736": 1734, "0197": 1841, "02": [150, 262, 443, 479, 519, 928, 1199, 1200, 1202, 1213, 1225, 1265, 1704, 1714, 1743, 1757, 1802, 1838, 1841, 1842], "020": 1706, "020680": 1832, "02099": 1770, "021": 1706, "0212": 1841, "021264": 1832, "021305": 1832, "0213974638823942": 1756, "021460": 1832, "0215": 1752, "0219": 1752, "022140857e": 1706, "022413962": 1706, "02263015": 1837, "0227": 1841, "022710947": 1706, "02277500": 1844, "02277530": 1828, "023": 1706, "0235": 1841, "024": 1706, "02400": 1770, "024102": 1781, "024103": [1734, 1837], "024107": 1781, "0243": 1841, "024801": [1734, 1837], "02481": 1770, "025": 1706, "02500": 1749, "02542623432": 1706, "026": 1706, "02663273410671": 1844, "026632734857": 1844, "02663273486682": 1828, "02663273488399": 1828, "026632734908": 1828, "027": 1706, "027022666011": 1828, "027022668419": 1844, "027032729361": 1844, "027032729374": 1828, "02703272937504": 1828, "02742199": 1844, "02742222": 1828, "028": 1706, "02817737": 1837, "02860757": 1837, "02881355": 1837, "02881480": 1740, "029": 1706, "0293": 1752, "03": [1743, 1788, 1802, 1838, 1841], "030": [1706, 1743], "0301": 1752, "03030": 1770, "031": 1706, "0310": [295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "03100": 1749, "0312": [1743, 1752], "031900": 1833, "032": 1706, "0321": 1743, "0321452": 1770, "032504": [1734, 1838], "03288936": 1740, "033": [1706, 1770], "0331513": 1730, "034": 1706, "03407997": 1740, "034108": [1714, 1734, 1763, 1842], "034116651e": 1706, "03460497": 1740, "03494879": 1740, "03507767": 1743, "0352": 1841, "03535": 1770, "035503": 1802, "03561890": 1743, "035800": 1841, "035999139": 1706, "036402": [295, 318, 319, 1695, 1697, 1698, 1702, 1703, 1758, 1766, 1800], "036671": 1841, "03674932248": 1706, "0369747": 1770, "037": 1706, "03739944": 1837, "0376": 1752, "03771": 1770, "038": 1706, "03893812": 1740, "039": 1706, "039475": 1841, "03954147": 1837, "03e": 1743, "04": [2, 285, 287, 336, 338, 1743, 1802, 1804, 1838, 1841], "040": [1706, 1770], "040712": 1837, "041": 1706, "042": 1706, "04201004": 1740, "042559": 1833, "043": 1706, "04330347": 1740, "04400": 1749, "044104": [1734, 1781], "044115": [1734, 1770], "0442": 1841, "04490350": 1837, "045": 1706, "04558907": 1837, "04591732": 1837, "046": 1706, "047": 1706, "04787362": 1837, "0479": 1743, "048": 1706, "04821832": 1837, "0486691861": 1734, "048798468084": 1771, "048976": 1802, "049180": 1802, "0497": 1841, "049853548145": 1771, "04e": [1743, 1802], "05": [1692, 1743, 1750, 1752, 1759, 1768, 1788, 1802, 1838, 1841], "050": 1706, "0500": 1743, "050000": [1695, 1700, 1758], "050783699e": 1706, "05098402733282": 2, "051": 1706, "051103": [1734, 1770, 1781], "0512503270216563": 1756, "051387722248": 1771, "052": 1706, "05362": 1770, "05367e": 1838, "054": 1706, "054028401038": 1771, "054101": [1734, 1754], "054104": [1734, 1781], "054105": 1781, "054107": [1734, 1774], "054111": [1734, 1754, 1803], "05436": 1770, "054571800e": 1706, "0546": 1841, "054892": 1802, "055": [1706, 1802], "05500": 1749, "0553": 1743, "056": 1706, "0566569": 1770, "056669079827": 1771, "0567": 1841, "05786571": 1833, "058224": 1802, "058257": 1706, "0587": 1841, "05893": 1770, "059": 1706, "0594649": 1706, "0595": 1841, "05959979": 1837, "059754": 1802, "05e": 1802, "06": [2, 115, 335, 730, 742, 750, 1208, 1704, 1714, 1743, 1753, 1757, 1781, 1802, 1838, 1841, 1842], "060": 1706, "0605": 1752, "061249": 1841, "061485823e": 1706, "062": [1706, 1770], "062748460180": 1743, "063": 1706, "0640": 1841, "064103": [1734, 1774], "064104": 1734, "065": 1706, "0650": 1841, "06509118": 1837, "065301311104": 1743, "06634e": 1838, "0673": 1752, "067403": 1802, "067833831e": 1706, "068": 1828, "0690": 1743, "0696860": 1770, "07": [2, 287, 338, 1734, 1738, 1743, 1786, 1802, 1838], "07038252": 1837, "071": 1706, "072": 1770, "07214637e": 1706, "0729": 1841, "073": 1706, "0735441105e": 1706, "074": [1706, 1770], "074107": [1734, 1781, 1829], "074111": 1781, "074465": 1841, "07455": 1770, "074553080e": 1706, "074617522e": 1706, "0747": 1743, "075": [1757, 1828, 1844], "07500": 1749, "075844098953": 1833, "07606823017188": 1752, "076806": 1841, "077": 1706, "0787495": 1750, "07949567": 1833, "0799": 1841, "079900": [1695, 1700, 1701, 1758], "08": [106, 1781, 1833, 1838, 1841], "0800": 1743, "08095438e": 1706, "081": [1706, 1734], "0812023770e": 1706, "082": 1706, "0823309159": 1802, "08339310458383": 1833, "0836612e": 1706, "084": 1706, "084107": [1692, 1752], "084114": [1734, 1781, 1836], "08555675": 1837, "086": [1706, 1802], "088": 1706, "0880964705": 1743, "0883677": 1770, "0890": 1841, "08900": 1749, "0890958457": 1743, "089590304723": 1833, "0899": 1752, "09": 1743, "090000": [1695, 1696, 1697, 1700, 1702, 1758], "091": 1706, "092486": 1841, "0933": 1743, "094106": [1734, 1781, 1837], "094107": [1230, 1469, 1704, 1734, 1837], "0948": 1841, "0949": 1743, "095": 1770, "096": 1706, "0961": 1743, "097": 1706, "0970": 1837, "09700": 1749, "097806": 1841, "09996723": 1730, "0_0": 1775, "0a": 1817, "0c02405": [295, 318, 319, 1695, 1698, 1702, 1703, 1758, 1766, 1800], "0e": [722, 916, 967, 973, 1030, 1054, 1055, 1072, 1079, 1085, 1086, 1113, 1131, 1135, 1137, 1140, 1207, 1213, 1214, 1218, 1219, 1221, 1224, 1226, 1230, 1231, 1234, 1350, 1351, 1365, 1444, 1455, 1462, 1487, 1488, 1489, 1498, 1506, 1514, 1545, 1567, 1572, 1616, 1617, 1621, 1622, 1627, 1638, 1644, 1648, 1704, 1757, 1771, 1795, 1837, 1838, 1844], "0e9": [374, 395], "0th": [295, 1766, 1796], "0x12d884fc0": [150, 262], "1": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1828, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1839, 1840, 1841, 1842, 1843, 1844], "10": [0, 2, 295, 297, 318, 319, 323, 347, 368, 369, 377, 442, 452, 504, 518, 525, 542, 572, 580, 582, 588, 594, 601, 606, 614, 618, 622, 632, 645, 684, 690, 709, 710, 711, 712, 737, 747, 868, 967, 1131, 1134, 1135, 1199, 1200, 1202, 1203, 1206, 1208, 1210, 1214, 1221, 1230, 1231, 1456, 1477, 1487, 1488, 1506, 1547, 1598, 1616, 1617, 1621, 1622, 1692, 1695, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1706, 1714, 1729, 1730, 1733, 1734, 1738, 1740, 1742, 1743, 1749, 1752, 1753, 1757, 1758, 1759, 1761, 1762, 1764, 1766, 1767, 1768, 1770, 1776, 1781, 1788, 1795, 1800, 1802, 1828, 1837, 1838, 1841, 1842, 1844], "100": [150, 262, 342, 356, 580, 651, 723, 729, 768, 774, 932, 1003, 1080, 1185, 1206, 1207, 1208, 1209, 1213, 1215, 1219, 1222, 1226, 1229, 1231, 1362, 1405, 1416, 1499, 1517, 1577, 1597, 1639, 1704, 1706, 1708, 1734, 1746, 1748, 1754, 1757, 1771, 1788, 1798, 1802, 1808, 1810, 1832, 1836, 1841], "1000": [368, 369, 377, 685, 833, 834, 974, 1031, 1060, 1114, 1206, 1210, 1214, 1218, 1221, 1704, 1821, 1832], "100000": [300, 301, 302, 390, 1232, 1665, 1695, 1697, 1700, 1702, 1704, 1706, 1758, 1772, 1843], "100000000": [651, 1206, 1704, 1743], "1000000000": [374, 395], "100000000000": [374, 395], "100000000kb": [374, 395], "10007984692388": 1836, "1000798469238902": 1836, "1001941536e": 1706, "1002": [377, 1734, 1781], "100644": 1786, "1007": [295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1738, 1740, 1758, 1766, 1781, 1800], "1009": 1738, "100gb": 1767, "101": [1706, 1708, 1734, 1757], "101325": [390, 1232, 1665, 1704, 1706, 1843], "10146": [1692, 1752], "1015": 1743, "1016": [297, 347, 1714, 1734, 1740, 1781, 1842], "102": [323, 1708, 1734, 1832], "1021": [295, 318, 319, 1692, 1695, 1697, 1698, 1700, 1701, 1702, 1703, 1714, 1734, 1752, 1758, 1766, 1776, 1781, 1800, 1842], "1024": [1821, 1832], "10245974": 1743, "102833": 1802, "103": [1708, 1714, 1734, 1789, 1802, 1832, 1842], "10300098": 1743, "10308910109e": 1706, "1039": [1734, 1781], "104": [2, 443, 479, 519, 543, 1199, 1200, 1202, 1203, 1704, 1708, 1714, 1734, 1743, 1750, 1756, 1757, 1759, 1763, 1771, 1788, 1792, 1802, 1828, 1832, 1838, 1842, 1844], "1040380466": [1754, 1803], "104103": [1734, 1781], "104105": [1734, 1754], "104107": [1734, 1781, 1837], "104116": [1734, 1781], "105": [323, 1706, 1708, 1734, 1743, 1802], "106": [1708, 1832], "106066": [1695, 1697, 1700, 1701, 1758], "10626": 1734, "1063": [295, 318, 319, 1231, 1616, 1617, 1692, 1695, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1714, 1734, 1740, 1752, 1758, 1761, 1762, 1766, 1776, 1781, 1800, 1842], "1069765": 1770, "107": [323, 1708, 1734, 1757, 1802], "10715266": 1833, "1073": [295, 318, 319, 1695, 1698, 1702, 1703, 1758, 1766, 1800], "108": [1708, 1833], "1080": [1734, 1776, 1781], "1083509": 1770, "108401996052": 1833, "1085": [1692, 1752], "109": [356, 1692, 1708, 1734, 1752, 1802, 1833], "1092635": 1770, "10938356e": 1706, "10973731": 1706, "10f": [691, 1206, 1704, 1707, 1730, 1731, 1802, 1810], "10mb": 1767, "10x": 1810, "11": [710, 1206, 1231, 1489, 1627, 1692, 1704, 1706, 1708, 1714, 1715, 1734, 1738, 1752, 1757, 1759, 1768, 1770, 1771, 1781, 1788, 1802, 1817, 1821, 1832, 1837, 1838, 1841, 1842], "110": [776, 1209, 1231, 1495, 1704, 1708, 1710, 1734, 1754, 1757, 1802], "11000": 1749, "110000": [1695, 1697, 1700, 1701, 1702, 1758], "1103": [295, 318, 319, 1695, 1697, 1698, 1702, 1703, 1734, 1758, 1766, 1800], "11056e": 1706, "111": [1708, 1734, 1781], "111469": 1837, "111625": 1802, "111984": 1802, "112": [323, 1708, 1714, 1734, 1842], "11216169": 1837, "11227502": 1837, "1124545167": 1706, "1126095262": 1706, "112650056e": 1706, "113": [1692, 1708, 1734, 1752, 1757], "1134289257": 1706, "11362": [1734, 1781], "11373": 1734, "114": [1708, 1734, 1754, 1770], "1140": 1781, "1143863257": 1802, "11449": 1781, "114520": 1837, "11464": 1781, "115": [295, 318, 319, 323, 1695, 1697, 1698, 1702, 1703, 1708, 1740, 1758, 1766, 1800], "11528": 354, "1155": 1743, "1155773223": 1802, "1157": 1841, "116": [1708, 1734], "11604": 1706, "116100": [1695, 1697, 1700, 1758], "11662884": 1740, "117": [323, 1692, 1708, 1734, 1752, 1762], "11719087": 1837, "11789413": 1837, "1179": [1734, 1781], "118": [885, 1210, 1692, 1704, 1708, 1752], "1188": 1734, "11881134": 1740, "1189": 1841, "119": [1708, 1734, 1757, 1802], "11916375": 1740, "1193": [1828, 1844], "119626565582": 1706, "11969410": 1837, "119764": 1802, "11e": 1802, "12": [100, 106, 472, 505, 594, 730, 742, 973, 1030, 1054, 1113, 1137, 1200, 1206, 1208, 1214, 1218, 1221, 1224, 1230, 1231, 1234, 1455, 1514, 1569, 1572, 1573, 1692, 1704, 1706, 1708, 1714, 1734, 1743, 1752, 1753, 1757, 1759, 1767, 1770, 1781, 1802, 1817, 1828, 1833, 1837, 1838, 1841, 1842, 1844], "120": [323, 1708, 1781, 1802, 1833, 1841], "1200": 323, "1202": 1757, "120432": 1802, "12055592": 1837, "121": 1708, "12178201232889": 1833, "122": [323, 1708, 1714, 1842], "1223": [1734, 1841], "1223155812": 1743, "1224836": 1770, "122781": 1802, "123": 1708, "12345": [288, 289, 339, 340], "1235": [1734, 1781, 1837], "124": [1708, 1714, 1842], "124103": 1734, "124104": [1714, 1734, 1781, 1829, 1842], "1241077": 1734, "1244": 1743, "124659": [1828, 1833, 1844], "12492546": 1837, "125": [323, 1708, 1734, 1757], "125000": [1695, 1696, 1697, 1700, 1758], "12581": 1833, "126": 1708, "126185": [1828, 1833, 1844], "127": [1708, 1734, 1740, 1781], "127497720": 1706, "127625308": 1706, "128": [323, 1685, 1708, 1734, 1776, 1781, 1828, 1844], "129": [1708, 1734, 1802], "12900": 1749, "12906": 1706, "12932": 1833, "12e": 1802, "13": [295, 318, 319, 323, 437, 730, 1068, 1199, 1208, 1219, 1224, 1225, 1237, 1247, 1692, 1695, 1698, 1700, 1703, 1704, 1706, 1714, 1752, 1753, 1757, 1758, 1766, 1770, 1771, 1776, 1781, 1800, 1802, 1837, 1841, 1842], "130": [323, 1229, 1427, 1704, 1708, 1730, 1802], "1300": 1743, "130000": [1695, 1696, 1697, 1700, 1758], "1304": [1228, 1387, 1388, 1704], "1307": 1837, "131": [1708, 1734, 1757, 1781], "1313": 1788, "132": [1692, 1708, 1734, 1752, 1781], "1327625515": 1802, "133": [323, 1708, 1734, 1757, 1781, 1828, 1844], "134": [1692, 1708, 1752], "134106": [1692, 1734, 1752, 1837], "134108": [1734, 1838], "135": [323, 1692, 1708, 1734, 1752, 1781], "135060": 1802, "135667662e": 1706, "136": [1734, 1757, 1781], "137": [1706, 1708, 1781], "13702": 1706, "138": [323, 1708, 1734, 1770, 1781], "13802706": 1837, "1387": 1743, "139": [1708, 1734, 1781], "1396": 1837, "13996245042": 1706, "13_seq": 1738, "14": [415, 443, 479, 519, 543, 740, 1198, 1199, 1200, 1202, 1203, 1208, 1225, 1249, 1692, 1704, 1706, 1734, 1743, 1752, 1757, 1759, 1770, 1781, 1802, 1829, 1837, 1841], "140": [323, 1708, 1734, 1770, 1781, 1802, 1838], "1403": 1743, "141": [1230, 1469, 1704, 1708, 1734, 1781, 1837], "1413e": 1706, "14185962536715097": 1752, "14185962536715307": 1752, "142": [1708, 1838], "142206707e": 1706, "143": [323, 1708, 1734, 1781], "1430": 1743, "14344": 1770, "143507": 1802, "144": [323, 1708, 1734, 1781, 1838], "144101": [1734, 1792, 1838], "144104": [1692, 1752], "144105": [1734, 1838], "144108": [1734, 1781], "144112": [1229, 1427, 1704], "145": [1708, 1734, 1838], "1452": [1692, 1734, 1752, 1781], "1454": 1757, "1456": [1734, 1759, 1838], "146": [1231, 1544, 1704, 1708, 1757], "1460": [1692, 1752], "1462": [1734, 1781], "1463": [1734, 1759], "1468": 1734, "147": [1708, 1734, 1770, 1781, 1802], "1470195": [1714, 1842], "1473": 1734, "1475789": 1770, "148": [323, 1708, 1734, 1771], "148460": 1841, "149": [1708, 1734, 1802, 1838], "1495491": 1770, "15": [2, 300, 301, 302, 390, 659, 1206, 1231, 1232, 1545, 1667, 1692, 1704, 1706, 1734, 1738, 1750, 1752, 1754, 1757, 1770, 1771, 1772, 1781, 1788, 1802, 1810, 1828, 1841, 1843, 1844], "150": [323, 689, 1206, 1704, 1708, 1734, 1802, 1836, 1841], "1500": 1838, "150000": [1695, 1697, 1700, 1701, 1702, 1758], "1501": 1781, "151": [1708, 1734], "1514": 1781, "15142168": 1837, "1515314": 1762, "1517084": 1706, "1519120": 1770, "15195886530135": 1833, "152": [1708, 1734, 1752], "152133": 1841, "1524512550e": 1706, "1525": [1734, 1743, 1763], "15267389": 1706, "1529": [1225, 1256, 1704], "153": [323, 1708, 1734], "1534098175176923": 1756, "1535440": 1776, "153725": 1841, "15387002": 1837, "154": [1692, 1708, 1734, 1752], "154104": [1734, 1759], "154105": 1781, "154113": [1734, 1829], "154122": [1734, 1759], "15432897": 1730, "155": [1708, 1752], "15591627": 1730, "156": [323, 1708, 1734], "15647926": 1837, "157": [1708, 1734], "157706": [1695, 1697, 1700, 1701, 1758], "158": [323, 1708, 1734], "159": [1708, 1734], "1593": [1734, 1781, 1838], "159324": 1802, "15e0": [957, 1213, 1225, 1289, 1704], "15g": [691, 1206, 1704, 1810], "16": [2, 368, 377, 1224, 1233, 1692, 1704, 1706, 1708, 1714, 1734, 1742, 1752, 1770, 1771, 1788, 1802, 1810, 1828, 1829, 1834, 1842, 1844], "160": [323, 1708, 1802], "160000": [1695, 1700, 1758], "161": [323, 1708], "1611084524": 1802, "161725": [1734, 1806], "162": [1708, 1802], "1625": 1743, "16281105": 1740, "16297582e": [150, 262], "163": [323, 1708], "1633": 1743, "16382": 1770, "1638694922": 1802, "1639": 1743, "164": 1708, "16400": 1749, "164104": [1734, 1742, 1749, 1754, 1803], "164110": [1734, 1837], "1646305764": 1802, "1646933": 1706, "1648714": 1706, "165": 1708, "1659": 1743, "166": 323, "1663": [1734, 1838], "166478414245": 1771, "16656305": 1837, "166667": [1695, 1700, 1758], "1668": [1734, 1829], "1669340785": 1802, "167": [1770, 1802], "167000": [1695, 1697, 1700, 1701, 1758], "1672": [1734, 1774], "16747e": 1706, "1677": 1837, "1680": 1743, "16885540": 1730, "16937828": 1837, "169500": [1695, 1700, 1758], "1695961": 1730, "16dbd3e": 1788, "17": [106, 1692, 1706, 1734, 1738, 1752, 1757, 1770, 1802, 1837], "170": 1757, "1701843": 1770, "1705670114": [295, 318, 319, 1695, 1698, 1702, 1703, 1758, 1766, 1800], "171": 323, "1712": 1743, "171225850256": 1771, "17293e": 1841, "173": 1734, "1730": 1757, "1733": 1743, "173444111e": 1706, "17386": [1734, 1770], "174017": 1781, "174102": [1734, 1781, 1837], "174103": [1734, 1781], "174107": [1734, 1837], "174122": 1781, "174705953194": 1833, "1752875": 1781, "175973286267": 1771, "176": 323, "176470e": 1706, "1767335622934780": 1836, "1775": [1828, 1844], "1776": [1706, 1828, 1844], "1787": [1734, 1759], "17892163": 1837, "179": 323, "179872325e": 1706, "1799": 1734, "17e": 1802, "18": [1231, 1498, 1692, 1704, 1706, 1714, 1734, 1752, 1770, 1781, 1802, 1837, 1842], "180": [1708, 1838], "180324322304": 1771, "18054663": 1837, "1809087569358e": 1759, "18090932": 1837, "181": [323, 1708], "1814": 1828, "181578117924": 1771, "182": 1708, "1823": [693, 1206, 1704], "1826": 1844, "18300": 1749, "183247172": 1706, "1833": [693, 1206, 1704], "183345142": 1706, "1836": 1706, "1838": 1706, "184": [323, 1706, 1802], "1840917810212307": 1756, "184103": [1734, 1781], "1841068002": 1743, "184108": [1734, 1754, 1837], "184111": [1734, 1781, 1828, 1837, 1844], "185": 1781, "1850101": 1770, "186": 323, "187": 1770, "18710565e": 1706, "187331653300": 1743, "1875": 1706, "18757e": 1838, "18857384937354635": 1752, "1887": [1734, 1781, 1828, 1837, 1844], "1887118848315123": 1752, "189": [323, 1770], "18902e": 1838, "18e": 1802, "19": [1692, 1706, 1714, 1752, 1757, 1770, 1837, 1842], "190": 1708, "190000": [1695, 1697, 1700, 1701, 1758], "1904642137": 1802, "19059785": 1837, "1907": 1743, "191": [323, 1708, 1770, 1782], "1910": 1734, "191042953e": 1706, "1918": 1734, "192": [323, 1708], "1923374156": 1802, "192416": [1695, 1700, 1758], "19285e": 1838, "193": 1708, "1930": [1734, 1763, 1781], "19319632": 1837, "194": [323, 1708, 1757], "194102": [1692, 1752], "1942": 1841, "194300": [1695, 1700, 1758], "195": 1708, "1950": [1734, 1836], "195728": [1695, 1697, 1700, 1701, 1758], "196": 1708, "1964": [1734, 1754, 1757], "1965": [1734, 1757], "197": [1706, 1708], "1978": [1734, 1838], "198": 1708, "1980": [1734, 1755, 1757, 1789], "19803293": 1837, "1981": [1734, 1829], "1982": [0, 1734, 1742, 1757, 1771, 1781], "19825": 1770, "1984": [1734, 1802, 1836], "19846883": 1837, "1985": [1692, 1752], "1986": [1734, 1763], "1987": [1225, 1271, 1704, 1734, 1771, 1802], "1988": [1734, 1755, 1757], "1989": [297, 347, 1734, 1742, 1757, 1771, 1838], "199": 323, "1990": [811, 1210, 1704, 1734, 1755, 1757, 1789], "19902978067739": 1752, "19905879745446": 1752, "1991": [1734, 1771], "19917038": 1837, "1992": [1734, 1754, 1802], "1992967152": 1802, "1993": [443, 479, 519, 543, 1199, 1200, 1202, 1203, 1692, 1704, 1734, 1752, 1754], "199352": [1695, 1700, 1758], "1994": [1734, 1781, 1802, 1828, 1837, 1844], "1995": [1734, 1805, 1810], "1996": [443, 479, 519, 543, 1199, 1200, 1202, 1203, 1692, 1704, 1714, 1734, 1752, 1802, 1842], "199699": 1802, "1997": [1734, 1789, 1798], "1998": [356, 1714, 1734, 1740, 1754, 1798, 1802, 1803, 1838, 1841, 1842], "1999": [1734, 1740, 1755, 1781, 1798], "19e": 1802, "1_": [1775, 1794], "1_0": 1775, "1a": [295, 318, 319, 1683, 1695, 1698, 1700, 1703, 1758, 1766, 1776, 1792, 1793, 1800, 1838], "1a1": [1714, 1786, 1838, 1842], "1a2": 1786, "1a2dev42": 1828, "1a_1": [1714, 1842], "1b": [295, 318, 319, 1683, 1695, 1698, 1700, 1703, 1758, 1766, 1776, 1792, 1793, 1800], "1b1": 1838, "1b2": [1714, 1838, 1842], "1c": [295, 318, 319, 1695, 1698, 1700, 1703, 1758, 1766, 1775, 1800], "1c00280": 1734, "1cp": 1794, "1e": [0, 1, 2, 100, 106, 115, 287, 335, 338, 408, 415, 432, 439, 455, 472, 473, 491, 496, 499, 500, 529, 552, 677, 736, 737, 739, 740, 747, 754, 777, 818, 850, 854, 856, 857, 876, 924, 930, 949, 953, 958, 971, 972, 976, 977, 978, 979, 980, 981, 983, 984, 985, 1001, 1029, 1174, 1178, 1197, 1198, 1199, 1200, 1202, 1203, 1206, 1208, 1209, 1210, 1213, 1214, 1215, 1218, 1222, 1224, 1225, 1226, 1228, 1229, 1230, 1231, 1233, 1257, 1266, 1285, 1287, 1290, 1301, 1328, 1389, 1410, 1424, 1438, 1440, 1442, 1486, 1497, 1552, 1569, 1571, 1573, 1600, 1602, 1603, 1604, 1605, 1654, 1704, 1714, 1742, 1746, 1749, 1754, 1755, 1757, 1771, 1776, 1789, 1798, 1828, 1837, 1838, 1841, 1842], "1e5": [374, 395], "1e8": [1226, 1366, 1704], "1f": [1743, 1802, 1828, 1844], "1g": 1833, "1nocp": 1794, "1p": [295, 318, 319, 1695, 1698, 1700, 1703, 1758, 1766, 1800], "1rc1": [1786, 1788], "1rc2": 1786, "1rdm": [314, 1776, 1791], "1st": [106, 295, 1706, 1766, 1794, 1796], "1tb": 1767, "1u": 1833, "1vmfc": 1794, "1x1": [615, 1206, 1704], "2": [0, 1, 2, 8, 9, 11, 76, 79, 82, 84, 90, 100, 103, 106, 119, 133, 134, 135, 148, 155, 225, 265, 268, 278, 282, 284, 285, 287, 288, 289, 291, 295, 296, 297, 300, 301, 302, 307, 318, 319, 322, 323, 331, 332, 336, 338, 339, 340, 341, 342, 346, 347, 356, 368, 369, 374, 376, 377, 386, 389, 395, 397, 407, 412, 433, 466, 476, 507, 514, 537, 558, 568, 569, 574, 575, 584, 586, 590, 592, 593, 599, 601, 603, 608, 609, 615, 618, 635, 637, 640, 641, 652, 655, 656, 660, 662, 666, 669, 671, 673, 676, 677, 696, 700, 701, 707, 708, 722, 728, 787, 791, 813, 815, 820, 837, 862, 884, 903, 904, 912, 917, 938, 978, 980, 982, 993, 997, 1001, 1004, 1033, 1042, 1097, 1116, 1122, 1125, 1126, 1147, 1182, 1191, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1206, 1207, 1208, 1210, 1212, 1213, 1214, 1215, 1218, 1220, 1221, 1222, 1224, 1225, 1226, 1228, 1229, 1230, 1231, 1235, 1238, 1241, 1242, 1251, 1274, 1299, 1348, 1382, 1387, 1388, 1409, 1453, 1548, 1555, 1556, 1571, 1638, 1648, 1658, 1679, 1680, 1689, 1692, 1694, 1695, 1696, 1697, 1698, 1700, 1703, 1704, 1706, 1707, 1708, 1711, 1714, 1722, 1730, 1731, 1732, 1733, 1734, 1735, 1738, 1739, 1740, 1741, 1742, 1743, 1746, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1762, 1763, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1774, 1775, 1776, 1781, 1782, 1785, 1787, 1789, 1790, 1792, 1794, 1795, 1796, 1797, 1798, 1800, 1802, 1806, 1807, 1808, 1810, 1814, 1821, 1828, 1829, 1832, 1833, 1836, 1837, 1838, 1840, 1841, 1842, 1844], "20": [1, 100, 148, 331, 335, 404, 449, 607, 729, 751, 757, 760, 869, 894, 1029, 1066, 1081, 1196, 1197, 1199, 1206, 1208, 1209, 1210, 1211, 1218, 1219, 1223, 1226, 1229, 1230, 1231, 1347, 1405, 1442, 1444, 1454, 1499, 1660, 1692, 1704, 1706, 1738, 1750, 1752, 1754, 1759, 1767, 1768, 1770, 1771, 1781, 1797, 1802, 1837], "200": [323, 755, 1208, 1231, 1574, 1704, 1743, 1750, 1837], "2000": [374, 395, 693, 1206, 1704, 1714, 1734, 1755, 1781, 1798, 1832, 1837, 1841, 1842], "200000": [1695, 1697, 1700, 1701, 1758], "2000000": 1832, "20000000": 1743, "2000000000": 1832, "2000000000000000": 1756, "2000000000000000000": [374, 395], "2001": [1734, 1805], "2002": [0, 1692, 1734, 1752, 1759, 1762, 1802, 1838], "2003": [885, 1210, 1692, 1704, 1752], "200389": 1802, "2004": [1734, 1759, 1781], "2004088624": [374, 395], "2005": [1692, 1714, 1734, 1750, 1752, 1754, 1803, 1842], "2006": [0, 1692, 1714, 1734, 1740, 1752, 1759, 1781, 1798, 1829, 1837, 1842], "2007": [1692, 1752, 1781, 1788], "2008": [1734, 1754, 1771, 1781, 1792, 1829], "2009": [1229, 1427, 1692, 1704, 1714, 1734, 1742, 1749, 1752, 1754, 1759, 1781, 1798, 1803, 1829, 1837, 1838, 1842], "201": [323, 1734, 1837], "2010": [1692, 1714, 1734, 1749, 1752, 1759, 1781, 1828, 1829, 1837, 1842, 1844], "2011": [1692, 1730, 1733, 1734, 1752, 1759, 1781, 1798, 1828, 1837, 1838, 1844], "2011752233617829": 1756, "2012": [94, 1135, 1221, 1692, 1704, 1734, 1752, 1781, 1798, 1804, 1828, 1837, 1844], "2013": [1692, 1734, 1738, 1752, 1754, 1771, 1774, 1781, 1798, 1803, 1837], "2014": [0, 106, 1230, 1469, 1704, 1714, 1734, 1743, 1754, 1770, 1781, 1792, 1798, 1832, 1837, 1842], "201498": 1832, "2015": [1714, 1715, 1734, 1750, 1763, 1770, 1774, 1781, 1836, 1842], "20150623": 1738, "2016": [1734, 1738, 1746, 1754, 1759, 1781, 1798, 1799, 1802, 1828, 1837], "2017": [1734, 1748, 1757, 1781, 1782, 1786, 1788, 1798, 1806, 1838], "2018": [1692, 1734, 1740, 1752, 1757, 1770, 1774, 1781, 1788, 1798, 1824, 1837, 1839], "201891": 1832, "2019": [1734, 1738, 1754, 1759, 1781, 1798, 1805, 1838], "2020": [1095, 1219, 1704, 1730, 1734, 1738, 1771, 1781, 1783, 1798, 1837, 1838], "2021": [1692, 1734, 1752, 1774, 1798, 1837], "2022": [2, 267, 1230, 1469, 1470, 1704, 1734, 1738, 1740, 1759, 1770, 1792, 1798, 1837, 1838], "2023": [1734, 1754, 1770, 1774, 1788, 1838], "2030": 1757, "203789458": 1706, "20393": 1781, "204": 323, "2041": 1781, "204105": 1781, "204110": 1781, "204111": [1734, 1757], "204114": 1734, "20411857": 1837, "2046601445393486": 1756, "204676": 1832, "2048": [620, 1206, 1231, 1625, 1704], "204890356651": 1743, "205": [1734, 1750], "205087": 1832, "206": 1706, "206361329e": 1706, "206824": 1802, "2074914566": 1802, "207655674855": 1833, "208": [323, 1770], "209": [323, 1734, 1763], "20e": [1743, 1802], "20e5c7": 1788, "21": [1692, 1706, 1752, 1757, 1770, 1821, 1828, 1837, 1838, 1844], "210000": [1695, 1697, 1700, 1758], "210219057e": 1706, "21028": 1841, "2106866": 1706, "2110247636": 1802, "2111": 1734, "21138602": 1706, "212": 323, "2120": 1767, "2120mb": 1767, "212218": 1841, "212288": 1802, "2126": [1714, 1715, 1842], "2126975": [295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "2129": [1714, 1842], "213": 1782, "2134345": 1770, "2136": [1714, 1715, 1842], "214": 323, "2140": [1714, 1842], "214108": [1734, 1802], "214210": 1841, "2143": 1706, "215671574613": 1833, "216": [1734, 1755, 1770], "217": [323, 1734, 1771], "2170": 1743, "217006": 1832, "217439": 1832, "218000": [1695, 1697, 1700, 1758], "21822294": 1837, "21825": 1841, "2185": 1734, "2187691": 1706, "218981": 1833, "21902130": 1837, "219474": 1706, "21947463": 1706, "2197": [1734, 1759], "219847": [1695, 1700, 1758], "21e": 1802, "21g": [1231, 1485, 1694, 1704, 1707, 1730, 1731, 1732, 1733, 1740, 1838], "22": [669, 1206, 1692, 1704, 1706, 1752, 1770, 1788, 1837], "220": [1706, 1708], "220000": [1695, 1696, 1697, 1700, 1702, 1758], "2203": 1734, "220910e": 1706, "221": [1708, 1802], "221189": 1832, "221605": 1832, "221781602033": 1833, "222": [1708, 1770], "222036": [1695, 1697, 1700, 1701, 1758], "222105": 1802, "2223": 1706, "2225726872441811": 1756, "223": [1708, 1788], "223147494072": 1771, "22321549": 1837, "2235996493": 1802, "224": [323, 1708], "224103": [1734, 1781], "2248": 1743, "224946": 1832, "224987": 1832, "225": 1708, "225254251294": 1771, "226": 1708, "2260576084217405": 1756, "226173": 1802, "227": [323, 1708, 1770], "227361008515": 1771, "2275971": 1706, "2278": [1734, 1805], "228": 1708, "22812415": 1837, "228668": 1832, "228727": 1832, "229": [1708, 1770], "2290": 1734, "229015": [1695, 1700, 1758], "2297110": 1770, "22e": 1743, "23": [323, 669, 1206, 1692, 1704, 1706, 1730, 1734, 1750, 1752, 1757, 1770], "230": [323, 1708, 1734, 1757], "230995119324": 1771, "231431666069": 1771, "232055": [1695, 1700, 1758], "232253": [1828, 1833, 1844], "234103": 1734, "234104": [1734, 1838], "234107": [1734, 1837], "234567": 1733, "235": 323, "235051": 1706, "235380085e": 1706, "2354": 1757, "2365": [1692, 1752], "2370496": 1770, "2371": 1781, "237978": [1695, 1700, 1758], "23872336e": 1706, "2390": 1743, "239431": 1841, "2395": 1734, "24": [669, 805, 1206, 1210, 1225, 1256, 1692, 1704, 1706, 1734, 1752, 1755, 1770], "240": [323, 1833], "240759": 1802, "241": 1833, "241102": [1734, 1838], "241304": 1802, "241509126e": 1706, "2417367": 1770, "242": 323, "2427": [1692, 1752], "24289005": 1837, "2429731e": 1706, "243": [323, 1740, 1833], "24325177": 1837, "243777": 1802, "244": 1833, "244115": 1734, "245": 323, "246": 1734, "246150": 1802, "24700": 1749, "247849447550": 1833, "248": [323, 1738], "249": 1770, "2491": 1841, "249258": 1841, "24938": 1841, "25": [323, 644, 669, 704, 923, 969, 1206, 1213, 1214, 1225, 1231, 1256, 1494, 1692, 1704, 1706, 1714, 1734, 1743, 1752, 1757, 1768, 1770, 1776, 1842], "250": [323, 1708, 1750, 1832], "250000": [1695, 1697, 1700, 1701, 1702, 1758], "251": 1708, "2510842e": 1706, "25122": 1734, "252": [1708, 1740], "25200": 1749, "25216749": 1837, "252325": 1833, "2523427206e": 1706, "252468": 1833, "253": 1708, "253224": 1802, "254": 1708, "255": [323, 1708], "255250616": 1706, "25554938": 1837, "256": [1231, 1515, 1704, 1708], "257": [1708, 1828, 1844], "2570": [1734, 1781, 1837], "258": 1708, "25812": 1706, "258686": 1802, "258836941658": 1771, "259": 1708, "2594122526144091": 1752, "25945": [1734, 1838], "259958": 1802, "26": [669, 1206, 1704, 1706, 1734, 1757, 1770], "260": 1708, "26092": 1841, "260943698880": 1771, "261": [1708, 1759], "26106": 1770, "2614": [1734, 1740], "262": 1708, "2625": 1706, "26277": 1706, "2629759351596186": 1752, "263": 1708, "263050456101": 1771, "263201": [1714, 1734, 1759, 1842], "264": 1708, "264065": 1802, "2642563": 1770, "265": [1708, 1734, 1802], "265122720724": 1829, "26529903": 1837, "26535": 1770, "26535160": 1837, "26543510": 1837, "2657": 1743, "266": [1708, 1757, 1770], "26601138679877": 1833, "266684566910": 1771, "266705": 1833, "266920": 1802, "267": 1708, "267121113654": 1771, "267515317": 1706, "267522190": 1706, "2687": [1734, 1771, 1781], "269": [1734, 1781], "269000": [1695, 1696, 1697, 1700, 1702, 1758], "269288": [1695, 1700, 1758], "26945": 1841, "2696": [1734, 1781], "26970292": 1837, "26e": 1743, "27": [436, 1067, 1199, 1219, 1225, 1245, 1704, 1706, 1734, 1757, 1771, 1776, 1781], "270": [1708, 1844], "270000": [1695, 1696, 1697, 1700, 1702, 1758], "270191667755": 1743, "2702": 1757, "271": 1708, "27158877": 1837, "272": [1708, 1781], "2720813": 1706, "273": [300, 301, 302, 390, 1232, 1667, 1704, 1706, 1708, 1772, 1843], "27338e": 1838, "273516": 1802, "273896": 1738, "27392413": 1837, "274": [1708, 1734], "274009994e": 1706, "2743014": 1781, "2747241": 1740, "274985": 1802, "275": [1708, 1782, 1802], "27504": 1841, "275705492359": 1743, "276": 1708, "277": 1708, "278": 1708, "279": 1708, "2790": 1743, "28": [1706, 1776, 1786, 1833], "280": [1708, 1734], "2800": 1837, "280000": [1695, 1697, 1700, 1702, 1758], "28024": 1706, "2808": 1706, "281": 1708, "28140": 1770, "281508": 1802, "28197234": 1706, "282": 1708, "28232": 1770, "283": 1708, "2834927": 1781, "284": [1708, 1838], "2842": [1734, 1837], "2844102558783027": 1752, "28451": 1770, "28455969": 1837, "284764620e": 1706, "285": 1708, "2851": 1734, "28558683837122": 1833, "286": [1708, 1740], "286062": 1833, "28660857": 1837, "286988509018": 1833, "287": [323, 1708, 1838], "28722": 1841, "288": 1708, "28808866712e": 1706, "289": [1708, 1833], "289841960355e": 1706, "28th": 1837, "29": [1706, 1734, 1757, 1837], "290": 1708, "290000": [1695, 1700, 1702, 1758], "291": 1708, "291772106700e": 1706, "2917721067e": 1706, "292": 1708, "29200": 1749, "293": [1708, 1734, 1771, 1781], "29333205": 1706, "293712317e": 1706, "294": 1740, "29412053242164": 1752, "29432": 1770, "29448051": 1837, "295": 1770, "29709": 1770, "298": [390, 1232, 1667, 1704, 1714, 1754, 1842, 1843], "299": [1734, 1781], "29927518": 1837, "29954136": 1706, "299792458": 1706, "2999": [1734, 1754, 1803], "2_": [1775, 1794], "2_0": 1775, "2a": [295, 318, 319, 1692, 1695, 1698, 1700, 1703, 1752, 1758, 1766, 1800], "2a1": [1748, 1838], "2a_1": [660, 1206, 1704, 1833], "2b": [295, 318, 319, 1695, 1698, 1700, 1703, 1758, 1766, 1800], "2b1": [1714, 1842], "2b2": [1714, 1842], "2b_1": 1833, "2b_2": 1833, "2c": [295, 318, 319, 1695, 1698, 1700, 1703, 1758, 1766, 1775, 1800, 1836], "2c06465": 1734, "2ce1c29": 1788, "2cp": 1794, "2d": [150, 255, 262, 263, 1694, 1732, 1733], "2df": [1694, 1732, 1733], "2e": [1226, 1349, 1364, 1704, 1776], "2g": 1833, "2h": [698, 1206, 1704, 1757, 1833, 1838], "2l": 1810, "2m": 106, "2n": [82, 862, 1210, 1704, 1755], "2n_": 1837, "2nd": [295, 318, 319, 381, 382, 1695, 1696, 1698, 1700, 1706, 1743, 1744, 1745, 1746, 1758, 1762, 1766, 1777, 1786, 1790, 1794, 1796, 1800, 1806, 1826, 1844], "2nm": [811, 1210, 1704, 1755], "2nocp": 1794, "2nx2n": 356, "2order": 1717, "2ovn_aux": 1837, "2p": [1694, 1732, 1733], "2pd": [1694, 1732, 1733], "2pi": 139, "2q": 1756, "2qov": 1756, "2rc1": 1748, "2sf": 1805, "2t_": 1763, "2t_2": 1771, "2u": 1833, "2v": [1730, 1771, 1833, 1837, 1838], "2vmfc": 1794, "2x": [295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1758, 1766, 1800, 1810], "2x2": [811, 855, 1210, 1704, 1755, 1789], "2zapa": [1694, 1707, 1731, 1732], "3": [0, 63, 75, 89, 100, 103, 106, 139, 148, 150, 156, 267, 278, 284, 288, 289, 295, 300, 301, 302, 310, 318, 319, 331, 339, 340, 346, 361, 368, 369, 377, 381, 382, 386, 387, 388, 389, 390, 399, 496, 574, 584, 586, 601, 608, 609, 613, 616, 635, 637, 652, 655, 660, 662, 671, 676, 696, 735, 736, 739, 756, 840, 841, 848, 896, 937, 954, 979, 983, 993, 1028, 1096, 1106, 1125, 1154, 1156, 1200, 1206, 1208, 1210, 1211, 1213, 1214, 1215, 1217, 1219, 1221, 1224, 1225, 1226, 1230, 1231, 1235, 1239, 1246, 1273, 1303, 1304, 1326, 1349, 1351, 1352, 1364, 1365, 1447, 1449, 1451, 1476, 1479, 1485, 1516, 1644, 1658, 1662, 1680, 1683, 1689, 1692, 1694, 1695, 1698, 1700, 1703, 1704, 1706, 1707, 1708, 1711, 1714, 1717, 1726, 1730, 1731, 1732, 1733, 1734, 1735, 1738, 1739, 1740, 1742, 1743, 1746, 1748, 1749, 1750, 1752, 1753, 1756, 1757, 1758, 1759, 1764, 1766, 1767, 1770, 1771, 1772, 1774, 1776, 1781, 1782, 1787, 1789, 1792, 1793, 1794, 1797, 1798, 1799, 1800, 1802, 1803, 1805, 1808, 1810, 1814, 1817, 1821, 1826, 1828, 1829, 1832, 1833, 1837, 1838, 1841, 1842, 1844], "30": [2, 313, 364, 374, 395, 853, 1135, 1210, 1221, 1225, 1263, 1286, 1704, 1706, 1750, 1767, 1768, 1789, 1828, 1837], "300": [2, 634, 649, 1206, 1704, 1708, 1743], "3000": 1837, "300000": [1695, 1697, 1700, 1701, 1702, 1758], "30000000000l": [374, 395], "30078276": 1822, "301525": 1802, "30193450": 1837, "302": [770, 1144, 1209, 1221, 1231, 1536, 1635, 1704, 1740, 1754, 1757, 1838], "30239689": 1837, "30277": 1770, "3031992532": 1802, "304": [1734, 1781], "304098": 1833, "30557377e": 1706, "3070122077": 1706, "3074": 1757, "309": [1734, 1754, 1803], "30900": 1749, "30957": 1841, "30e": 1802, "31": [323, 1694, 1706, 1730, 1732, 1733, 1757, 1802, 1810], "310": [1748, 1788], "310000": [1695, 1696, 1697, 1700, 1702, 1758], "31030140": 1837, "311": [1694, 1732, 1733, 1788], "311g": [1694, 1707, 1731, 1732, 1733], "311g_2d_": [1694, 1707, 1731, 1732], "311g_2d_2p_": [1694, 1707, 1731, 1732], "311g_2d_p_": [1694, 1707, 1731, 1732], "311g_2df_": [1694, 1707, 1731, 1732], "311g_2df_2p_": [1694, 1707, 1731, 1732], "311g_2df_2pd_": [1694, 1707, 1731, 1732], "311g_2df_p_": [1694, 1707, 1731, 1732], "311g_3df_": [1694, 1707, 1731, 1732], "311g_3df_2p_": [1694, 1707, 1731, 1732], "311g_3df_2pd_": [1694, 1707, 1731, 1732], "311g_3df_3pd_": [1694, 1707, 1731, 1732], "311g_3df_p_": [1694, 1707, 1731, 1732], "311g_d_": [1694, 1707, 1731, 1732], "311g_d_p_": [1694, 1707, 1731, 1732], "311gss": [1707, 1731], "311pg": [1694, 1707, 1731, 1732], "311pg_2d_": [1694, 1707, 1731, 1732], "311pg_2d_2p_": [1694, 1707, 1731, 1732], "311pg_2d_p_": [1694, 1707, 1731, 1732], "311pg_2df_": [1694, 1707, 1731, 1732], "311pg_2df_2p_": [1694, 1707, 1731, 1732], "311pg_2df_2pd_": [1694, 1707, 1731, 1732], "311pg_2df_p_": [1694, 1707, 1731, 1732], "311pg_3df_": [1694, 1707, 1731, 1732], "311pg_3df_2p_": [1694, 1707, 1731, 1732], "311pg_3df_2pd_": [1694, 1707, 1731, 1732], "311pg_3df_3pd_": [1694, 1707, 1731, 1732], "311pg_3df_p_": [1694, 1707, 1731, 1732], "311pg_d_": [1694, 1707, 1731, 1732], "311pg_d_p_": [1694, 1707, 1731, 1732], "311pgss": [1707, 1731], "311ppg": [1694, 1707, 1731, 1732], "311ppg_2d_": [1694, 1707, 1731, 1732], "311ppg_2d_2p_": [1694, 1707, 1731, 1732], "311ppg_2d_p_": [1694, 1707, 1731, 1732], "311ppg_2df_": [1694, 1707, 1731, 1732], "311ppg_2df_2p_": [1694, 1707, 1731, 1732], "311ppg_2df_2pd_": [1694, 1707, 1731, 1732], "311ppg_2df_p_": [1694, 1707, 1731, 1732], "311ppg_3df_": [1694, 1707, 1731, 1732], "311ppg_3df_2p_": [1694, 1707, 1731, 1732], "311ppg_3df_2pd_": [1694, 1707, 1731, 1732], "311ppg_3df_3pd_": [1694, 1707, 1731, 1732], "311ppg_3df_p_": [1694, 1707, 1731, 1732], "311ppg_d_": [1694, 1707, 1731, 1732], "311ppg_d_p_": [1694, 1707, 1731, 1732], "311ppgss": [1707, 1731], "3128110": 1770, "3141": 1743, "3144598": 1706, "314577": 1802, "3150": 1743, "31533": 1770, "31534": 1841, "315775": 1706, "315852": 1841, "3159": 1837, "3185": 1781, "31959090481e": 1706, "3197": 1781, "31e": 1743, "31g": [265, 284, 1694, 1707, 1711, 1714, 1731, 1732, 1733, 1740, 1743, 1752, 1757, 1782, 1789, 1794, 1828, 1842, 1844], "31g_d_": [1694, 1707, 1731, 1732], "31g_d_p_": [1694, 1707, 1731, 1732], "31gss": [1707, 1731], "31pg": [1694, 1707, 1731, 1732], "31pg_d_": [1694, 1707, 1731, 1732], "31pg_d_p_": [1694, 1707, 1731, 1732], "31pgss": [1707, 1731], "31pm": 1786, "31ppg": [1694, 1707, 1731, 1732], "31ppg_d_": [1694, 1707, 1731, 1732], "31ppg_d_p_": [1694, 1707, 1731, 1732], "31ppgss": [1707, 1730, 1731], "32": [288, 289, 295, 339, 340, 354, 575, 651, 1206, 1685, 1704, 1706, 1734, 1766, 1776, 1799], "321": 1734, "32140985396e": 1706, "322226": 1802, "325": 1706, "32500": 1749, "3251": 1706, "325106": 1841, "3259": 1734, "326": [1734, 1781], "3269788": 1706, "3271056135": 1802, "3276": 1781, "329": 1734, "3292990446": 1802, "3295094": 1770, "33": [150, 262, 323, 1706, 1708, 1781], "330": 1740, "330000": [1695, 1697, 1700, 1701, 1758], "33048": 1770, "3304922": [1714, 1842], "3305335": 1781, "330735040e": 1706, "33100": 1749, "33102504900e": 1706, "3315674": 1770, "33199": 1841, "332242848098": 1743, "33224285": 1743, "332260965382": 1743, "33226097": 1743, "33226140": 1743, "332261404452": 1743, "332261408714": 1743, "33226141": 1743, "33289": 1706, "332940127935": 1743, "333": [1734, 1740, 1802], "333333": [1695, 1700, 1701, 1758], "3333333333333333": 1756, "33405042": 1837, "335640951e": 1706, "336952636980364": 1752, "336952636980506": 1752, "336987": 1802, "3383498": 1770, "33843": 1770, "338453952539": 1743, "33865984413460": 1833, "33916119": 1837, "33981720": 1837, "34": [1706, 1708, 1734, 1781, 1788, 1837], "3407": 1743, "34127251": 1837, "34146e": 1841, "342": 323, "34231776": 1706, "3426316": 1781, "343": [1734, 1782], "343127": 1802, "343583719e": 1706, "34395089": 1837, "34500": 1749, "3451077": 1781, "3451968428": 1833, "345717550569": 1743, "34656": 1841, "3470": 1757, "3477": 1706, "3479400": 1781, "348": 1770, "3487495": 1770, "349": 1706, "349093": 1802, "35": [282, 323, 332, 775, 1209, 1231, 1493, 1704, 1706, 1708, 1754, 1757, 1837], "350": [804, 1210, 1704, 1708, 1734, 1757], "3503657": 1781, "3504": [1734, 1824], "350625": 1837, "3509": 1743, "351": [1708, 1734], "3511": 1734, "351261319421": 1833, "35157390": 1837, "352": 1708, "353": 1708, "3531168": 1770, "354": [804, 1210, 1704], "3540": 1743, "355": [1714, 1842], "355311": 1802, "356": [1734, 1770], "356023604706": 1838, "356392512e": 1706, "357": [1734, 1763], "35760": 1841, "35909265": 1837, "359744650": 1706, "359744650e": 1706, "35e": 1802, "36": [323, 1706, 1708, 1734, 1757], "360": [1231, 1590, 1659, 1704, 1734], "360000": [1695, 1696, 1697, 1700, 1758], "36130548": 1837, "362": 1770, "36243": 1770, "3624397": 1781, "3629": [1734, 1805], "3631129": 1781, "364": [323, 1770], "36406353": 1743, "36407122": 1743, "36408021": 1743, "36408563": 1743, "36409177": 1743, "36409932": 1743, "36410422": 1743, "36411044": 1743, "36411859": 1743, "36412938": 1743, "36414365": 1743, "36416227": 1743, "36418623": 1743, "36421659": 1743, "36425461": 1743, "36430165": 1743, "36435916": 1743, "36442840": 1743, "3656681": 1781, "365860": 1802, "365913941094": 1833, "3665134": 1781, "3670": 1706, "368443": 1802, "3686": [1734, 1838], "36962": 1770, "37": 1708, "370000": [1695, 1696, 1697, 1700, 1758], "37040396": 1837, "371180": 1833, "3720": 1743, "3721": [1734, 1749], "37212939": 1837, "372497201e": 1706, "3727": 1706, "3734": 1734, "37373581838636": 1752, "373741": 1837, "3743208": 1770, "375000": [1695, 1696, 1697, 1700, 1702, 1758], "37522": 1841, "37542977": 1837, "376": 1706, "376787": 1802, "3768100495": 1802, "377": 1734, "379": 1802, "37905": 1770, "379378": 1706, "3794": 1844, "3795": 1828, "3797598812113561": 1752, "37e": 1802, "38": [323, 1708, 1757, 1788, 1802, 1828, 1833, 1844], "3803890": 1730, "38060": 1770, "38064852e": 1706, "381": [651, 1206, 1704, 1802], "38332109": 1837, "38368112": 1837, "38426": 1841, "385": 1781, "386": 1802, "38659740": 1837, "3866": [1734, 1759], "387673": 1802, "388": 1717, "388142": 1841, "3885044": 1770, "3890": 1757, "38900": 1749, "38e": 1802, "39": [1706, 1708, 1734, 1748, 1788, 1802], "391": 1738, "39116e": 1706, "391586": 1706, "39195739": 1730, "392": 1770, "39246770": 1837, "393": 1734, "39320925": 1837, "395442": 1802, "3960": 1743, "39600": 1749, "396608": 1802, "397": 323, "397780": 1802, "398": 1734, "39822383": 1837, "39876776": 1833, "39951283": 1730, "39987": 1770, "39e": 1743, "3a1": 1838, "3b1": [1714, 1842], "3c": [106, 267, 295, 318, 319, 1695, 1698, 1699, 1700, 1701, 1703, 1718, 1757, 1758, 1766, 1774, 1781, 1800], "3d": 106, "3d4s4p4d4f": [1714, 1842], "3df": [1694, 1732, 1733], "3dmp2": [295, 1689, 1766, 1776, 1837], "3e": [982, 1214, 1704], "3f": [1743, 1821], "3g": [284, 386, 1694, 1707, 1710, 1713, 1714, 1724, 1729, 1730, 1731, 1732, 1733, 1740, 1749, 1752, 1754, 1757, 1803, 1832, 1833, 1838, 1842], "3o": 1837, "3pd": [1694, 1732, 1733], "3rc1": [1787, 1814], "3rc2": 1788, "3rc3": 1788, "3rd": [295, 318, 319, 1225, 1256, 1704, 1743, 1744, 1745, 1766, 1794, 1800], "3s3p": [1714, 1842], "3u": 1833, "3v": 1771, "3zapa": [1694, 1707, 1731, 1732], "4": [84, 96, 100, 103, 143, 144, 148, 150, 192, 193, 203, 204, 206, 253, 264, 284, 288, 289, 295, 300, 301, 302, 310, 318, 319, 331, 339, 340, 346, 361, 368, 369, 377, 389, 578, 591, 601, 607, 613, 616, 618, 628, 641, 652, 665, 671, 676, 696, 754, 856, 857, 876, 888, 916, 930, 955, 958, 993, 1032, 1056, 1072, 1096, 1101, 1115, 1139, 1147, 1206, 1208, 1210, 1213, 1215, 1218, 1219, 1220, 1221, 1224, 1225, 1226, 1229, 1230, 1231, 1235, 1241, 1245, 1246, 1247, 1253, 1254, 1255, 1265, 1266, 1272, 1273, 1274, 1275, 1290, 1326, 1333, 1351, 1365, 1421, 1422, 1458, 1459, 1461, 1486, 1616, 1654, 1692, 1704, 1711, 1714, 1725, 1729, 1734, 1740, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1760, 1761, 1763, 1766, 1767, 1770, 1771, 1772, 1775, 1776, 1782, 1783, 1792, 1794, 1798, 1800, 1828, 1829, 1837, 1841, 1842], "40": [323, 741, 1208, 1231, 1523, 1704, 1706, 1708, 1743, 1750, 1752, 1802, 1841], "400": [1708, 1734, 1770, 1837], "4000": 1837, "400000": [1695, 1696, 1697, 1700, 1701, 1758], "4005": 1706, "4009": 1734, "400kb": 1788, "401": 1708, "40100": 1749, "401500": [1695, 1697, 1700, 1758], "40217026": 1837, "4037278": 1706, "40386": 1841, "404": 1802, "40502969": 1837, "4057590": 1770, "40794598": 1837, "408": 323, "4080144050": 1743, "40807e": 1841, "4091028": 1770, "40958884746667": 1752, "41": [323, 1706, 1708, 1757], "41037138e": [150, 262], "410570547e": 1706, "4106067873e": 1706, "41065224": 1837, "4113": [1828, 1844], "41169e": 1838, "41246": 1770, "414": 1746, "41407": 1841, "414895": 1841, "416": 1828, "416808e": 1706, "417": [1786, 1794, 1838, 1844], "4170": 1743, "4171": 1734, "41768202": 1837, "417989262e": 1706, "418": 1786, "418648109779": [1828, 1844], "418674031273": [1828, 1844], "41867403127321": [1828, 1844], "418884326509e": 1706, "41972294": 1837, "41e": 1743, "42": 1706, "420000": [1695, 1697, 1700, 1702, 1758], "4212": [1828, 1844], "42148": 1841, "42333": 1770, "424295": 1788, "424700": 1837, "425": 1770, "42525091": 1730, "42552e": 1841, "4263102367e": 1706, "42788430": 1837, "428": 1734, "428000": [1695, 1697, 1700, 1701, 1702, 1758], "4285": [1734, 1838], "4291": 1734, "429560656538": 1833, "42966050": 1837, "42e": 1802, "43": [1706, 1708], "43000": 1749, "430000": [1695, 1700, 1702, 1758], "431020504e": 1706, "431500": 1837, "43239563": 1837, "43252": 1841, "4334": 1757, "43351854": 1837, "434": 1757, "43409966": 1706, "435": 1770, "4367983": 1770, "436840": 1802, "437": 1740, "43813": 1770, "4389": [1734, 1781], "4390": 1743, "4396": 1841, "4398216616e": 1706, "4399": 1734, "44": [1706, 1708], "440000": [1695, 1697, 1700, 1702, 1758], "441": [1734, 1754], "4417": [1734, 1770, 1781], "4429": 1743, "4431206": 1770, "4436083": 1730, "44463454": 1730, "4449979205": 1802, "4459192939": 1802, "446": 1740, "447": 1782, "44820652": 1706, "45": [1706, 1708, 1740, 1833, 1836], "450000": [1695, 1701, 1758], "45023975": 1837, "451": [1734, 1750], "452": 323, "453": 1802, "45315cb": 1788, "45344432": 1837, "45347471": 1837, "45347768": 1837, "45552656": 1837, "4557": 1841, "456": 1770, "45673981": 1837, "4598161475": 1743, "4598854": 1770, "45989805": 1706, "46": [323, 1706, 1708], "460000": [1695, 1696, 1697, 1700, 1702, 1758], "461": 1734, "4630807": 1770, "46375": 1841, "46454628": 1833, "465272": 1802, "4655": [297, 347], "466": 1802, "46600": 1749, "4676": 1743, "468": 1802, "4685031765008461": 1836, "46952": 1841, "46975875": 1837, "46e": 1802, "47": 1757, "470000": [1695, 1696, 1697, 1700, 1701, 1758], "47226565": 1788, "47226573": 1788, "4723133": 1770, "4728": [1734, 1781, 1829], "473": 1734, "47320": 1770, "4739423": 1781, "474": [323, 1802], "4740249": [1231, 1616, 1617, 1704], "4741": 1781, "47449560": 1837, "475": 1802, "47550008": 1837, "476741": 1734, "47692534": 1837, "4772692868": 1802, "4773580": 1781, "477483": 1734, "47801205": 1837, "47828501": 1837, "478353552e": 1706, "479": 1734, "47979303": 1833, "47996433": 1837, "48": [323, 1706, 1734, 1740], "4800": 1743, "480000": [1695, 1696, 1700, 1702, 1758], "4802": 1757, "4803662": 1781, "4811537": 1770, "48122": 1770, "4816628": 1781, "4818470201": [1754, 1803], "4818470204": [1754, 1803], "481873213172": 1833, "482": 1802, "48200": 1749, "4820877": 1781, "4825041": 1781, "4826520": 1781, "48296785": 1706, "483": [1734, 1802], "4833138": 1781, "48342016": 1837, "4843682167491039": 1836, "485": 323, "485797": 1841, "48579909070e": 1706, "486": 1802, "4862157": 1761, "486551484e": 1706, "4867135": 1781, "48758504": 1837, "48808e": 1838, "48819": 1770, "4892946": 1781, "4895864": 1770, "49": [1706, 1734, 1802], "490": 1802, "4902226": 1781, "49044826e": 1706, "491": 1802, "49186": 1841, "492418062e": 1706, "4927575": 1781, "4929609": 1770, "4937410": 1734, "4940734": [295, 318, 319, 1695, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "4940954": 1706, "4945706": [1734, 1781], "4948318": [1734, 1781], "49612913": 1837, "49639": 1770, "4976": [1692, 1752], "49800e": 1838, "4994190": 1734, "4994918": [1734, 1781], "499539341e": 1706, "4996382852165050": 1706, "4a": [1692, 1752], "4a1": 1757, "4a2": 1767, "4b": [1714, 1842], "4c": 1836, "4d_": 1838, "4e0596": 1786, "4ec3cae0546b6ae4f4f2cf28482cd164c8323cc6": [1692, 1752], "4f": 1833, "4f3": 1788, "4gb": [92, 1802], "4qov": 1756, "4rc1": 1748, "4th": [295, 318, 319, 1743, 1744, 1745, 1762, 1766, 1800], "4zapa": [1694, 1707, 1731, 1732], "5": [0, 1, 2, 13, 103, 150, 284, 291, 295, 296, 310, 314, 318, 319, 323, 341, 361, 375, 381, 382, 396, 404, 432, 487, 502, 549, 583, 588, 601, 606, 618, 632, 635, 641, 652, 669, 696, 700, 814, 835, 852, 854, 893, 933, 953, 972, 981, 993, 1028, 1138, 1147, 1153, 1180, 1197, 1199, 1200, 1203, 1206, 1210, 1211, 1213, 1214, 1215, 1217, 1221, 1222, 1224, 1225, 1226, 1228, 1229, 1231, 1236, 1245, 1246, 1247, 1253, 1254, 1255, 1265, 1269, 1272, 1273, 1274, 1275, 1287, 1297, 1299, 1340, 1343, 1395, 1396, 1421, 1422, 1426, 1522, 1556, 1567, 1568, 1604, 1605, 1644, 1645, 1658, 1670, 1675, 1680, 1684, 1692, 1694, 1695, 1698, 1700, 1701, 1704, 1706, 1707, 1711, 1714, 1730, 1731, 1732, 1733, 1734, 1738, 1739, 1740, 1741, 1742, 1743, 1746, 1748, 1750, 1752, 1753, 1756, 1757, 1758, 1759, 1761, 1763, 1764, 1766, 1767, 1768, 1769, 1770, 1771, 1776, 1781, 1782, 1783, 1786, 1789, 1791, 1792, 1796, 1798, 1800, 1802, 1808, 1809, 1817, 1821, 1826, 1828, 1832, 1833, 1834, 1836, 1837, 1838, 1841, 1842, 1844], "50": [1, 405, 431, 447, 524, 548, 585, 633, 646, 663, 914, 950, 966, 970, 1062, 1136, 1197, 1199, 1202, 1203, 1206, 1213, 1214, 1218, 1221, 1225, 1226, 1228, 1230, 1231, 1243, 1267, 1325, 1332, 1391, 1439, 1457, 1496, 1542, 1607, 1658, 1704, 1706, 1708, 1710, 1714, 1742, 1749, 1757, 1770, 1776, 1798, 1802, 1808, 1832, 1837, 1841, 1842], "500": [2, 685, 1141, 1206, 1221, 1231, 1592, 1704, 1786, 1828, 1832], "5000": 377, "50000": [572, 1206, 1704], "500000": [1695, 1696, 1697, 1700, 1702, 1758], "50005": 1770, "500387735e": 1706, "500mib": [374, 395], "501": 1770, "5012601": [295, 318, 319, 1695, 1698, 1699, 1703, 1734, 1758, 1766, 1800], "50223e": 1838, "5026452583": 1802, "503195220163": 1833, "503277593e": 1706, "503457": 1706, "503900": 1837, "504": 1802, "50405": 1841, "50432831": 1837, "504609503e": 1706, "505": 1802, "50500": 1781, "505349739e": 1706, "5057": 1837, "50586123": 1837, "506": 1802, "50669": 1770, "50673730": 1837, "507144": 1841, "5080": 1743, "5086168": 1734, "5090222": 1734, "509190205e": 1706, "5094737775374055927342256": 1706, "50962": 1770, "50964": 1841, "5096595e": 1706, "51": [323, 1706, 1708], "510000": [1695, 1696, 1700, 1758], "5106510": 1770, "5109989461": 1706, "512": [620, 1206, 1231, 1661, 1704, 1757, 1770], "5130066166e": 1706, "5137": 1837, "5139948": 1734, "51414": 1770, "5144964": 1734, "515": [1734, 1759], "5150": 1743, "51500": 1749, "51612746": 1837, "517327": 1833, "5173865": 1770, "518": 1802, "51934253": 1833, "5198298460088e": 1706, "51e": 1743, "52": [1706, 1708], "520000": [1695, 1696, 1697, 1700, 1758], "5218583": 1770, "522": [1734, 1805], "5221": 1706, "522300": [1695, 1697, 1700, 1702, 1758], "5238121": 1770, "523870772178089": 1752, "524": 1802, "524438411e": 1706, "5244823836": 1802, "52532395": 1837, "52534243": 1837, "527107413251": 1833, "528063": 1706, "5281": 1743, "5286439": 1770, "528790": 1706, "52917721067": 1706, "5294": 1757, "52971": 1841, "53": [1706, 1708, 1734, 1757], "530": 1734, "530000": [1695, 1696, 1697, 1700, 1758], "53532814": 1730, "536": 1828, "53614999": 1837, "53617865e": 1706, "53635": 1770, "536418": 1802, "53752571": 1837, "538": 1844, "53800": 1749, "5390": 1743, "54": [297, 323, 347, 1706, 1810], "540000": [1695, 1696, 1697, 1700, 1702, 1758], "540030314": 1781, "540100111": 1734, "5409035710": 1802, "5410": 1743, "541746451895025916414946904": 1706, "54291925": 1837, "54385233": 1837, "544757019107": 1838, "546": 1802, "546935": 1802, "5477": 1734, "548101": 1833, "5482": 1734, "5495": 1706, "5496": 1706, "55": [601, 1206, 1704], "550": [1714, 1734, 1759, 1842], "550000": [1695, 1696, 1697, 1700, 1758], "550414": 1802, "5504918473": 1802, "551007": 1837, "552136": 1841, "553": 1770, "55358703": 1837, "555": [1714, 1842], "55514739": 1837, "556": [1770, 1781], "55600": 1749, "556335252767e": 1706, "557000": [1695, 1700, 1758], "557685": 1833, "558111": 1802, "56": [323, 1224, 1233, 1235, 1236, 1237, 1238, 1239, 1241, 1704, 1733, 1740], "560000": [1695, 1697, 1700, 1702, 1758], "56083": 1841, "5615900098": [1754, 1803], "562": 323, "563468": 1802, "5654133": 1706, "5656": [1692, 1752], "56634474": 1837, "5665603": 1770, "56695248": 1837, "567900": [1695, 1700, 1702, 1758], "56841161": 1837, "568508": 1706, "57042064": 1837, "571249748886": 1833, "5748636": 1770, "57500": 1749, "57530818": 1837, "57615966": 1837, "57636": 1770, "57638507": 1706, "57747892": 1706, "57944161": 1837, "579683920711e": 1706, "58": [601, 1206, 1704, 1706, 1738], "58009e": 1838, "58073": 1841, "581": 1802, "5810": 1757, "582119514e": 1706, "583": 1770, "58408901": 1837, "585694702": 1706, "58728357": 1837, "589": [1714, 1842], "5897959670": 1743, "58991e": 1838, "58e": 1743, "59": [323, 601, 1206, 1704, 1706, 1757], "590": 1757, "59003378": 1837, "59009": 1770, "5904026": 1770, "592": 1782, "592753": 1802, "5930": 1771, "593333": 1841, "594": 1770, "59496320631871": 1838, "595": 323, "5968": [1734, 1771], "5976": [1225, 1271, 1704], "599677": 1837, "5a7522a": 1788, "5b00817": [1734, 1781], "5b01128": [1734, 1781], "5d": [691, 1206, 1704, 1707, 1722, 1730, 1731, 1810], "5d87b55": 1786, "5e": 1743, "5e5": [374, 395], "5e8": [92, 1832], "5z": 1738, "5zapa": [1694, 1707, 1731, 1732], "6": [0, 1, 150, 262, 265, 284, 291, 295, 296, 303, 310, 321, 323, 341, 361, 374, 389, 395, 408, 433, 439, 466, 473, 491, 499, 500, 507, 514, 572, 601, 609, 614, 622, 635, 641, 662, 686, 690, 696, 709, 711, 712, 722, 734, 763, 818, 907, 911, 924, 931, 936, 971, 976, 985, 993, 1002, 1079, 1085, 1174, 1178, 1197, 1199, 1200, 1201, 1202, 1206, 1207, 1208, 1209, 1210, 1212, 1213, 1214, 1215, 1219, 1222, 1224, 1225, 1226, 1229, 1230, 1231, 1233, 1242, 1250, 1257, 1272, 1285, 1350, 1410, 1444, 1445, 1462, 1478, 1497, 1552, 1638, 1692, 1694, 1704, 1706, 1707, 1711, 1714, 1729, 1730, 1731, 1732, 1733, 1734, 1738, 1739, 1740, 1742, 1743, 1746, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1757, 1759, 1763, 1766, 1769, 1770, 1771, 1775, 1776, 1781, 1782, 1786, 1788, 1789, 1792, 1794, 1795, 1798, 1802, 1817, 1828, 1832, 1833, 1837, 1838, 1841, 1842, 1844], "60": [342, 356, 601, 1206, 1231, 1652, 1704, 1708, 1750, 1757, 1841], "600": [374, 395, 1844], "600000": [1695, 1696, 1697, 1700, 1758], "600000000": [374, 395], "600000000l": [374, 395], "6008": 1837, "601": [1714, 1842], "6021766208e": 1706, "60218631": 1837, "6031427": 1770, "60532": 1781, "605693009": 1706, "606": 323, "606057": 1802, "6061": [1734, 1754], "6064153737": 1802, "60709": 1770, "60768372": 1730, "609588650e": 1706, "60998364": 1837, "60e": 1743, "61": [323, 601, 1206, 1704, 1706, 1708], "6100822": 1786, "6103": [1734, 1755], "6106": [1692, 1752], "611": [1714, 1842], "61249e": 1838, "612928": 1706, "6137632": 1770, "614413": [1695, 1700, 1702, 1758], "615938": 1841, "616229e": 1706, "62": [601, 1206, 1704, 1706, 1708, 1735], "62000698": 1837, "622593285": 1706, "62349901753706": 1838, "62391373": 1730, "623ad64": 1748, "6240195463": 1802, "626070040e": 1706, "62639942687878": 1838, "62689561367233": 1838, "62694151275420": 1838, "62694337910040": 1838, "62694340915198": 1838, "62694340999315": 1838, "627": 1706, "62730705472407": 1838, "62730737348096": 1838, "62730738537113": 1838, "62730738624032": 1838, "627352": [1828, 1833, 1844], "628": 323, "6286": [443, 479, 519, 543, 1199, 1200, 1202, 1203, 1704], "629145600": [374, 395], "6297": [443, 479, 519, 543, 1199, 1200, 1202, 1203, 1704], "63": [284, 601, 1206, 1704, 1706, 1708, 1740], "6313702": 1706, "6324": 1743, "63645e": 1838, "636822": 1833, "63697e": 1838, "637563": 1833, "639": 323, "639498336738": 1833, "63e": [1743, 1802], "64": [323, 575, 595, 601, 651, 1206, 1685, 1704, 1708, 1738, 1776, 1788], "640882152784": 1833, "6431662": 1770, "644657230e": 1706, "64545587": 1837, "64572e": 1841, "6478": 1828, "6480": 1844, "64800": 1749, "6487772731e": 1706, "649232019048": 1838, "64gb": 1837, "65": [323, 1706, 1734, 1757, 1828, 1844], "650000": [1695, 1696, 1697, 1700, 1758], "65010327": 1837, "6509": 1734, "651226": 1802, "6516467e": 1706, "65200": 1749, "65238683": 1837, "6524587158e": 1706, "65300": 1749, "65344779": 1833, "65441e": 1841, "65498573": 1837, "65616e": 1838, "656530": 1802, "65723": 1833, "6579683920": 1706, "658": 1706, "6583745": 1706, "66": [323, 1734], "660000": [1695, 1696, 1697, 1700, 1702, 1758], "660539040000e": 1706, "660539040e": 1706, "6615": [1734, 1759], "6623650e": 1706, "6645256529074572": 1836, "6649726": 1770, "667578": [1828, 1833, 1844], "67": 1706, "6700535363": 1706, "670367e": 1706, "6709": 1743, "67171405": 1706, "672": 323, "672621898e": 1706, "673": 1782, "673774709694": 1833, "67384e": 1832, "674": 1770, "67408e": 1706, "67416758080654": 1752, "674927471e": 1706, "678369": 1802, "68": [1734, 1781], "680": 1770, "680000": [1695, 1696, 1697, 1700, 1758], "680398": 1837, "683": 323, "683650": 1802, "68366158": 1706, "6838545": 1770, "684669": 1802, "68497934": 1706, "68499694": 1706, "686": [1230, 1469, 1704, 1837], "68644814": 1706, "68662563": 1837, "6867811e": 1706, "687348": 1802, "6888063568e": 1838, "689090": 1802, "68980e": 1838, "68990e": 1838, "69": [323, 1706, 1734], "690000": [1695, 1696, 1697, 1700, 1702, 1758], "69193e": 1838, "692833774e": 1706, "693240": [1828, 1833, 1844], "693370": 1802, "69430495": 1752, "69435362": 1752, "69464439": 1837, "695000": 1841, "69570268": 1837, "69689985": 1837, "697024": 1802, "699036": 1802, "69968912": 1837, "6a": [1692, 1752], "6b00456": 1734, "6cbc05e": 1786, "6d": [691, 1206, 1704, 1707, 1722, 1730, 1731, 1810], "6f": [1828, 1833, 1844], "6g": [1694, 1707, 1731, 1732], "6h": 1730, "6z": 1738, "6zapa": [1694, 1707, 1731, 1732], "7": [284, 295, 297, 323, 347, 455, 529, 552, 582, 601, 613, 628, 645, 669, 684, 696, 850, 876, 949, 993, 1055, 1086, 1176, 1199, 1202, 1203, 1206, 1210, 1213, 1215, 1218, 1219, 1222, 1226, 1229, 1231, 1301, 1328, 1408, 1548, 1602, 1603, 1692, 1704, 1706, 1711, 1714, 1730, 1734, 1738, 1739, 1740, 1742, 1743, 1746, 1748, 1749, 1752, 1753, 1755, 1757, 1759, 1761, 1766, 1770, 1771, 1776, 1781, 1782, 1786, 1788, 1789, 1792, 1798, 1802, 1805, 1808, 1828, 1829, 1833, 1837, 1838, 1841, 1842], "70": [1231, 1632, 1704, 1838], "700": 1757, "7000176": 1808, "70011547": 1730, "705": 323, "70649e": 1841, "70684615": 1837, "707325": 1802, "707746": 1802, "708370": 1802, "7084139850": 1743, "70861e": 1706, "709": 1782, "7093200": 1730, "70932405488924": [1828, 1844], "70932405488935": [1828, 1844], "7096126": 1770, "71": [1708, 1757], "710000": [1695, 1696, 1697, 1700, 1758], "7109913627": 1802, "711": 1706, "71100": 1749, "711418672248": 1833, "71200": 1749, "713491": 1833, "7140": [1734, 1755], "715": 1788, "7151": 1837, "7151135": 1770, "71581": 1841, "716": [323, 1770], "717362356e": 1706, "717651915252": 1833, "7197947": 1770, "71e": 1743, "72": [1708, 1833], "720000": [1695, 1696, 1700, 1758], "7221": [1734, 1771], "72286487": 1837, "7230": 1734, "72343814": 1837, "727": [323, 1833], "72700202": 1743, "72764911": 1743, "72806043": 1743, "72817678": 1743, "72821875": 1743, "72827951": 1743, "72831099": 1743, "72831991": 1743, "72836761": 1743, "72842215": 1743, "72845143": 1743, "72845373": 1743, "72848118": 1743, "72850993": 1743, "72852567": 1743, "72853498": 1743, "72855167": 1743, "72855247": 1743, "7288723155": 1802, "7294": 1706, "72e": 1802, "73": [1708, 1734, 1738], "730": [628, 1206, 1704, 1770], "730313461": 1706, "73076": 1841, "730924488e": 1706, "73200": 1749, "73400": 1749, "735": [575, 1206, 1704], "735e": 1759, "736": [443, 479, 519, 543, 1199, 1200, 1202, 1203, 1704], "7369": 1833, "7370": 1833, "7371": 1833, "739": 1770, "739888": 1841, "74": [295, 1708, 1734, 1757, 1766], "740": [443, 479, 519, 543, 1199, 1200, 1202, 1203, 1704], "74100": 1749, "741771790e": 1706, "742": 1770, "74247000": 1837, "74296": 1833, "7445512": 1770, "745960643462": 1833, "7478283184": 1802, "748": 1738, "748978309671": 1833, "749": [323, 1770], "74900": 1749, "75": [297, 323, 347, 714, 1143, 1207, 1221, 1231, 1533, 1618, 1704, 1708, 1743, 1757, 1832], "75000": 1749, "750000": [1695, 1696, 1697, 1700, 1758], "7505": 1833, "751e": 1706, "75483e": 1841, "755": 1738, "7550": 1706, "7550882318031839256652313": 1706, "75689e": 1841, "7569489": 1770, "7577": 1743, "757718": 1844, "758561": 1837, "758605": 1828, "758820024e": 1706, "76": [2, 323, 1706, 1708, 1734, 1743, 1752, 1756, 1771, 1776, 1828, 1832, 1844], "76075473": 1837, "760859644e": 1706, "7611816259664579": 1836, "7617665603": 1706, "7617861313": 1706, "762": [651, 1206, 1704], "762503": 1837, "7638459": 1770, "76487181": 1837, "766603000356": 1833, "7669880": 1706, "7680411190": 1802, "7682826": 1706, "76960": 1841, "7696838": 1770, "76e": 1743, "77": [323, 1708, 1752, 1757], "770": [1230, 1469, 1704, 1757, 1837], "77037903": 1837, "771": 323, "772570540211": 1833, "772960": 1802, "774": 1770, "77605762": 1837, "77624": 1841, "777290": 1833, "77763": 1770, "78": [1734, 1752], "782661907e": 1706, "7842846": 1770, "78438": 1833, "785": [1734, 1792], "786082": 1802, "7865043": 1770, "786fb2b": 1788, "7878417": 1770, "788248": 1841, "79": [323, 1706, 1708], "790": [1692, 1752, 1802], "792": 1770, "792775600": 1706, "7928473508": 1706, "793701": [1695, 1696, 1700, 1758], "7949930": 1770, "799": [1734, 1754], "7992447e": 1706, "799961446760": 1838, "7b00174": 1781, "7f": [691, 1206, 1704, 1707, 1730, 1731, 1810], "7th": [1714, 1842], "7z": 1738, "7zapa": [1694, 1707, 1731, 1732], "8": [2, 284, 285, 287, 336, 338, 374, 395, 601, 662, 687, 696, 777, 847, 918, 977, 984, 1029, 1034, 1077, 1140, 1206, 1209, 1210, 1213, 1214, 1218, 1219, 1221, 1226, 1228, 1230, 1231, 1341, 1389, 1438, 1440, 1442, 1543, 1600, 1692, 1704, 1706, 1711, 1736, 1737, 1738, 1739, 1740, 1743, 1748, 1749, 1752, 1754, 1757, 1759, 1770, 1771, 1781, 1782, 1786, 1787, 1792, 1798, 1802, 1814, 1821, 1828, 1829, 1833, 1837, 1838, 1841, 1844], "80": [313, 323, 364, 485, 1200, 1231, 1629, 1704, 1708, 1743, 1752, 1841], "800000000": [374, 395], "80032977420572": 1838, "8007": [1714, 1842], "801466202085710": 2, "8031688251": [1754, 1803], "804": [323, 1743], "8040686146": 1802, "80466e": 1838, "805375": 1802, "805894": 1802, "806554": 1706, "80665": 1706, "807": 1706, "807024": 1802, "807436": 1802, "8074555": 1706, "80760445": 1837, "80800": 1749, "8088610": 1730, "80937379": 1837, "81": 1708, "810717": 1802, "811790225041": 1833, "81251": 1770, "81348351": 1833, "8138764635": 1833, "8139169342": 1802, "8141619690": 1802, "8153482424": 1802, "8167": 1706, "8179403227e": 1706, "81e": 1743, "82": [0, 323, 1734, 1738], "8218": [356, 1734], "821873": 1802, "82204": 1770, "82293384": 1833, "825": 323, "82608545": 1706, "826189": 1841, "82714": 1770, "827253": [1734, 1781], "828215": 1841, "82e": 1743, "83": [1706, 1708, 1757, 1810], "8318": 1734, "83217802": [150, 262], "833": 1802, "8330227": 1770, "833601608592": 1833, "834": [1794, 1838], "8340933116": 1802, "8357382590": 1743, "835978525e": 1706, "835979e": 1706, "83718642": 1837, "839500": 1837, "8396901": 1770, "84": [323, 1708, 1781], "84372": 1770, "84608": 1770, "84678e": 1706, "84717649": 1752, "84e": [1743, 1759], "85": [1110, 1221, 1704, 1706, 1708, 1750, 1752], "850718": 1802, "850870129e": 1706, "85252518": 1837, "85358e": 1838, "854187817e": 1706, "85440936": 1837, "854801999e": 1706, "85518839": 1738, "85541474": 1833, "8566666": 1770, "8574382311": 1706, "86": [1708, 1757], "860": 1770, "8615926764e": 1706, "8624456357": 1802, "863178": 1841, "864": 1706, "86635e": 1838, "867": [1770, 1802], "8670730": 1770, "867594308e": 1706, "87": [323, 1225, 1271, 1704, 1708, 1734, 1810], "87104935": 1837, "878": [1692, 1752], "8789238e": 1706, "88": [1692, 1706, 1708, 1734, 1752, 1789], "88024338": 1706, "881": 323, "8811319": 1770, "881921": 1841, "8822939": 1770, "88342055": 1837, "883531594e": 1706, "883829": 1802, "88527922": 1706, "8853463281": 1802, "888": [1692, 1752], "8887241813": 1802, "8897161646320724": 323, "89": [297, 323, 347, 1708, 1734, 1757], "89059705": 1706, "890600": 1837, "8910365886e": 1706, "89111": 1706, "892": 323, "8921463": 1770, "89248408": 1706, "89372": 1706, "895249": 1841, "8960491": 1770, "89725": 1770, "89884187": 1837, "89e": [1743, 1802], "8b00072": [295, 318, 319, 1695, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "8b00286": 1734, "8b01089": [1734, 1781], "8f": 1834, "9": [2, 106, 150, 192, 193, 203, 204, 262, 284, 285, 287, 336, 338, 374, 395, 601, 695, 764, 766, 902, 927, 1051, 1206, 1209, 1212, 1213, 1218, 1229, 1230, 1424, 1481, 1482, 1692, 1704, 1706, 1734, 1736, 1740, 1743, 1748, 1749, 1752, 1754, 1757, 1759, 1763, 1767, 1770, 1771, 1774, 1781, 1802, 1817, 1828, 1832, 1833, 1837, 1838, 1840, 1841], "90": [855, 1058, 1210, 1218, 1231, 1624, 1704, 1706, 1713, 1730, 1742, 1750, 1767, 1770, 1789, 1802], "900": 323, "90033": [297, 347], "90041e": 1838, "900503": [1828, 1833, 1844], "90100": 1749, "9015844116": [1754, 1803], "901788": 1841, "902": 1706, "9024664": 1770, "903": 1770, "9030376": 1770, "90349624": 1837, "90749": 1706, "907714": 1802, "9084": [885, 1210, 1704], "9094": [885, 1210, 1704], "90986540": 1837, "9099": 1743, "90997067": 1837, "91": 1706, "91003922": 1837, "912085762652": 1838, "91304273": 1706, "91313050": 1837, "9143727": 1770, "91526": 1833, "91591820": 1802, "9160": [1692, 1734, 1752, 1802], "91714746": 1837, "9178691296": 1743, "918035522052": 1833, "91816882": 1837, "91e": 1802, "92": [323, 1692, 1708, 1752, 1836], "920155714e": 1706, "92050": 1706, "9209603634": 1802, "921112": 1706, "9212623197e": 1706, "9213": [1714, 1842], "9215": 1762, "92153588": 1706, "923": 1770, "923499": 1706, "923621": [1828, 1833, 1844], "92529543": 1802, "92533462456894": 1844, "925334628859886": 1828, "92533462887677": 1828, "92540669": 1802, "92548668": 1802, "92548698": 1802, "925572581453": 1833, "926": 1781, "92934049": 1833, "92967": 1770, "9298523": 1770, "92e": 1802, "93": [1708, 1757, 1781, 1828, 1844], "93023559": 1837, "93042809": 1833, "931": [1706, 1770], "931494095": 1706, "934259": 1837, "936": 1770, "938": 1706, "9382724": 1770, "939": 1706, "93e": 1743, "94": [1708, 1734, 1781], "94200": 1749, "94222": 1770, "944245": 1802, "946347": 1802, "948079": 1833, "949": 1802, "949807": 1841, "95": [1692, 1708, 1734, 1752, 1757, 1802], "950962": 1833, "95107": 1786, "95164": 1706, "952052": 1802, "953": 1803, "95387e": 1841, "955593": 1802, "957": 1832, "9574": 1837, "9574153": 1770, "95788332": 1706, "957924920": 1706, "958": 1743, "95e": 1802, "96": [1734, 1828, 1844], "960": 1706, "96187e": 1838, "962771": 1841, "963929": [1828, 1833, 1844], "9646519": 1770, "96485": 1706, "965": [1770, 1802], "96785": 1770, "9681078610": 1802, "968607": 1802, "97": [323, 1708, 1734, 1837], "971": 1802, "971920097e": 1706, "97259968907": 1706, "973": [1734, 1754], "974": 1757, "9770": [1734, 1802], "97787e": 1706, "977905": 1802, "978": 1782, "9780195357738": 1734, "9780470125915": 1781, "9781118008720": [377, 1734], "978834": 1802, "978962460": 1706, "98": [693, 1206, 1704, 1714, 1734, 1740, 1838, 1842], "98000": 1749, "98104857": 1833, "9846751653": 1802, "98526650": 1837, "986445824e": 1706, "986471814808": 1833, "987551787e": 1706, "98921779": 1837, "98e": 1802, "99": [2, 285, 287, 323, 336, 338, 1084, 1219, 1704, 1740, 1757, 1763, 1802], "990085": 1832, "990195": 1832, "990227": 1802, "9903127110e": 1706, "99100": 1749, "9920": 1837, "99216": 1770, "992851882e": 1706, "99315267046": 1706, "99371703348": 1706, "994915": [1828, 1844], "99497e": 1838, "99500": 1749, "9950517332": 1833, "9964630692": 1802, "99734": 1770, "998400": 1802, "99862347844": 1706, "999": [644, 1206, 1704, 1786, 1803], "99900750087": 1706, "99e": 1802, "9b00860": 1734, "9g": [691, 1206, 1704, 1810], "A": [0, 1, 2, 11, 13, 26, 75, 76, 100, 106, 138, 150, 182, 259, 284, 287, 295, 296, 303, 314, 321, 324, 327, 329, 335, 338, 342, 356, 368, 369, 374, 377, 386, 395, 399, 404, 433, 434, 446, 466, 484, 507, 514, 592, 596, 640, 679, 729, 770, 776, 837, 906, 957, 993, 1048, 1153, 1197, 1199, 1200, 1201, 1202, 1206, 1208, 1209, 1210, 1212, 1213, 1215, 1218, 1221, 1225, 1226, 1229, 1230, 1231, 1242, 1283, 1289, 1294, 1304, 1313, 1336, 1405, 1469, 1473, 1485, 1499, 1500, 1520, 1536, 1544, 1556, 1669, 1675, 1679, 1683, 1704, 1706, 1708, 1713, 1714, 1725, 1726, 1730, 1734, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1746, 1748, 1749, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1760, 1761, 1764, 1765, 1766, 1767, 1768, 1769, 1771, 1772, 1774, 1776, 1777, 1780, 1781, 1782, 1783, 1785, 1786, 1789, 1790, 1791, 1792, 1794, 1797, 1798, 1801, 1802, 1803, 1806, 1809, 1810, 1817, 1823, 1824, 1828, 1832, 1833, 1835, 1838, 1839, 1841, 1842, 1843, 1844], "AND": [794, 1210, 1704, 1770, 1821], "AT": [1685, 1714, 1776, 1798, 1799, 1828, 1842], "And": [1738, 1767, 1777, 1780, 1828, 1844], "As": [106, 111, 284, 577, 1206, 1704, 1707, 1730, 1731, 1736, 1737, 1738, 1740, 1743, 1746, 1748, 1750, 1752, 1753, 1755, 1757, 1759, 1763, 1767, 1770, 1779, 1781, 1783, 1789, 1798, 1801, 1802, 1810, 1821, 1828, 1829, 1832, 1834, 1837, 1838, 1841, 1844], "At": [2, 342, 356, 617, 641, 1125, 1206, 1221, 1704, 1707, 1731, 1738, 1740, 1749, 1752, 1753, 1754, 1756, 1757, 1763, 1764, 1770, 1771, 1774, 1782, 1792, 1801, 1802, 1803, 1809, 1828, 1833, 1834, 1837, 1838, 1844], "Be": [614, 661, 1126, 1206, 1221, 1224, 1240, 1704, 1707, 1731, 1761, 1786, 1788], "But": [2, 1748, 1759, 1788, 1837, 1843], "By": [0, 2, 106, 284, 671, 681, 1206, 1704, 1735, 1740, 1743, 1747, 1750, 1753, 1754, 1755, 1759, 1762, 1767, 1768, 1770, 1771, 1788, 1794, 1799, 1801, 1808, 1824, 1828, 1832, 1833, 1836, 1837, 1838, 1841, 1844], "For": [0, 1, 2, 8, 106, 150, 158, 159, 279, 283, 292, 296, 300, 301, 302, 324, 333, 342, 343, 350, 376, 397, 416, 433, 457, 466, 507, 514, 539, 569, 593, 601, 608, 609, 616, 628, 659, 660, 662, 665, 671, 675, 681, 700, 707, 715, 727, 794, 833, 861, 1126, 1150, 1188, 1189, 1190, 1191, 1198, 1199, 1200, 1201, 1202, 1203, 1206, 1207, 1208, 1210, 1221, 1222, 1225, 1226, 1230, 1231, 1242, 1313, 1326, 1448, 1449, 1450, 1463, 1464, 1465, 1466, 1615, 1620, 1704, 1714, 1730, 1733, 1738, 1740, 1742, 1743, 1746, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1762, 1763, 1764, 1765, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1792, 1794, 1795, 1796, 1798, 1799, 1800, 1801, 1802, 1803, 1809, 1810, 1817, 1824, 1828, 1832, 1833, 1835, 1837, 1838, 1839, 1841, 1842, 1844], "IN": [1668, 1669, 1690, 1776], "If": [0, 1, 2, 8, 13, 64, 84, 86, 100, 106, 148, 150, 255, 259, 262, 267, 282, 284, 296, 300, 301, 302, 303, 318, 319, 326, 329, 331, 332, 335, 342, 346, 377, 384, 389, 430, 474, 550, 569, 570, 573, 593, 616, 638, 656, 660, 661, 672, 704, 707, 726, 746, 808, 821, 827, 852, 859, 860, 862, 875, 930, 934, 949, 958, 1025, 1026, 1027, 1129, 1157, 1199, 1200, 1203, 1206, 1208, 1210, 1213, 1217, 1221, 1224, 1225, 1226, 1228, 1230, 1231, 1236, 1240, 1266, 1290, 1331, 1332, 1381, 1453, 1565, 1578, 1612, 1654, 1704, 1714, 1730, 1735, 1738, 1740, 1742, 1743, 1746, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1761, 1762, 1763, 1764, 1765, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1782, 1783, 1784, 1785, 1786, 1788, 1791, 1792, 1794, 1797, 1798, 1800, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1817, 1821, 1824, 1828, 1829, 1833, 1835, 1837, 1838, 1839, 1841, 1842, 1843, 1844], "In": [0, 1, 2, 8, 106, 150, 284, 314, 329, 377, 575, 584, 603, 609, 619, 623, 626, 655, 660, 695, 697, 747, 829, 890, 921, 922, 1125, 1206, 1208, 1210, 1213, 1221, 1224, 1225, 1230, 1241, 1244, 1441, 1704, 1707, 1714, 1731, 1734, 1735, 1737, 1738, 1740, 1741, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1756, 1757, 1759, 1762, 1763, 1764, 1765, 1767, 1770, 1771, 1773, 1775, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1791, 1794, 1797, 1798, 1799, 1801, 1802, 1803, 1808, 1809, 1810, 1817, 1824, 1828, 1829, 1832, 1833, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1844], "It": [0, 2, 5, 84, 279, 285, 336, 510, 573, 609, 660, 681, 882, 883, 993, 1124, 1201, 1206, 1210, 1215, 1221, 1231, 1498, 1704, 1738, 1740, 1742, 1743, 1746, 1747, 1748, 1750, 1752, 1753, 1755, 1764, 1767, 1770, 1772, 1781, 1786, 1788, 1789, 1791, 1801, 1803, 1808, 1810, 1817, 1824, 1828, 1829, 1833, 1835, 1836, 1837, 1838, 1841, 1843, 1844], "Its": [1739, 1781], "NO": [150, 314, 596, 707, 1000, 1163, 1206, 1215, 1221, 1704, 1714, 1746, 1762, 1785, 1791, 1836, 1842], "NOT": [87, 1124, 1221, 1704, 1738, 1752, 1759], "NOs": [1083, 1084, 1085, 1219, 1231, 1614, 1704, 1771, 1837], "NeAr": [1692, 1752], "Near": [1781, 1828, 1844], "No": [1, 2, 11, 284, 410, 422, 495, 516, 522, 531, 550, 563, 569, 593, 601, 608, 609, 616, 623, 628, 629, 630, 631, 636, 660, 665, 670, 671, 679, 715, 717, 733, 767, 771, 778, 783, 784, 794, 810, 819, 824, 825, 827, 829, 855, 892, 897, 899, 963, 1005, 1006, 1007, 1008, 1009, 1032, 1033, 1050, 1057, 1065, 1075, 1099, 1100, 1102, 1103, 1108, 1109, 1111, 1112, 1115, 1116, 1120, 1123, 1126, 1127, 1128, 1130, 1150, 1155, 1156, 1158, 1159, 1160, 1161, 1162, 1164, 1165, 1168, 1170, 1177, 1192, 1195, 1197, 1198, 1200, 1202, 1203, 1204, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1214, 1215, 1218, 1219, 1220, 1221, 1222, 1223, 1226, 1227, 1230, 1231, 1304, 1307, 1308, 1309, 1310, 1311, 1314, 1318, 1319, 1320, 1321, 1322, 1336, 1357, 1358, 1359, 1360, 1371, 1377, 1437, 1445, 1446, 1484, 1502, 1521, 1527, 1551, 1559, 1562, 1579, 1581, 1582, 1584, 1586, 1595, 1619, 1642, 1655, 1657, 1658, 1692, 1704, 1730, 1736, 1740, 1742, 1743, 1746, 1750, 1752, 1754, 1755, 1759, 1763, 1767, 1771, 1772, 1775, 1781, 1785, 1788, 1789, 1791, 1832, 1834, 1835, 1836, 1837, 1841], "Not": [150, 296, 778, 799, 886, 1209, 1210, 1704, 1737, 1738, 1740, 1743, 1754, 1769, 1776, 1781, 1785], "ON": [1, 576, 579, 596, 597, 598, 602, 604, 617, 625, 626, 636, 639, 640, 642, 648, 655, 658, 672, 673, 678, 679, 680, 682, 688, 691, 692, 693, 694, 695, 698, 699, 701, 706, 1206, 1704, 1738, 1746, 1748, 1749, 1754, 1762, 1765, 1773, 1775, 1782, 1783, 1784, 1788, 1803, 1839], "ONE": [2, 286, 294, 337, 345, 1690, 1776, 1821], "OR": [794, 1210, 1228, 1393, 1704, 1738, 1748, 1749, 1759, 1764], "Of": [2, 603, 1206, 1704, 1748, 1798, 1828, 1844], "On": [1730, 1736, 1748, 1757, 1767, 1787, 1808, 1810, 1814, 1838], "One": [84, 150, 267, 317, 342, 365, 377, 577, 771, 1206, 1209, 1704, 1714, 1752, 1753, 1754, 1757, 1759, 1767, 1770, 1771, 1777, 1790, 1828, 1832, 1833, 1834, 1836, 1837, 1838, 1842, 1844], "Ons": [1738, 1748, 1777, 1787], "Or": [150, 255, 1737, 1738, 1748, 1786, 1797], "Such": [2, 692, 1206, 1704, 1757, 1764], "THE": 1828, "TO": 1794, "That": [2, 586, 1206, 1704, 1738, 1743, 1748, 1764, 1786, 1794, 1801, 1828, 1832, 1838, 1844], "The": [0, 1, 2, 8, 11, 13, 14, 64, 81, 83, 84, 87, 88, 100, 106, 111, 112, 113, 115, 128, 130, 134, 135, 138, 145, 148, 150, 214, 265, 284, 295, 296, 300, 301, 302, 312, 314, 318, 319, 321, 322, 325, 329, 335, 342, 352, 356, 368, 369, 377, 381, 382, 390, 399, 403, 410, 411, 412, 414, 420, 422, 430, 432, 433, 454, 466, 467, 474, 476, 507, 513, 514, 523, 528, 531, 547, 551, 557, 568, 569, 572, 575, 580, 582, 586, 593, 594, 601, 603, 606, 607, 608, 609, 614, 616, 622, 632, 635, 641, 644, 646, 647, 659, 660, 662, 664, 670, 671, 672, 677, 678, 685, 690, 696, 697, 703, 709, 710, 711, 712, 716, 720, 729, 744, 751, 752, 755, 756, 757, 759, 772, 791, 800, 811, 820, 823, 826, 828, 829, 833, 870, 873, 874, 876, 882, 884, 889, 890, 929, 930, 935, 944, 946, 947, 949, 958, 961, 993, 997, 1002, 1005, 1006, 1007, 1008, 1009, 1021, 1084, 1095, 1097, 1099, 1100, 1101, 1118, 1120, 1124, 1148, 1149, 1153, 1167, 1168, 1177, 1192, 1194, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1206, 1207, 1208, 1209, 1210, 1213, 1215, 1216, 1219, 1220, 1221, 1222, 1224, 1225, 1226, 1228, 1229, 1230, 1231, 1241, 1242, 1266, 1279, 1281, 1282, 1283, 1290, 1294, 1296, 1323, 1341, 1379, 1398, 1399, 1400, 1401, 1402, 1403, 1405, 1409, 1423, 1426, 1427, 1429, 1433, 1454, 1455, 1463, 1464, 1465, 1466, 1479, 1498, 1499, 1512, 1513, 1515, 1516, 1517, 1518, 1522, 1523, 1524, 1525, 1526, 1527, 1529, 1530, 1532, 1550, 1551, 1559, 1561, 1562, 1563, 1567, 1572, 1573, 1574, 1579, 1580, 1581, 1589, 1595, 1608, 1611, 1655, 1661, 1662, 1704, 1706, 1711, 1713, 1714, 1726, 1730, 1733, 1735, 1737, 1738, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1774, 1775, 1776, 1777, 1779, 1781, 1782, 1785, 1786, 1788, 1789, 1790, 1791, 1792, 1794, 1795, 1796, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1808, 1809, 1810, 1818, 1821, 1823, 1824, 1826, 1828, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "Then": [2, 8, 279, 1714, 1740, 1746, 1748, 1749, 1762, 1765, 1767, 1770, 1773, 1775, 1782, 1783, 1784, 1798, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1838, 1839, 1842], "There": [0, 2, 344, 616, 628, 640, 842, 1206, 1210, 1704, 1730, 1735, 1738, 1742, 1743, 1748, 1751, 1755, 1759, 1764, 1770, 1771, 1774, 1781, 1788, 1799, 1801, 1809, 1810, 1817, 1823], "These": [265, 321, 377, 570, 574, 664, 1206, 1230, 1231, 1441, 1690, 1704, 1714, 1730, 1733, 1738, 1740, 1743, 1750, 1753, 1754, 1757, 1759, 1767, 1770, 1771, 1774, 1776, 1780, 1782, 1788, 1789, 1794, 1798, 1799, 1802, 1808, 1809, 1810, 1817, 1824, 1828, 1832, 1833, 1837, 1838, 1839, 1841, 1842, 1844], "To": [0, 1, 2, 106, 150, 153, 275, 681, 829, 1206, 1210, 1704, 1730, 1735, 1737, 1738, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1762, 1765, 1767, 1769, 1770, 1773, 1774, 1775, 1782, 1783, 1784, 1786, 1792, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1810, 1817, 1823, 1824, 1828, 1831, 1832, 1833, 1837, 1838, 1839, 1844], "Will": [150, 314, 1225, 1229, 1231, 1245, 1246, 1247, 1253, 1254, 1255, 1265, 1272, 1273, 1274, 1275, 1421, 1422, 1548, 1704, 1791, 1798], "With": [0, 2, 356, 662, 1125, 1206, 1221, 1704, 1750, 1759, 1771, 1788, 1810, 1817, 1824, 1833, 1837], "_": [284, 377, 392, 1730, 1733, 1740, 1741, 1753, 1759, 1763, 1776, 1788, 1798, 1801, 1829, 1836, 1837, 1838, 1841], "_1": [1742, 1837], "_2": [1742, 1764, 1768, 1828, 1837], "_220_lattice_spacing_of_silicon": 1706, "_3": [1714, 1742, 1842], "__": [376, 397, 1828], "__file__": [2, 1738], "__getattr__": 315, "__init__": [1738, 1786, 1808], "__setattr__": 316, "__version__": [1738, 1786, 1788], "__version_branch_nam": 1786, "__version_cmak": 1786, "__version_is_clean": 1786, "__version_last_releas": 1786, "__version_long": [1786, 1788], "__version_prereleas": 1786, "__version_releas": 1786, "__version_upcoming_annotated_v_tag": [1786, 1788], "_a": 1837, "_b": 1837, "_c": 1757, "_contents_": 1794, "_dir": [1738, 1785], "_exit": 1785, "_function": [267, 1757, 1759], "_g_converg": [1226, 1324, 1704, 1802], "_get_default_xtpl": 1740, "_i": [1776, 1829], "_j": [1776, 1829], "_l": [295, 1683, 1739, 1742, 1766, 1776, 1781, 1792, 1793, 1798], "_n": [0, 1742], "_nprocessors_onln": [1738, 1748], "_optional_": 1748, "_psi4_true_raise_handl": 2, "_py_falsestruct": [1736, 1767], "_qcvar_reshape_get": 367, "_std": 1740, "_to_arrai": 1797, "_x": 1757, "_xtpl_": 1740, "a0": [76, 106, 267, 386, 388, 389, 399, 1759, 1772, 1774, 1776, 1802, 1817, 1838], "a1": [68, 300, 301, 302, 384, 993, 1215, 1704, 1714, 1746, 1750, 1772, 1802, 1828, 1842, 1844], "a1133": [1734, 1757], "a1138": 1734, "a1vib": 384, "a2": [68, 993, 1215, 1704, 1746, 1795, 1802], "a24": [1711, 1743, 1832], "aT": [1739, 1742, 1781, 1798], "a_": [0, 13, 1763, 1798, 1837], "a_1": [300, 301, 302, 829, 1210, 1704, 1714, 1759, 1772, 1833, 1842], "a_2": [829, 1210, 1704, 1759, 1833], "a_g": 1833, "a_i": [829, 1210, 1704], "a_point": 1810, "a_q": 13, "a_ras3_max": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "a_u": 1833, "aa": [13, 1228, 1383, 1704, 1706, 1708, 1734, 1749, 1755], "aaa": [1669, 1776], "aab": [1669, 1776], "aaqz": 1733, "ab": [1, 13, 259, 433, 466, 507, 514, 568, 575, 641, 708, 1047, 1199, 1200, 1201, 1202, 1206, 1218, 1225, 1242, 1679, 1704, 1708, 1714, 1734, 1742, 1753, 1755, 1756, 1759, 1763, 1770, 1771, 1776, 1777, 1781, 1786, 1790, 1802, 1829, 1838, 1842], "abb": [1669, 1776], "abbott": 1734, "abbr_acc": 1786, "abbrev": 1786, "abbrevi": [701, 1206, 1704, 1738, 1743], "abc": [259, 324, 329, 1679, 1714, 1755, 1759, 1770, 1776, 1827, 1842], "abc2": [1714, 1770, 1842], "abcd": [0, 1, 2, 627, 1206, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "abcdtyp": [568, 1206, 1704], "abelian": [106, 387, 573, 619, 696, 1206, 1704, 1781, 1833, 1838], "abil": [342, 1750, 1772, 1832, 1837], "abl": [1757, 1782, 1792, 1809, 1817, 1828, 1837, 1844], "abnorm": 1798, "abort": [656, 1206, 1704], "about": [0, 2, 81, 112, 115, 120, 139, 150, 1099, 1156, 1220, 1221, 1704, 1730, 1738, 1743, 1750, 1753, 1754, 1757, 1759, 1764, 1767, 1772, 1775, 1782, 1786, 1788, 1801, 1802, 1803, 1809, 1816, 1824, 1828, 1833, 1835, 1838, 1844], "abov": [0, 2, 267, 277, 279, 284, 454, 496, 551, 592, 601, 609, 629, 660, 704, 1101, 1199, 1200, 1203, 1206, 1220, 1230, 1231, 1462, 1562, 1704, 1730, 1738, 1740, 1742, 1743, 1748, 1750, 1752, 1753, 1755, 1757, 1759, 1760, 1767, 1768, 1770, 1772, 1775, 1779, 1781, 1782, 1788, 1794, 1797, 1799, 1801, 1802, 1808, 1809, 1810, 1817, 1828, 1829, 1832, 1833, 1834, 1837, 1838, 1840, 1841, 1844], "abram": 1781, "absenc": [1714, 1743, 1842], "absent": [79, 106, 1781, 1804], "absmax": 100, "absolut": [2, 100, 285, 287, 336, 338, 374, 383, 395, 415, 496, 582, 656, 683, 740, 823, 824, 825, 827, 829, 905, 1053, 1198, 1200, 1206, 1208, 1210, 1212, 1218, 1224, 1226, 1230, 1231, 1234, 1366, 1455, 1497, 1549, 1559, 1569, 1579, 1581, 1704, 1714, 1742, 1743, 1752, 1757, 1767, 1776, 1810, 1817, 1837, 1838, 1842, 1843], "absorb": [1764, 1808], "absorpt": [369, 377, 1781, 1790], "abspath": 1828, "abstract": [324, 329, 1768, 1817], "absurdli": 1757, "ac": [295, 318, 319, 1679, 1695, 1698, 1700, 1702, 1703, 1708, 1734, 1758, 1759, 1763, 1766, 1776, 1781, 1800, 1802], "academ": [1734, 1781], "acc": [1734, 1740, 1781], "accc": 1833, "acceler": [438, 515, 538, 584, 686, 687, 688, 699, 760, 762, 812, 833, 1173, 1175, 1199, 1202, 1203, 1206, 1209, 1210, 1222, 1229, 1231, 1430, 1485, 1546, 1557, 1615, 1616, 1617, 1704, 1706, 1734, 1735, 1738, 1753, 1754, 1789, 1824, 1838], "accept": [402, 454, 539, 550, 551, 696, 830, 1197, 1199, 1203, 1206, 1210, 1704, 1737, 1738, 1742, 1748, 1785, 1822], "access": [0, 70, 300, 301, 302, 318, 319, 620, 641, 1130, 1206, 1221, 1704, 1714, 1715, 1726, 1737, 1738, 1739, 1740, 1743, 1748, 1751, 1752, 1757, 1767, 1775, 1779, 1781, 1782, 1786, 1788, 1794, 1795, 1797, 1800, 1801, 1808, 1809, 1823, 1824, 1828, 1832, 1833, 1834, 1837, 1838, 1841, 1842, 1844], "accessor": [100, 148, 1738, 1797], "accident": 1786, "accommod": 1767, "accomod": 1817, "accompani": 1743, "accomplish": [1713, 1747, 1767, 1808, 1823, 1824, 1837, 1838], "accord": [8, 106, 296, 300, 301, 302, 586, 664, 691, 1206, 1704, 1730, 1737, 1738, 1740, 1743, 1747, 1750, 1757, 1763, 1769, 1770, 1772, 1781, 1794, 1798, 1802, 1810, 1833, 1835, 1837, 1838, 1840], "accordingli": [342, 356, 377, 1788, 1833, 1837, 1838], "account": [0, 1228, 1232, 1382, 1666, 1704, 1714, 1726, 1737, 1742, 1749, 1753, 1762, 1809, 1817, 1837, 1838, 1842, 1843], "accumul": [1231, 1568, 1704], "accumulate_product": 100, "accur": [295, 318, 319, 666, 1206, 1695, 1698, 1699, 1703, 1704, 1742, 1753, 1754, 1755, 1756, 1757, 1758, 1766, 1770, 1781, 1800, 1829, 1837, 1838], "accuraci": [2, 285, 287, 336, 338, 1714, 1734, 1753, 1754, 1756, 1757, 1763, 1771, 1781, 1796, 1798, 1806, 1837, 1838, 1842], "acen": 1781, "aces2": 1743, "acetylen": [1714, 1828, 1842, 1844], "achiev": [930, 949, 958, 1213, 1225, 1266, 1290, 1704, 1730, 1735, 1743, 1749, 1753, 1757, 1763, 1770, 1798, 1802, 1803, 1833, 1838], "acid": [460, 1199, 1692, 1704, 1711, 1714, 1752, 1833, 1837, 1842], "acml": 1738, "acpf": [284, 295, 1078, 1106, 1219, 1221, 1680, 1704, 1714, 1739, 1740, 1766, 1771, 1776, 1781, 1842], "across": [329, 1231, 1606, 1704, 1738, 1755, 1757, 1763, 1770, 1785, 1828, 1838, 1844], "act": [13, 1714, 1786, 1796, 1835, 1842], "acta": 1734, "action": [639, 1206, 1704, 1706, 1788], "activ": [0, 1, 2, 13, 76, 79, 86, 92, 106, 150, 191, 214, 215, 243, 260, 268, 284, 295, 335, 378, 454, 539, 551, 569, 587, 592, 654, 662, 676, 705, 795, 888, 989, 994, 1000, 1171, 1199, 1203, 1206, 1210, 1215, 1222, 1228, 1231, 1378, 1500, 1673, 1704, 1714, 1722, 1729, 1730, 1733, 1734, 1735, 1737, 1738, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "activate_all_frag": 106, "active_nat_orb": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "active_occ": 150, "active_vir": 150, "actual": [2, 8, 359, 570, 572, 1206, 1704, 1714, 1726, 1730, 1735, 1736, 1740, 1743, 1747, 1767, 1779, 1786, 1794, 1801, 1810, 1832, 1833, 1837, 1838, 1842, 1844], "actv": 1835, "ad": [8, 106, 150, 291, 296, 303, 314, 329, 341, 496, 589, 671, 751, 1200, 1206, 1208, 1225, 1296, 1704, 1730, 1738, 1742, 1747, 1748, 1750, 1755, 1757, 1760, 1763, 1764, 1767, 1769, 1775, 1777, 1779, 1781, 1787, 1788, 1790, 1791, 1798, 1802, 1804, 1808, 1814, 1815, 1817, 1823, 1828, 1832, 1833, 1836, 1837, 1838, 1839, 1840, 1844], "adapt": [16, 237, 295, 617, 619, 662, 707, 1110, 1206, 1221, 1230, 1689, 1704, 1734, 1743, 1748, 1754, 1755, 1766, 1776, 1777, 1790, 1806, 1810, 1828, 1833, 1838, 1844], "adc": [1, 295, 381, 382, 400, 408, 1704, 1705, 1709, 1734, 1738, 1766, 1776, 1777, 1790, 1826], "adcc": [295, 401, 404, 406, 407, 408, 1197, 1704, 1738, 1748, 1766, 1777, 1780, 1781, 1790], "adcc_stat": 0, "add": [2, 5, 73, 84, 88, 100, 106, 111, 114, 138, 148, 183, 184, 275, 284, 293, 321, 835, 1210, 1226, 1298, 1299, 1704, 1730, 1736, 1737, 1740, 1747, 1748, 1750, 1752, 1755, 1760, 1764, 1767, 1768, 1772, 1777, 1781, 1786, 1787, 1788, 1794, 1800, 1801, 1802, 1804, 1808, 1809, 1814, 1815, 1817, 1819, 1832, 1833, 1834, 1837, 1838], "add_": 1801, "add_and_orthogonalize_row": 100, "add_arrai": 114, "add_atom": 106, "add_auxiliary_bond": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "add_bool": [114, 1801], "add_c_funct": 138, "add_doubl": 1801, "add_execut": 1738, "add_int": [114, 1801], "add_opt": 327, "add_regression_test": 2, "add_spac": 27, "add_str": [114, 1801], "add_str_i": [114, 1170, 1221, 1704, 1772, 1791, 1801], "add_transform": 27, "add_x_funct": 138, "addbasi": 73, "addcharg": [73, 1838], "addchargeangstrom": 275, "addchargebohr": 275, "adddiffus": 275, "addfin": 1788, "addit": [0, 1, 2, 150, 266, 279, 297, 303, 308, 312, 314, 318, 319, 329, 347, 378, 608, 610, 667, 669, 671, 704, 794, 823, 890, 1125, 1206, 1210, 1221, 1230, 1435, 1436, 1704, 1730, 1733, 1738, 1740, 1742, 1743, 1746, 1748, 1749, 1750, 1753, 1754, 1755, 1757, 1759, 1762, 1763, 1765, 1767, 1771, 1773, 1775, 1780, 1781, 1782, 1783, 1784, 1788, 1790, 1791, 1797, 1799, 1800, 1801, 1803, 1805, 1808, 1809, 1828, 1829, 1833, 1837, 1838, 1844], "addition": [0, 106, 295, 300, 301, 302, 318, 319, 693, 1206, 1225, 1279, 1704, 1738, 1740, 1743, 1748, 1750, 1754, 1757, 1766, 1768, 1772, 1794, 1798, 1799, 1800, 1828, 1832, 1837, 1838, 1843], "additional_info": 266, "additionalproperti": [265, 1740, 1772, 1794], "addl": 1730, "addon": [2, 1724, 1738, 1748, 1785, 1788], "addon_nam": 1785, "addonconfig": 1738, "address": [0, 268, 620, 1206, 1704, 1714, 1823, 1831, 1842], "adenin": [1692, 1752, 1837], "adiabat": [655, 1206, 1704, 1757], "adii": [1231, 1550, 1615, 1704, 1714, 1838, 1842], "adjac": [106, 1692, 1740, 1752, 1768, 1838], "adjoint": [698, 1206, 1704, 1754], "adjust": [368, 369, 432, 635, 652, 1199, 1206, 1704, 1738, 1742, 1748, 1757, 1759, 1774, 1788, 1833, 1837, 1838], "admin": 1788, "administr": [1738, 1748, 1767, 1786], "admittedli": 1834, "adopt": 1757, "adv": 1781, "advanc": [608, 761, 774, 1097, 1206, 1209, 1220, 1229, 1688, 1704, 1714, 1734, 1738, 1754, 1755, 1759, 1775, 1781, 1782, 1790, 1810, 1832, 1838, 1842], "advantag": [2, 335, 356, 573, 647, 692, 1206, 1704, 1730, 1743, 1747, 1753, 1786, 1789, 1798, 1824, 1828, 1838, 1841], "adventur": 1803, "advertis": [2, 1785], "advic": [1738, 1757, 1810, 1838], "advis": [150, 660, 1206, 1230, 1480, 1704, 1748, 1755, 1757, 1788, 1832, 1837, 1838], "advisor": [1738, 1748, 1788], "advoc": 1757, "adz": 1733, "ae": [1761, 1809], "aedii": [1714, 1842], "aettig": 1734, "affect": [8, 661, 1206, 1224, 1240, 1704, 1736, 1740, 1753, 1756, 1763, 1767, 1770, 1817, 1837, 1844], "affin": [895, 1211, 1225, 1258, 1261, 1704, 1757, 1781, 1805], "affirm": [1795, 1796], "afford": [1742, 1824], "afirst": 106, "aforement": 1802, "after": [0, 2, 63, 84, 86, 87, 106, 138, 279, 295, 300, 301, 302, 318, 319, 384, 471, 559, 570, 605, 614, 640, 701, 838, 986, 989, 999, 1188, 1189, 1190, 1191, 1200, 1204, 1206, 1210, 1215, 1222, 1226, 1229, 1231, 1361, 1426, 1498, 1619, 1649, 1692, 1704, 1711, 1714, 1730, 1735, 1736, 1743, 1746, 1747, 1750, 1752, 1753, 1757, 1759, 1766, 1767, 1770, 1771, 1772, 1774, 1775, 1781, 1785, 1788, 1792, 1799, 1800, 1801, 1808, 1810, 1817, 1828, 1832, 1837, 1838, 1842, 1843, 1844], "ag": [993, 1215, 1704, 1707, 1731, 1746, 1834], "again": [283, 333, 1738, 1756, 1767, 1770, 1785, 1794, 1801, 1809, 1828, 1837, 1838, 1844], "against": [2, 100, 285, 286, 287, 336, 337, 338, 383, 392, 1714, 1718, 1722, 1726, 1738, 1746, 1748, 1757, 1762, 1765, 1767, 1773, 1775, 1782, 1783, 1784, 1785, 1801, 1808, 1824, 1832, 1839, 1842], "aggreg": 1740, "aggress": [1743, 1757, 1838], "agre": [1748, 1804], "agreement": [1735, 1743, 1804, 1828, 1844], "ah": [843, 856, 857, 1210, 1704, 1789], "ahcc1": 1833, "ahcc2": 1833, "ahcc3": 1833, "ahead": [1738, 1788], "ahlrich": [1707, 1731, 1734], "ahoh": 1832, "ahold": 1738, "ai": 1841, "aid": [296, 928, 1184, 1213, 1222, 1704, 1769, 1786, 1817], "aida": 1734, "aim": [2, 1770, 1799, 1828], "aimqc": [1734, 1802], "aindex": 98, "aio_cphf": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "aio_df_int": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "aj": 1706, "ak": 1708, "aka": [1714, 1777, 1781, 1834, 1842], "akin": [2, 1776, 1788], "al": [1, 786, 885, 1126, 1210, 1221, 1225, 1271, 1692, 1704, 1707, 1714, 1731, 1734, 1752, 1754, 1763, 1802, 1805, 1806, 1837, 1841, 1842], "alanin": [1714, 1833, 1842], "alast": 106, "alejandro": 1734, "alenaizan": [1734, 1781], "alert": 1817, "alexand": [1753, 1802, 1829], "algebra": [0, 1, 295, 381, 382, 1197, 1668, 1738, 1766, 1777, 1812, 1824, 1826], "algerror": 1802, "algo": [1231, 1576, 1704], "algorithm": [0, 1, 2, 106, 268, 342, 356, 411, 428, 430, 465, 473, 491, 496, 499, 500, 510, 512, 513, 535, 557, 568, 570, 575, 609, 615, 623, 627, 641, 647, 655, 727, 732, 739, 742, 746, 750, 843, 876, 935, 944, 946, 947, 961, 964, 1049, 1095, 1106, 1107, 1146, 1147, 1166, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1206, 1213, 1214, 1218, 1219, 1221, 1225, 1227, 1229, 1230, 1279, 1281, 1282, 1296, 1375, 1429, 1443, 1497, 1505, 1552, 1572, 1620, 1704, 1714, 1727, 1730, 1733, 1735, 1740, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1754, 1755, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1790, 1791, 1792, 1794, 1795, 1797, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1839, 1840, 1841, 1842, 1843, 1844], "alia": [2, 80, 106, 267, 1714, 1733, 1740, 1751, 1757, 1759, 1768, 1772, 1777, 1788, 1842], "alias": [284, 300, 301, 302, 318, 319, 381, 382, 1752, 1759, 1772, 1788, 1800, 1826, 1831, 1834, 1844], "align": [106, 1714, 1743, 1750, 1776, 1833, 1838, 1842], "alignmentmil": 106, "alik": [1759, 1781, 1838], "alkali": [1714, 1837, 1842], "alkan": [1692, 1752, 1763], "alken": [1692, 1752], "all": [0, 2, 5, 8, 11, 13, 21, 64, 73, 86, 87, 96, 98, 100, 105, 106, 111, 112, 114, 138, 148, 150, 152, 171, 183, 184, 195, 196, 208, 224, 227, 230, 235, 239, 246, 255, 263, 265, 267, 268, 277, 284, 291, 295, 296, 300, 301, 302, 314, 317, 318, 319, 326, 330, 331, 341, 342, 346, 352, 356, 359, 365, 370, 383, 384, 388, 400, 418, 433, 454, 466, 476, 507, 514, 526, 551, 568, 570, 574, 575, 581, 582, 586, 608, 609, 615, 616, 625, 626, 627, 641, 646, 657, 665, 703, 795, 811, 828, 852, 874, 921, 922, 1097, 1101, 1108, 1111, 1145, 1198, 1199, 1200, 1201, 1202, 1203, 1206, 1210, 1213, 1220, 1221, 1224, 1225, 1226, 1228, 1229, 1230, 1231, 1235, 1236, 1242, 1279, 1315, 1316, 1317, 1333, 1341, 1355, 1379, 1380, 1411, 1426, 1441, 1454, 1455, 1459, 1460, 1461, 1464, 1465, 1466, 1591, 1641, 1704, 1708, 1711, 1714, 1715, 1722, 1727, 1730, 1735, 1738, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1753, 1754, 1755, 1756, 1757, 1759, 1762, 1763, 1764, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1775, 1777, 1779, 1781, 1782, 1785, 1786, 1788, 1789, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1802, 1803, 1808, 1809, 1810, 1812, 1817, 1823, 1828, 1829, 1832, 1833, 1834, 1835, 1837, 1838, 1840, 1841, 1842, 1844], "allclos": [2, 383], "allen": [1714, 1734, 1740, 1743, 1781, 1842], "allen_focal_point": 1740, "allnormco": 384, "alloc": [138, 305, 353, 374, 395, 714, 1207, 1231, 1618, 1624, 1704, 1810, 1821, 1838], "allof": [265, 1740, 1794], "allow": [2, 106, 265, 267, 284, 296, 595, 601, 621, 625, 633, 634, 648, 668, 671, 692, 699, 708, 709, 711, 712, 794, 819, 859, 860, 881, 890, 1206, 1210, 1226, 1229, 1230, 1231, 1302, 1312, 1426, 1444, 1602, 1620, 1704, 1714, 1738, 1740, 1743, 1749, 1754, 1755, 1756, 1757, 1759, 1768, 1769, 1770, 1771, 1772, 1779, 1781, 1782, 1783, 1785, 1788, 1794, 1798, 1802, 1803, 1804, 1805, 1808, 1810, 1817, 1824, 1828, 1829, 1831, 1832, 1833, 1835, 1837, 1838, 1842, 1844], "allterm": [1714, 1842], "allvib": 384, "alml": 1781, "almlof": [1734, 1802], "almost": [1786, 1802, 1810, 1821, 1824, 1838], "alogrithm": [745, 749, 1208, 1704], "alon": [2, 1231, 1615, 1704, 1730, 1767, 1785, 1833], "along": [0, 2, 265, 390, 603, 608, 1206, 1226, 1231, 1340, 1343, 1556, 1704, 1708, 1738, 1740, 1742, 1743, 1746, 1750, 1768, 1775, 1776, 1779, 1781, 1782, 1794, 1798, 1802, 1808, 1810, 1828, 1832, 1833, 1834, 1838, 1844], "alongsid": [2, 1738, 1746, 1748, 1749, 1759, 1762, 1765, 1773, 1774, 1775, 1782, 1783, 1784, 1803, 1806, 1807, 1808, 1832, 1838, 1839], "alp": 1759, "alpha": [0, 11, 13, 80, 84, 92, 98, 100, 138, 150, 284, 291, 314, 341, 400, 660, 664, 782, 789, 823, 824, 825, 827, 829, 1111, 1206, 1210, 1221, 1230, 1231, 1453, 1522, 1531, 1559, 1564, 1579, 1581, 1669, 1680, 1689, 1690, 1706, 1708, 1709, 1714, 1724, 1740, 1750, 1755, 1756, 1757, 1777, 1781, 1791, 1810, 1829, 1832, 1833, 1837, 1838, 1842], "alpha6": [68, 1759], "alpha_6": 1759, "alpha_corr_to_pitz": 90, "alpha_n": 1759, "alpha_orbital_spac": 150, "alpha_particle_electron_mass_ratio": 1706, "alpha_particle_mass": 1706, "alpha_particle_mass_energy_equival": 1706, "alpha_particle_mass_energy_equivalent_in_mev": 1706, "alpha_particle_mass_in_u": 1706, "alpha_particle_molar_mass": 1706, "alpha_particle_proton_mass_ratio": 1706, "alphabet": 1785, "alphamo": 1750, "alphast": [575, 1206, 1704], "alphastr": [827, 1210, 1704], "alreadi": [2, 61, 150, 225, 255, 1746, 1749, 1759, 1762, 1765, 1767, 1770, 1773, 1774, 1775, 1782, 1783, 1784, 1788, 1803, 1806, 1807, 1809, 1815, 1824, 1828, 1834, 1837, 1839, 1841, 1844], "also": [0, 2, 106, 150, 263, 267, 279, 284, 297, 335, 347, 359, 386, 392, 470, 574, 609, 662, 664, 665, 811, 823, 833, 993, 1168, 1200, 1206, 1210, 1215, 1221, 1226, 1230, 1231, 1324, 1451, 1463, 1626, 1629, 1634, 1658, 1704, 1708, 1710, 1714, 1726, 1730, 1735, 1738, 1739, 1740, 1741, 1742, 1743, 1746, 1748, 1749, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1762, 1763, 1765, 1767, 1770, 1771, 1773, 1774, 1775, 1776, 1779, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1795, 1798, 1801, 1802, 1803, 1807, 1808, 1809, 1810, 1817, 1821, 1823, 1824, 1828, 1832, 1833, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1844], "alt": [1707, 1714, 1731, 1842], "altair": 1841, "alter": [327, 671, 1206, 1704, 1754, 1786], "altern": [0, 106, 299, 318, 319, 349, 625, 627, 670, 1206, 1704, 1738, 1742, 1748, 1755, 1756, 1757, 1763, 1767, 1771, 1777, 1785, 1789, 1790, 1799, 1800, 1802, 1804, 1832, 1833, 1835, 1836, 1837, 1838, 1839], "although": [647, 1206, 1704, 1743, 1782, 1798, 1802, 1810, 1817, 1824, 1828, 1833, 1838, 1844], "altogeth": [1770, 1802, 1838], "alwai": [2, 13, 259, 267, 284, 443, 479, 519, 543, 586, 592, 596, 603, 620, 650, 705, 1199, 1200, 1202, 1203, 1206, 1704, 1730, 1738, 1740, 1743, 1748, 1756, 1767, 1779, 1782, 1786, 1788, 1794, 1797, 1799, 1801, 1802, 1809, 1810, 1821, 1824, 1837, 1838, 1840], "am": [18, 81, 310, 361, 1714, 1734, 1738, 1783, 1788, 1817, 1839, 1842], "am7": 1738, "am8": 1738, "amaz": 1786, "amazonaw": 1735, "ambigu": [296, 1730, 1757, 1769, 1770], "ambit": 1738, "ambiti": 1831, "amchar": 81, "amelior": 1838, "amen": 1838, "american": 1734, "ammet": [1734, 1838], "ammonia": [1714, 1722, 1842], "among": [11, 106, 299, 349, 1231, 1232, 1655, 1666, 1704, 1714, 1737, 1738, 1740, 1757, 1770, 1785, 1789, 1794, 1795, 1809, 1829, 1832, 1841, 1842, 1843], "amount": [8, 106, 138, 198, 342, 356, 412, 568, 608, 644, 650, 651, 667, 716, 720, 729, 882, 1021, 1034, 1118, 1153, 1198, 1206, 1207, 1208, 1210, 1216, 1218, 1221, 1229, 1230, 1231, 1405, 1463, 1499, 1608, 1704, 1742, 1750, 1757, 1759, 1763, 1767, 1774, 1801, 1817, 1832, 1837, 1838, 1844], "amp": [11, 1726, 1785], "amplitud": [0, 1, 2, 11, 75, 401, 429, 432, 433, 448, 452, 455, 457, 466, 481, 487, 507, 509, 514, 520, 525, 529, 530, 536, 544, 548, 549, 554, 575, 582, 585, 659, 699, 700, 792, 793, 794, 799, 868, 911, 912, 913, 914, 935, 953, 966, 1086, 1197, 1199, 1200, 1201, 1202, 1203, 1206, 1210, 1213, 1214, 1219, 1225, 1229, 1230, 1242, 1243, 1287, 1405, 1416, 1419, 1424, 1434, 1440, 1459, 1461, 1704, 1708, 1714, 1721, 1726, 1742, 1756, 1763, 1771, 1785, 1798, 1837, 1842], "ampltud": [972, 1214, 1704], "amu": [618, 1206, 1226, 1348, 1704], "amu2g": 1706, "amu2kg": 1706, "an": [0, 2, 5, 8, 11, 13, 20, 74, 84, 89, 90, 91, 92, 100, 103, 106, 110, 115, 130, 132, 139, 148, 150, 216, 235, 236, 255, 262, 263, 266, 279, 284, 285, 310, 312, 314, 318, 319, 321, 329, 336, 342, 356, 361, 367, 374, 376, 395, 397, 568, 569, 574, 575, 577, 593, 608, 609, 614, 622, 625, 637, 642, 656, 660, 669, 670, 671, 672, 676, 679, 690, 694, 696, 704, 709, 711, 712, 731, 765, 774, 819, 828, 855, 863, 874, 1002, 1006, 1007, 1038, 1065, 1099, 1100, 1102, 1123, 1125, 1126, 1127, 1128, 1159, 1160, 1161, 1162, 1164, 1165, 1168, 1206, 1208, 1209, 1210, 1215, 1218, 1219, 1220, 1221, 1225, 1226, 1229, 1230, 1231, 1245, 1246, 1247, 1253, 1254, 1255, 1265, 1272, 1273, 1274, 1275, 1296, 1340, 1343, 1356, 1421, 1422, 1435, 1436, 1508, 1516, 1553, 1583, 1586, 1606, 1619, 1655, 1704, 1708, 1714, 1722, 1726, 1730, 1733, 1734, 1736, 1737, 1738, 1740, 1741, 1742, 1743, 1746, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1761, 1762, 1763, 1764, 1765, 1767, 1770, 1771, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1781, 1782, 1783, 1784, 1787, 1788, 1789, 1791, 1792, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1808, 1809, 1810, 1814, 1816, 1817, 1821, 1824, 1825, 1828, 1829, 1831, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843], "ana": [1736, 1738, 1767], "anaconda": [1736, 1737, 1746, 1748, 1749, 1759, 1762, 1764, 1765, 1767, 1773, 1774, 1775, 1782, 1783, 1784, 1788, 1803, 1806, 1807, 1839], "analog": [356, 525, 549, 868, 1202, 1203, 1210, 1226, 1231, 1357, 1358, 1359, 1360, 1506, 1604, 1605, 1704, 1714, 1738, 1739, 1743, 1748, 1753, 1755, 1809, 1832, 1842], "analogi": 1788, "analogu": 1838, "analys": [303, 1217, 1226, 1770, 1775, 1837, 1843], "analysi": [0, 76, 84, 150, 259, 267, 303, 307, 318, 319, 384, 386, 388, 389, 390, 399, 616, 640, 707, 753, 1038, 1040, 1206, 1208, 1218, 1220, 1230, 1231, 1232, 1638, 1639, 1640, 1641, 1642, 1649, 1665, 1666, 1667, 1681, 1689, 1704, 1714, 1719, 1735, 1738, 1740, 1759, 1776, 1777, 1778, 1780, 1781, 1788, 1790, 1794, 1800, 1806, 1822, 1831, 1837, 1840, 1842], "analyt": [265, 267, 300, 301, 302, 306, 307, 318, 319, 571, 596, 608, 610, 615, 665, 679, 707, 750, 1206, 1208, 1217, 1704, 1714, 1718, 1740, 1743, 1748, 1754, 1768, 1772, 1790, 1794, 1796, 1800, 1803, 1809, 1838, 1842], "analytic1": [1714, 1842], "analytic2": [1714, 1842], "analyz": [0, 1, 2, 399, 574, 1206, 1230, 1689, 1704, 1714, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1828, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "anchor": [292, 343, 373, 391], "andez": 1734, "andi": 1768, "andr": 1734, "andrew": [1753, 1761, 1765, 1769, 1775, 1782, 1792, 1799, 1803, 1829, 1838, 1841], "andysim": 386, "anew": 1747, "ang": [781, 1209, 1704, 1754, 1802, 1828, 1833, 1844], "angl": [100, 106, 855, 1188, 1210, 1222, 1226, 1228, 1307, 1309, 1311, 1315, 1318, 1320, 1322, 1357, 1358, 1360, 1396, 1704, 1706, 1714, 1742, 1750, 1759, 1782, 1789, 1802, 1828, 1832, 1833, 1838, 1842, 1844], "angstrom": [83, 106, 275, 705, 1099, 1100, 1206, 1220, 1704, 1706, 1743, 1761, 1768, 1775, 1782, 1802, 1803, 1828, 1833, 1835, 1837, 1844], "angstrom_star": 1706, "angstr\u00f6m": 1754, "angular": [2, 4, 8, 81, 89, 103, 285, 310, 336, 361, 377, 1157, 1221, 1704, 1710, 1714, 1730, 1733, 1736, 1754, 1767, 1783, 1810, 1817, 1842], "angularmomentumint": [1817, 1827], "anharmon": [571, 572, 574, 604, 1206, 1704, 1761, 1831], "ani": [0, 1, 2, 8, 84, 100, 106, 148, 150, 265, 266, 267, 277, 279, 284, 298, 308, 312, 314, 318, 319, 329, 342, 344, 348, 355, 358, 359, 371, 375, 376, 378, 394, 396, 397, 403, 599, 608, 664, 671, 795, 859, 860, 1070, 1088, 1124, 1126, 1197, 1199, 1206, 1210, 1219, 1221, 1226, 1230, 1324, 1464, 1465, 1466, 1669, 1704, 1714, 1730, 1735, 1738, 1740, 1743, 1748, 1751, 1752, 1755, 1757, 1759, 1760, 1761, 1763, 1764, 1767, 1770, 1771, 1772, 1776, 1781, 1782, 1785, 1786, 1788, 1791, 1792, 1794, 1798, 1799, 1800, 1801, 1802, 1808, 1809, 1817, 1823, 1824, 1828, 1832, 1833, 1835, 1837, 1838, 1840, 1842, 1843, 1844], "anilin": 1833, "anilino": 1833, "anim": [1828, 1844], "anion": [1714, 1730, 1733, 1757, 1768, 1838, 1842], "anion_mult": 1768, "annoi": [1738, 1764], "annot": [106, 139, 150, 1787, 1814], "announc": [1788, 1804], "annual": [1734, 1748, 1787, 1814, 1825], "ano": [1707, 1731, 1836], "ano0": [1707, 1731], "anom": 1788, "anomali": 1706, "anonym": [1228, 1393, 1704, 1749], "anoth": [2, 88, 100, 148, 150, 327, 671, 1206, 1704, 1730, 1738, 1748, 1755, 1757, 1763, 1767, 1770, 1774, 1785, 1789, 1798, 1801, 1802, 1804, 1810, 1832, 1833, 1836, 1837, 1838], "ansatz": [119, 138, 653, 1206, 1229, 1398, 1704, 1754, 1756, 1757, 1776, 1829, 1838], "answer": [2, 1714, 1781, 1801, 1816, 1829, 1837, 1842], "anthoni": [1220, 1681, 1775], "anthracen": [1692, 1752], "anti": [575, 1206, 1704], "antialia": 323, "antialias_threshold": 323, "anticip": [318, 319, 1781, 1787, 1800], "antisymmetr": [1753, 1756, 1776, 1837, 1838], "antoni": 1734, "anyof": [265, 1740, 1794], "anyon": [1786, 1804], "anyth": [644, 1206, 1704, 1737, 1743, 1781, 1809, 1833, 1835, 1838], "anytim": 1757, "anywai": [284, 662, 1206, 1704, 1740, 1821], "anywher": [1809, 1833], "ao": [8, 75, 89, 103, 115, 118, 147, 150, 314, 430, 568, 575, 577, 623, 657, 682, 727, 845, 858, 998, 1199, 1206, 1208, 1210, 1215, 1704, 1708, 1711, 1714, 1743, 1746, 1753, 1763, 1767, 1785, 1789, 1791, 1808, 1809, 1812, 1814, 1821, 1838, 1842], "ao_3center_deriv1": 103, "ao_3coverlap": 103, "ao_angular_momentum": [89, 103], "ao_basi": [0, 1, 2, 1704, 1714, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "ao_dipol": [89, 103], "ao_dkh": 103, "ao_efp_multipole_potenti": 103, "ao_elec_dip_deriv1": 103, "ao_erf_eri": 103, "ao_eri": 103, "ao_eri_shel": 103, "ao_f12": 103, "ao_f12_double_commut": 103, "ao_f12_squar": 103, "ao_f12g12": 103, "ao_kinet": [89, 103], "ao_metric_deriv1": 103, "ao_multipol": [89, 103], "ao_multipole_potenti": [89, 103], "ao_nabla": [89, 103], "ao_oei_deriv1": 103, "ao_oei_deriv2": 103, "ao_overlap": [89, 103], "ao_overlap_half_deriv1": 103, "ao_potenti": [89, 103], "ao_potential_erf": 103, "ao_potential_erf_compl": 103, "ao_pvp": 103, "ao_quadrupol": [89, 103], "ao_tei_deriv1": 103, "ao_tei_deriv2": 103, "ao_to_shel": 8, "ao_traceless_quadrupol": [89, 103], "aobasi": [444, 482, 568, 1199, 1200, 1206, 1704, 1711, 1743], "aointegr": 1808, "aorb": 98, "aoshellcombinationsiter": [89, 1827], "aotoso": [118, 150], "apart": [0, 574, 665, 1206, 1704], "apbw": [1229, 1398, 1704], "apdx": 1764, "apecifi": 1711, "api": [2, 106, 329, 1710, 1714, 1726, 1759, 1777, 1788, 1828, 1831, 1832, 1842], "app": [300, 301, 302, 719, 1207, 1704, 1748, 1772, 1788, 1808], "appar": 1801, "appeal": 1838, "appear": [2, 5, 1730, 1738, 1742, 1743, 1756, 1764, 1770, 1776, 1788, 1798, 1799, 1832, 1833, 1837, 1841], "append": [2, 5, 8, 73, 100, 111, 252, 284, 388, 1226, 1304, 1324, 1704, 1730, 1738, 1740, 1741, 1743, 1752, 1757, 1759, 1767, 1768, 1776, 1785, 1801, 1802, 1832, 1833, 1835, 1837], "appendcharg": 73, "appendic": [1742, 1764, 1777, 1781], "appendix": [0, 1730, 1733, 1742, 1755, 1756, 1764, 1790, 1792, 1802, 1829, 1832, 1843], "appl": [1738, 1781], "appleclang": [1738, 1808], "appli": [0, 2, 100, 106, 148, 267, 283, 284, 295, 300, 301, 302, 318, 319, 329, 331, 333, 350, 381, 382, 387, 472, 481, 520, 544, 592, 605, 608, 628, 629, 630, 631, 687, 729, 738, 744, 759, 855, 919, 920, 1200, 1202, 1203, 1206, 1208, 1210, 1213, 1225, 1229, 1230, 1231, 1252, 1405, 1427, 1442, 1499, 1571, 1588, 1704, 1714, 1730, 1740, 1743, 1752, 1757, 1759, 1761, 1766, 1772, 1777, 1788, 1789, 1794, 1797, 1798, 1800, 1817, 1826, 1832, 1833, 1835, 1837, 1838, 1841, 1842], "applic": [2, 573, 679, 1206, 1704, 1734, 1737, 1743, 1753, 1759, 1767, 1768, 1770, 1774, 1781, 1833, 1838], "apply_denomin": 100, "apport": [1809, 1835], "apportion": 1795, "appreci": [1781, 1810, 1817], "approach": [0, 377, 430, 575, 584, 608, 613, 615, 623, 662, 677, 694, 874, 1101, 1199, 1206, 1210, 1220, 1231, 1532, 1704, 1734, 1742, 1747, 1754, 1755, 1756, 1757, 1761, 1763, 1775, 1781, 1789, 1802, 1803, 1805, 1819, 1824, 1828, 1829, 1833, 1836, 1837, 1838, 1841], "appropri": [0, 103, 284, 577, 599, 601, 708, 730, 823, 1125, 1206, 1208, 1210, 1221, 1704, 1730, 1733, 1738, 1740, 1743, 1755, 1757, 1762, 1767, 1769, 1771, 1775, 1781, 1785, 1788, 1794, 1798, 1815, 1817, 1823, 1824, 1828, 1833, 1837, 1838, 1844], "approv": [1736, 1767, 1786, 1804], "approx": 1763, "approx_diag": [926, 1213, 1704, 1798], "approx_diag_ekt": [926, 1213, 1704, 1798], "approx_diag_hf": [926, 1213, 1704, 1798], "approx_solv": 133, "approxim": [0, 295, 299, 318, 319, 329, 342, 349, 356, 381, 382, 470, 608, 635, 651, 652, 662, 679, 835, 874, 985, 1132, 1200, 1206, 1210, 1214, 1221, 1225, 1230, 1231, 1279, 1444, 1448, 1449, 1450, 1459, 1461, 1470, 1656, 1704, 1714, 1730, 1733, 1742, 1743, 1744, 1745, 1749, 1753, 1754, 1755, 1756, 1757, 1759, 1763, 1766, 1776, 1781, 1789, 1790, 1792, 1793, 1798, 1800, 1801, 1803, 1826, 1829, 1838, 1841, 1842], "apr": [1694, 1707, 1731, 1732, 1733], "april": [1738, 1770, 1786], "aqcc": [284, 295, 1078, 1219, 1680, 1704, 1739, 1740, 1766, 1771, 1776, 1781], "aqz": 1733, "ar": [0, 2, 11, 13, 84, 92, 106, 112, 115, 150, 247, 255, 262, 263, 265, 268, 269, 277, 284, 285, 287, 296, 300, 301, 302, 304, 314, 318, 319, 321, 329, 336, 338, 342, 346, 351, 352, 356, 370, 371, 376, 377, 381, 382, 383, 385, 388, 397, 399, 402, 415, 430, 440, 448, 454, 476, 490, 539, 550, 551, 568, 569, 572, 574, 575, 577, 579, 582, 586, 592, 593, 594, 596, 597, 599, 600, 601, 602, 603, 605, 608, 609, 610, 613, 614, 615, 616, 617, 621, 623, 625, 626, 635, 636, 637, 638, 639, 640, 641, 645, 650, 652, 656, 657, 660, 662, 664, 665, 671, 672, 674, 675, 677, 682, 684, 691, 692, 695, 696, 699, 700, 703, 704, 707, 708, 710, 726, 740, 746, 761, 774, 777, 794, 804, 811, 823, 828, 830, 833, 838, 852, 859, 860, 874, 883, 905, 935, 986, 989, 1041, 1053, 1078, 1079, 1086, 1100, 1108, 1111, 1124, 1125, 1127, 1128, 1156, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1206, 1208, 1209, 1210, 1212, 1213, 1215, 1217, 1218, 1219, 1220, 1221, 1223, 1224, 1226, 1228, 1230, 1231, 1234, 1235, 1241, 1313, 1331, 1332, 1339, 1341, 1352, 1362, 1379, 1380, 1381, 1441, 1443, 1445, 1455, 1462, 1463, 1464, 1465, 1466, 1490, 1520, 1521, 1563, 1569, 1591, 1602, 1612, 1658, 1690, 1692, 1704, 1707, 1708, 1710, 1711, 1714, 1726, 1730, 1731, 1733, 1735, 1736, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1763, 1764, 1767, 1768, 1769, 1770, 1771, 1772, 1774, 1775, 1776, 1779, 1781, 1782, 1785, 1786, 1788, 1789, 1790, 1791, 1792, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1808, 1809, 1810, 1813, 1815, 1817, 1821, 1822, 1823, 1824, 1826, 1828, 1829, 1832, 1833, 1834, 1835, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "arar": [1692, 1752], "araya": [1734, 1750], "arbitrari": [2, 89, 100, 107, 295, 317, 334, 365, 577, 1099, 1206, 1210, 1220, 1673, 1704, 1714, 1730, 1738, 1739, 1760, 1766, 1775, 1781, 1790, 1794, 1799, 1817, 1834, 1838, 1842], "arbitrarili": [1753, 1831, 1832], "arch": 1738, "architectur": [575, 1206, 1704, 1737, 1748, 1767, 1781, 1788, 1821, 1840], "archiv": [1781, 1788], "area": [318, 319, 1743, 1747, 1757, 1767, 1786, 1800, 1803, 1804, 1832], "aren": [367, 1738, 1764, 1780], "arg": [2, 5, 8, 13, 20, 27, 29, 64, 88, 90, 92, 96, 100, 101, 103, 106, 114, 119, 147, 148, 246, 248, 252, 317, 334, 346, 365, 381, 382, 1738, 1748, 1799], "arg0": [6, 7, 8, 12, 13, 14, 17, 18, 20, 22, 23, 24, 25, 26, 27, 29, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 64, 68, 70, 73, 75, 76, 78, 80, 81, 84, 85, 86, 88, 89, 90, 91, 92, 96, 97, 100, 101, 103, 105, 106, 108, 110, 111, 112, 114, 118, 119, 128, 130, 131, 133, 138, 139, 141, 143, 144, 145, 147, 148, 149, 150, 180, 183, 184, 215, 216, 217, 220, 222, 223, 225, 229, 232, 240, 252], "arg1": [8, 12, 13, 20, 22, 23, 24, 25, 27, 29, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 64, 75, 76, 80, 84, 85, 86, 92, 97, 100, 103, 105, 106, 112, 114, 119, 128, 131, 133, 138, 139, 141, 143, 144, 147, 149, 150, 183, 184, 216, 217, 222, 240], "arg10": [31, 32, 33, 34, 44, 48, 49, 52, 53, 54, 57, 59], "arg11": [31, 32, 33, 34, 44, 48, 52, 57, 59], "arg12": [31, 32, 33, 48, 52], "arg13": [31, 32, 33], "arg2": [8, 12, 13, 22, 23, 24, 25, 27, 29, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 75, 76, 80, 84, 85, 92, 97, 103, 106, 114, 128, 133, 138, 139, 141, 143, 144, 147, 149, 150, 240], "arg3": [12, 13, 22, 23, 24, 25, 27, 29, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 80, 84, 85, 92, 103, 128, 133, 138, 143, 144, 150, 240], "arg4": [12, 13, 23, 24, 25, 31, 32, 33, 34, 35, 36, 37, 38, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 133, 138, 240], "arg5": [12, 13, 23, 24, 25, 31, 32, 33, 34, 35, 36, 37, 38, 42, 43, 44, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 138], "arg6": [23, 31, 32, 33, 34, 35, 37, 38, 42, 43, 44, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 138], "arg7": [31, 32, 33, 34, 35, 38, 42, 43, 44, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60], "arg8": [31, 32, 33, 34, 35, 38, 44, 47, 48, 49, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60], "arg9": [31, 32, 33, 34, 35, 44, 48, 49, 51, 52, 53, 54, 55, 56, 57, 59], "argo": [643, 1206, 1704], "argon": [1692, 1714, 1752, 1842], "argument": [0, 2, 8, 100, 103, 115, 150, 284, 295, 300, 301, 302, 312, 314, 318, 319, 329, 378, 381, 382, 581, 586, 662, 696, 1206, 1704, 1738, 1740, 1742, 1743, 1748, 1750, 1752, 1757, 1766, 1767, 1768, 1772, 1775, 1779, 1785, 1788, 1791, 1794, 1795, 1796, 1799, 1800, 1801, 1802, 1809, 1810, 1817, 1822, 1826, 1828, 1832, 1838, 1840], "aris": [1743, 1759, 1782, 1798, 1802, 1837], "arkr": [1692, 1752], "arm": 1802, "arm64": 1788, "arn": 1752, "aromat": 1770, "around": [84, 106, 247, 729, 1208, 1229, 1231, 1405, 1499, 1704, 1714, 1743, 1748, 1754, 1757, 1764, 1786, 1788, 1797, 1810, 1825, 1828, 1832, 1838, 1842, 1844], "arr": [100, 148, 331, 1797], "arrai": [0, 1, 2, 92, 98, 100, 106, 114, 147, 148, 150, 176, 212, 246, 248, 255, 262, 263, 275, 284, 300, 301, 302, 306, 307, 310, 321, 331, 334, 361, 367, 377, 387, 410, 422, 495, 531, 550, 569, 593, 601, 609, 616, 660, 670, 671, 715, 771, 783, 784, 794, 819, 824, 825, 827, 829, 855, 897, 1005, 1006, 1007, 1008, 1009, 1032, 1033, 1050, 1057, 1065, 1099, 1100, 1102, 1108, 1111, 1112, 1115, 1116, 1123, 1126, 1127, 1128, 1155, 1156, 1159, 1160, 1161, 1162, 1164, 1165, 1168, 1177, 1192, 1197, 1198, 1200, 1202, 1203, 1206, 1207, 1209, 1210, 1211, 1215, 1218, 1219, 1220, 1221, 1222, 1226, 1231, 1314, 1521, 1551, 1559, 1562, 1579, 1581, 1582, 1586, 1595, 1619, 1642, 1655, 1657, 1669, 1680, 1685, 1690, 1704, 1714, 1740, 1742, 1743, 1746, 1750, 1752, 1754, 1755, 1761, 1772, 1775, 1776, 1780, 1785, 1788, 1789, 1794, 1799, 1800, 1801, 1810, 1817, 1829, 1832, 1833, 1835, 1837, 1838, 1840, 1841, 1842, 1844], "arrang": [1124, 1221, 1704, 1730, 1733, 1785, 1802, 1835], "array_equ": 2, "array_interfac": [100, 148], "array_to_matrix": 1797, "array_vari": 150, "arraytyp": 1801, "arriv": 356, "art": [1770, 1781], "articl": [1692, 1752, 1781], "artifact": 1788, "artifactu": 1798, "arvo": 106, "asadchev": 1734, "asarrai": [318, 319, 1797, 1800], "ascend": [63, 100, 601, 1206, 1704], "ascii": [100, 1708, 1768, 1770, 1787, 1814], "asdf": 278, "ask": [1755, 1781, 1786, 1788, 1810, 1817, 1835], "aspect": [0, 672, 1206, 1232, 1666, 1704, 1763, 1843], "aspir": [1714, 1842], "assembl": [1201, 1739, 1740, 1772, 1787, 1794, 1835], "assemble_nbody_compon": 1794, "assert": [2, 1788], "assess": [84, 145, 1781], "assidu": 1759, "assign": [2, 1226, 1303, 1341, 1704, 1711, 1714, 1726, 1730, 1759, 1770, 1781, 1788, 1801, 1817, 1832, 1838, 1842], "assist": [321, 1757, 1828, 1838], "associ": [2, 8, 21, 103, 200, 283, 329, 333, 352, 356, 574, 582, 645, 681, 1206, 1704, 1730, 1742, 1743, 1757, 1764, 1767, 1768, 1776, 1781, 1795, 1799, 1801, 1809, 1828, 1831, 1838], "assum": [84, 100, 288, 289, 314, 329, 339, 340, 368, 369, 457, 550, 575, 660, 665, 883, 1124, 1199, 1203, 1206, 1210, 1221, 1704, 1730, 1742, 1755, 1757, 1767, 1791, 1802, 1817, 1832, 1833, 1837, 1838, 1841], "assume_socc_alpha": 150, "assur": 1832, "asymmetr": [295, 573, 1206, 1232, 1666, 1704, 1714, 1730, 1766, 1776, 1781, 1792, 1793, 1798, 1833, 1838, 1842, 1843], "asymptot": [1231, 1522, 1523, 1524, 1525, 1526, 1704, 1714, 1757, 1763, 1837, 1842], "asynchron": [1230, 1435, 1436, 1704, 1837], "asyncron": [1714, 1842], "atg0": 106, "atla": 1738, "atm": 1759, "atmgr": 1759, "atmospher": 1706, "atol": [2, 278, 285, 287, 336, 338], "atol_expon": [2, 285, 287, 336, 338], "atom": [8, 9, 81, 84, 100, 103, 106, 132, 134, 150, 262, 263, 265, 267, 318, 319, 323, 352, 368, 369, 377, 386, 388, 389, 390, 399, 550, 575, 614, 628, 629, 630, 631, 636, 705, 771, 983, 1061, 1098, 1100, 1125, 1126, 1203, 1206, 1209, 1214, 1218, 1220, 1221, 1226, 1228, 1231, 1298, 1307, 1308, 1309, 1310, 1311, 1314, 1318, 1319, 1320, 1321, 1322, 1335, 1336, 1339, 1349, 1351, 1357, 1358, 1359, 1360, 1364, 1365, 1382, 1383, 1518, 1586, 1607, 1609, 1610, 1685, 1692, 1704, 1706, 1711, 1714, 1721, 1724, 1726, 1730, 1734, 1738, 1742, 1743, 1749, 1750, 1752, 1753, 1754, 1756, 1757, 1759, 1768, 1770, 1771, 1775, 1776, 1781, 1782, 1785, 1786, 1788, 1791, 1794, 1799, 1800, 1802, 1806, 1810, 1828, 1832, 1835, 1837, 1838, 1841, 1842, 1844], "atom1": [103, 106, 1050, 1218, 1704], "atom2": [103, 1050, 1218, 1704], "atom_at_posit": 106, "atom_format": 106, "atom_lbl": 389, "atom_symbol": 388, "atomic_block": 105, "atomic_mass_const": 1706, "atomic_mass_constant_energy_equival": 1706, "atomic_mass_constant_energy_equivalent_in_mev": 1706, "atomic_mass_unit_electron_volt_relationship": 1706, "atomic_mass_unit_hartree_relationship": 1706, "atomic_mass_unit_hertz_relationship": 1706, "atomic_mass_unit_inverse_meter_relationship": 1706, "atomic_mass_unit_joule_relationship": 1706, "atomic_mass_unit_kelvin_relationship": 1706, "atomic_mass_unit_kilogram_relationship": 1706, "atomic_point_charg": 150, "atomic_unit_of_1st_hyperpolariz": 1706, "atomic_unit_of_2nd_hyperpolariz": 1706, "atomic_unit_of_act": 1706, "atomic_unit_of_charg": 1706, "atomic_unit_of_charge_dens": 1706, "atomic_unit_of_curr": 1706, "atomic_unit_of_electric_dipole_mom": 1706, "atomic_unit_of_electric_field": 1706, "atomic_unit_of_electric_field_gradi": 1706, "atomic_unit_of_electric_polariz": 1706, "atomic_unit_of_electric_potenti": 1706, "atomic_unit_of_electric_quadrupole_mom": 1706, "atomic_unit_of_energi": 1706, "atomic_unit_of_forc": 1706, "atomic_unit_of_length": 1706, "atomic_unit_of_mag_dipole_mom": 1706, "atomic_unit_of_mag_flux_dens": 1706, "atomic_unit_of_magnetiz": 1706, "atomic_unit_of_mass": 1706, "atomic_unit_of_momum": 1706, "atomic_unit_of_permitt": 1706, "atomic_unit_of_tim": 1706, "atomic_unit_of_veloc": 1706, "atomiccomput": [1740, 1768, 1772, 1794, 1827], "atomicinput": [265, 378], "atomicresult": [265, 367, 1740, 1772, 1794], "atomicresultprotocol": [265, 1740, 1794], "atommap": 106, "atoms_map": 106, "atop": [284, 1740, 1743, 1776], "attach": [267, 613, 1206, 1704, 1743, 1759, 1767], "attain": [1125, 1221, 1704, 1771, 1837], "attempt": [433, 466, 507, 514, 609, 1182, 1199, 1200, 1201, 1202, 1206, 1222, 1225, 1231, 1242, 1575, 1649, 1704, 1730, 1742, 1755, 1781, 1802, 1833, 1837, 1838], "attempt_number_": 84, "attent": [2, 313, 364, 1738, 1804, 1808], "attenu": [103, 1817], "attojoul": 1706, "attr": 355, "attract": [89, 1757, 1759, 1828, 1836, 1838, 1844], "attribut": [0, 3, 12, 62, 63, 64, 79, 81, 82, 83, 84, 88, 97, 100, 111, 112, 113, 122, 126, 134, 135, 148, 150, 235, 236, 247, 314, 323, 355, 1767, 1791, 1797, 1838], "atz": 1733, "au": [377, 550, 993, 1023, 1098, 1203, 1215, 1217, 1220, 1226, 1228, 1231, 1331, 1332, 1344, 1345, 1383, 1516, 1704, 1707, 1714, 1731, 1740, 1742, 1743, 1746, 1749, 1757, 1775, 1782, 1802, 1829, 1833, 1841, 1842], "au2amu": 1706, "aufbau": 1838, "aug": [284, 295, 318, 319, 1694, 1707, 1714, 1720, 1730, 1731, 1732, 1733, 1740, 1741, 1743, 1757, 1762, 1766, 1771, 1779, 1800, 1828, 1832, 1837, 1838, 1842, 1844], "augment": [329, 356, 752, 843, 1208, 1210, 1704, 1730, 1733, 1757, 1782, 1789, 1810, 1841], "august": [1730, 1837], "austin": 1743, "auth": 1788, "author": [0, 1, 106, 1735, 1740, 1742, 1743, 1746, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1769, 1770, 1771, 1773, 1774, 1775, 1782, 1783, 1784, 1787, 1789, 1791, 1792, 1794, 1797, 1798, 1799, 1802, 1803, 1804, 1805, 1806, 1807, 1829, 1836, 1837, 1838, 1839, 1841, 1843], "auto": [2, 951, 961, 1213, 1231, 1563, 1601, 1620, 1704, 1711, 1714, 1738, 1740, 1764, 1786, 1788, 1794, 1814, 1817, 1819, 1838, 1842], "auto_frag": [1768, 1777, 1833], "autoab": [1707, 1731], "autoaux": [1694, 1707, 1731, 1732], "autodoc": 1764, "autogener": [284, 1740, 1788, 1840], "autom": [1743, 1747, 1781, 1835, 1840], "automat": [1, 2, 295, 318, 319, 434, 599, 658, 664, 665, 774, 881, 891, 921, 922, 1049, 1095, 1199, 1206, 1209, 1210, 1213, 1218, 1219, 1224, 1230, 1231, 1236, 1241, 1441, 1601, 1704, 1711, 1714, 1726, 1730, 1738, 1742, 1750, 1754, 1755, 1756, 1757, 1759, 1766, 1771, 1774, 1775, 1781, 1782, 1788, 1792, 1798, 1800, 1801, 1802, 1805, 1808, 1810, 1817, 1828, 1832, 1833, 1837, 1838, 1842, 1844], "aux": [92, 983, 1214, 1704, 1837], "aux_basi": 1837, "aux_nam": 103, "aux_overlap": 75, "auxiliari": [2, 8, 73, 75, 92, 150, 394, 400, 717, 733, 810, 892, 899, 963, 1103, 1207, 1208, 1210, 1211, 1212, 1214, 1221, 1230, 1231, 1445, 1446, 1502, 1704, 1711, 1714, 1726, 1730, 1756, 1757, 1763, 1770, 1771, 1776, 1777, 1817, 1828, 1836, 1837, 1838, 1842, 1844], "auxiliary_bond_factor": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "auxilliari": [1075, 1219, 1704, 1714, 1771, 1842], "avail": [1, 2, 8, 198, 250, 268, 269, 284, 285, 287, 300, 301, 302, 317, 318, 319, 336, 338, 346, 355, 365, 400, 401, 404, 406, 407, 474, 488, 521, 523, 545, 547, 577, 581, 586, 596, 597, 608, 610, 613, 615, 627, 635, 641, 652, 699, 701, 703, 739, 742, 769, 851, 862, 944, 1078, 1095, 1195, 1197, 1200, 1202, 1203, 1206, 1208, 1209, 1210, 1213, 1217, 1219, 1223, 1224, 1230, 1231, 1241, 1441, 1481, 1620, 1624, 1704, 1714, 1730, 1735, 1736, 1737, 1739, 1740, 1742, 1743, 1746, 1748, 1749, 1750, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1764, 1765, 1767, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1782, 1783, 1784, 1790, 1791, 1792, 1794, 1798, 1799, 1800, 1801, 1803, 1806, 1807, 1808, 1809, 1823, 1824, 1828, 1829, 1831, 1832, 1834, 1835, 1837, 1839, 1840, 1842, 1844], "availbl": 1832, "aval": [1832, 1838], "averag": [13, 100, 106, 295, 318, 319, 576, 783, 784, 835, 1004, 1041, 1171, 1172, 1179, 1180, 1206, 1210, 1215, 1218, 1222, 1229, 1231, 1411, 1610, 1673, 1704, 1714, 1746, 1755, 1766, 1770, 1771, 1776, 1785, 1798, 1800, 1834, 1837, 1838, 1842], "avg": [1673, 1776, 1785], "avg_stat": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "avg_weight": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "avogadro": 1706, "avogadro_const": 1706, "avoid": [329, 727, 993, 1208, 1215, 1231, 1568, 1704, 1714, 1730, 1737, 1738, 1743, 1746, 1747, 1748, 1750, 1753, 1755, 1757, 1767, 1771, 1785, 1798, 1802, 1817, 1819, 1821, 1835, 1837, 1838, 1842], "avx": 1839, "avxfma": 1839, "awai": [656, 1206, 1704, 1837, 1838], "awar": [614, 661, 1206, 1224, 1240, 1704, 1743, 1759, 1763, 1767, 1804], "awesom": 1810, "ax": [329, 335, 1226, 1339, 1704, 1802], "axi": [106, 139, 377, 1743, 1750, 1833, 1838], "axilrod": 1759, "axpbi": 148, "axpi": [12, 100, 148], "axpy_matrix": [183, 184], "ayala": 1734, "ayer": 1781, "azimuth": [323, 1231, 1590, 1704], "azur": [1786, 1788], "b": [11, 13, 75, 76, 100, 106, 138, 141, 148, 150, 182, 215, 259, 303, 314, 335, 356, 811, 993, 1126, 1210, 1215, 1221, 1226, 1230, 1231, 1336, 1369, 1370, 1474, 1519, 1539, 1582, 1669, 1679, 1683, 1704, 1707, 1708, 1710, 1714, 1731, 1734, 1738, 1742, 1746, 1748, 1755, 1756, 1757, 1759, 1760, 1763, 1767, 1770, 1774, 1775, 1776, 1777, 1780, 1781, 1786, 1788, 1791, 1792, 1801, 1802, 1810, 1817, 1828, 1833, 1836, 1837, 1838, 1841, 1842, 1844], "b0": [76, 1761, 1802], "b1": [993, 1215, 1704, 1714, 1746, 1750, 1802, 1842], "b1g": [993, 1215, 1704, 1746, 1829], "b1lyp": [295, 318, 319, 1695, 1697, 1698, 1700, 1703, 1758, 1766, 1800], "b1pw91": [295, 318, 319, 1695, 1698, 1700, 1703, 1758, 1766, 1800], "b1u": [993, 1215, 1704, 1746], "b1wc": [295, 318, 319, 1695, 1698, 1700, 1703, 1758, 1766, 1800], "b2": [300, 301, 302, 993, 1215, 1704, 1714, 1746, 1772, 1802, 1828, 1842, 1844], "b204199p": 1734, "b2g": [993, 1215, 1704, 1746], "b2gpplyp": [295, 1695, 1696, 1697, 1698, 1700, 1758, 1766], "b2plyp": [295, 1695, 1696, 1697, 1698, 1700, 1714, 1739, 1757, 1758, 1759, 1766, 1781, 1842], "b2pylp": [1714, 1842], "b2u": [993, 1215, 1704, 1746], "b3": [993, 1215, 1704, 1746], "b3g": [993, 1215, 1704, 1746], "b3lyp": [150, 265, 291, 295, 296, 306, 314, 318, 319, 341, 1695, 1697, 1698, 1700, 1701, 1703, 1710, 1714, 1724, 1739, 1740, 1750, 1757, 1758, 1759, 1760, 1766, 1768, 1769, 1781, 1791, 1794, 1798, 1800, 1842], "b3lyp3": [1714, 1842], "b3lyp5": [295, 318, 319, 1695, 1698, 1700, 1703, 1714, 1758, 1766, 1800, 1842], "b3p86": [295, 318, 319, 1695, 1697, 1698, 1700, 1703, 1758, 1766, 1800], "b3pw91": [295, 318, 319, 1695, 1697, 1698, 1700, 1703, 1758, 1766, 1800], "b3u": [993, 1215, 1704, 1746], "b5050lyp": [295, 318, 319, 1695, 1698, 1700, 1703, 1758, 1766, 1800], "b787": 106, "b822910d": 1781, "b864": 1734, "b86b95": [295, 318, 319, 1695, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "b86bpbe": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "b871": 1734, "b88": [295, 1695, 1698, 1700, 1701, 1758, 1766], "b88b95": [295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "b97": [295, 318, 319, 1695, 1697, 1698, 1699, 1700, 1703, 1714, 1718, 1757, 1758, 1766, 1774, 1781, 1800, 1842], "b973c": [295, 318, 319, 1695, 1698, 1699, 1703, 1718, 1734, 1758, 1766, 1774, 1800], "b97m": [295, 318, 319, 1695, 1697, 1698, 1702, 1703, 1758, 1766, 1800], "b97x": [295, 1695, 1698, 1700, 1701, 1758, 1766], "b_": [1763, 1833, 1837], "b_1": [829, 1210, 1704, 1714, 1833, 1842], "b_2": [829, 1210, 1704, 1833], "b_3": 1833, "b_g": 1833, "b_i": [829, 1210, 1704], "b_ras3_max": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "b_u": 1833, "ba": [92, 1707, 1731, 1763, 1771], "back": [84, 153, 318, 319, 835, 1210, 1226, 1306, 1704, 1730, 1737, 1738, 1743, 1746, 1748, 1762, 1765, 1767, 1773, 1775, 1782, 1783, 1784, 1788, 1797, 1800, 1803, 1810, 1828, 1835, 1838, 1839, 1844], "back_transform": 100, "backbon": [1692, 1752], "backend": [0, 1, 401, 404, 406, 407, 1197, 1704, 1781, 1817], "background": 1763, "background_color": 323, "backport": 1788, "backtick": 1788, "backtransform": [61, 100, 1817], "backtransform_dens": 90, "backtransform_tpdm_restrict": 90, "backtransform_tpdm_unrestrict": 90, "backward": [1226, 1302, 1346, 1704, 1802], "bad": [374, 395, 1737, 1738, 1748, 1767], "badg": 1788, "badger": 1743, "bake": [1738, 1767], "baker": [1692, 1752, 1802], "bakken": [1692, 1734, 1752, 1802], "balanc": [2, 1231, 1628, 1704, 1753, 1754, 1757, 1817, 1836], "band": [324, 1757], "banner": 1834, "bannwarth": 1734, "bar": [106, 426, 1198, 1704, 1706, 1753, 1759, 1788], "barlett": 1734, "barrier": [1692, 1752, 1835], "bartlett": [532, 540, 555, 584, 1202, 1203, 1206, 1229, 1427, 1704, 1734, 1755], "base": [0, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 26, 27, 28, 29, 30, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 177, 183, 184, 233, 267, 274, 275, 295, 318, 319, 321, 322, 323, 324, 325, 326, 327, 329, 430, 432, 434, 562, 568, 626, 635, 637, 653, 670, 672, 673, 683, 786, 794, 856, 857, 925, 1013, 1015, 1101, 1108, 1111, 1170, 1189, 1190, 1191, 1199, 1204, 1206, 1210, 1213, 1216, 1220, 1221, 1222, 1223, 1225, 1230, 1231, 1259, 1260, 1442, 1532, 1648, 1654, 1692, 1695, 1698, 1699, 1700, 1703, 1704, 1714, 1726, 1730, 1733, 1735, 1737, 1738, 1740, 1742, 1743, 1748, 1749, 1750, 1752, 1753, 1755, 1756, 1757, 1758, 1759, 1760, 1766, 1768, 1770, 1771, 1772, 1775, 1776, 1777, 1780, 1781, 1790, 1791, 1794, 1798, 1800, 1802, 1803, 1805, 1812, 1814, 1821, 1823, 1824, 1829, 1836, 1837, 1838, 1841, 1842], "basecomput": [1768, 1772, 1777, 1794, 1827], "basemodel": [2, 1827], "basenam": 16, "bash": [1737, 1738, 1748, 1767, 1781, 1786, 1788], "bash_profil": [1738, 1748, 1767], "bashrc": [1738, 1748, 1767], "basi": [0, 1, 2, 6, 8, 14, 21, 73, 81, 92, 103, 106, 112, 113, 115, 128, 130, 132, 134, 145, 147, 150, 265, 283, 284, 285, 286, 287, 291, 295, 296, 297, 298, 303, 314, 317, 318, 319, 326, 329, 333, 336, 337, 338, 341, 342, 347, 348, 352, 365, 376, 378, 386, 394, 397, 430, 575, 577, 590, 614, 623, 628, 647, 671, 691, 717, 727, 733, 810, 892, 899, 963, 967, 978, 979, 998, 1009, 1030, 1063, 1075, 1103, 1108, 1113, 1120, 1126, 1131, 1157, 1199, 1206, 1207, 1208, 1210, 1211, 1214, 1215, 1218, 1219, 1221, 1445, 1446, 1485, 1487, 1500, 1501, 1502, 1506, 1514, 1535, 1593, 1611, 1621, 1695, 1698, 1699, 1700, 1701, 1703, 1704, 1710, 1711, 1714, 1715, 1722, 1726, 1727, 1734, 1735, 1736, 1739, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1777, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1790, 1791, 1792, 1795, 1797, 1798, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1828, 1829, 1831, 1833, 1834, 1835, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "basic": [284, 1153, 1221, 1704, 1740, 1743, 1748, 1756, 1778, 1780, 1785, 1790, 1808, 1834], "basicmpi": [1231, 1634, 1704], "basis1": [112, 113], "basis2": [112, 113], "basis_funct": [1112, 1221, 1704, 1750], "basis_guess": [0, 1, 2, 295, 1500, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "basis_lo": [284, 1740], "basis_on_atom": 106, "basis_project": 150, "basis_relativist": [0, 1, 2, 8, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "basis_set": [1735, 1832], "basis_set_exchang": 1738, "basis_valu": 7, "basisext": 1827, "basisfamili": 1764, "basisfunct": [119, 1827], "basislistdun": 1764, "basislistoth": 1764, "basisnam": 8, "basisset": [6, 14, 21, 29, 73, 84, 92, 97, 103, 115, 128, 130, 131, 145, 147, 150, 295, 386, 1714, 1726, 1766, 1801, 1809, 1817, 1827, 1837, 1842], "basset": 1730, "bat": 1788, "batch": [1231, 1592, 1704, 1767, 1817], "bb": [13, 1708], "bb1k": [295, 318, 319, 1695, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "bbb": [1669, 1776], "bbuild": 1738, "bc": [259, 961, 1213, 1679, 1704, 1708, 1759, 1776, 1802], "bc8d7f5": 1788, "bcc": [731, 1208, 1704], "bccd": [284, 295, 1739, 1740, 1742, 1766, 1781], "bccd_maxit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "be_quiet": 1828, "bear": [1828, 1844], "beauti": 1828, "becaus": [2, 106, 314, 430, 609, 1199, 1206, 1704, 1714, 1730, 1738, 1743, 1748, 1753, 1755, 1756, 1757, 1763, 1776, 1786, 1791, 1798, 1802, 1817, 1822, 1823, 1824, 1828, 1832, 1833, 1838, 1842, 1844], "beck": [1231, 1528, 1534, 1704, 1757, 1759, 1837], "becom": [1224, 1233, 1235, 1236, 1237, 1238, 1239, 1241, 1704, 1743, 1757, 1798, 1802, 1833, 1838, 1844], "been": [0, 2, 84, 106, 150, 171, 200, 208, 209, 210, 212, 230, 263, 265, 284, 370, 399, 430, 568, 574, 612, 641, 642, 647, 697, 882, 1095, 1199, 1206, 1210, 1219, 1704, 1714, 1730, 1733, 1735, 1736, 1737, 1738, 1740, 1743, 1746, 1747, 1748, 1749, 1751, 1753, 1756, 1757, 1759, 1762, 1763, 1764, 1765, 1767, 1770, 1771, 1773, 1774, 1775, 1780, 1781, 1782, 1783, 1784, 1786, 1788, 1792, 1794, 1798, 1801, 1802, 1803, 1806, 1807, 1808, 1809, 1817, 1828, 1829, 1832, 1833, 1837, 1838, 1839, 1840, 1842, 1844], "beer": 1838, "befor": [0, 100, 106, 235, 236, 259, 327, 342, 356, 661, 793, 838, 1204, 1206, 1210, 1224, 1226, 1229, 1230, 1231, 1240, 1347, 1409, 1464, 1465, 1466, 1510, 1602, 1704, 1714, 1738, 1743, 1747, 1753, 1754, 1755, 1757, 1759, 1767, 1768, 1770, 1786, 1787, 1801, 1804, 1808, 1817, 1828, 1832, 1833, 1835, 1837, 1838, 1842, 1844], "beforehand": [182, 259], "begin": [0, 137, 312, 700, 1180, 1206, 1222, 1223, 1704, 1740, 1743, 1750, 1752, 1755, 1770, 1771, 1776, 1797, 1801, 1802, 1823, 1828, 1836, 1838, 1841, 1844], "behav": [1743, 1757, 1798, 1804], "behavior": [106, 1231, 1490, 1704, 1711, 1757, 1759, 1767, 1798, 1802, 1821, 1828, 1837, 1838, 1844], "behaviour": 2, "behind": [1743, 1754, 1772, 1800, 1828, 1832, 1837, 1844], "behnl": [1734, 1798], "being": [2, 103, 112, 115, 134, 318, 319, 329, 388, 393, 516, 570, 601, 729, 1202, 1206, 1208, 1226, 1229, 1231, 1363, 1405, 1499, 1626, 1649, 1704, 1714, 1730, 1737, 1738, 1743, 1746, 1748, 1752, 1755, 1757, 1759, 1762, 1765, 1767, 1773, 1775, 1782, 1783, 1784, 1785, 1800, 1801, 1802, 1809, 1817, 1828, 1832, 1833, 1838, 1839, 1840, 1842, 1844], "belong": [9, 106, 1714, 1750, 1763, 1768, 1823, 1829, 1838, 1842], "below": [2, 106, 284, 286, 318, 319, 337, 415, 594, 606, 632, 645, 704, 736, 740, 829, 905, 1053, 1198, 1206, 1208, 1210, 1212, 1218, 1224, 1230, 1231, 1234, 1455, 1462, 1569, 1704, 1714, 1730, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1748, 1752, 1753, 1756, 1757, 1759, 1763, 1764, 1767, 1768, 1770, 1771, 1774, 1775, 1779, 1781, 1782, 1786, 1788, 1792, 1794, 1795, 1796, 1798, 1799, 1800, 1801, 1802, 1805, 1806, 1808, 1809, 1810, 1817, 1828, 1829, 1832, 1833, 1834, 1835, 1837, 1838, 1842, 1844], "bench": [0, 1, 2, 1704, 1714, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "benchmark": [154, 155, 156, 157, 158, 159, 1104, 1221, 1692, 1704, 1714, 1752, 1757, 1781, 1817, 1832, 1842], "benchmark_nam": [1692, 1752], "bend": [1711, 1714, 1802, 1842], "bendazzoli": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "benefit": [457, 1199, 1704, 1738, 1742, 1753, 1763, 1781, 1837, 1838], "benjamin": 1839, "bennyp": 1839, "bent": [1714, 1842], "benzaldehyd": 1833, "benzen": [1692, 1714, 1722, 1726, 1729, 1730, 1752, 1782, 1802, 1833, 1842], "benzenesulfon": 1833, "benzenesulfonamid": 1833, "benzenesulfonohydrazid": 1833, "benzenesulfonyl": 1833, "benzoic": 1833, "benzonitril": 1833, "benzyl": [1714, 1842], "beran": [267, 1759], "berquist": 1734, "besalu": [1734, 1802], "besal\u00fa": 1734, "besid": [100, 148, 331, 662, 1206, 1704, 1738, 1797], "best": [106, 284, 342, 356, 584, 586, 774, 808, 1206, 1209, 1210, 1231, 1620, 1704, 1711, 1730, 1737, 1738, 1739, 1740, 1742, 1743, 1754, 1757, 1782, 1794, 1801, 1804, 1809, 1835, 1837, 1838], "best_l": 356, "best_r": 356, "best_valu": [342, 356], "best_vector": 342, "beta": [0, 11, 13, 84, 92, 98, 100, 138, 150, 291, 314, 341, 660, 664, 785, 790, 823, 824, 825, 827, 829, 1111, 1206, 1210, 1221, 1225, 1231, 1284, 1523, 1559, 1564, 1579, 1581, 1669, 1680, 1690, 1704, 1708, 1714, 1740, 1750, 1755, 1756, 1757, 1759, 1776, 1781, 1791, 1810, 1829, 1838, 1842], "beta_corr_to_pitz": 90, "beta_orbital_spac": 150, "betastr": [827, 1210, 1704], "better": [2, 586, 1206, 1704, 1737, 1742, 1747, 1748, 1756, 1757, 1798, 1821, 1824, 1832, 1837, 1838], "between": [0, 1, 2, 20, 73, 106, 112, 143, 144, 149, 168, 195, 197, 309, 329, 360, 383, 404, 443, 457, 476, 479, 519, 543, 823, 826, 840, 887, 1101, 1197, 1199, 1200, 1202, 1203, 1210, 1220, 1226, 1231, 1301, 1307, 1309, 1310, 1311, 1318, 1320, 1321, 1322, 1357, 1358, 1359, 1360, 1616, 1617, 1704, 1711, 1714, 1730, 1733, 1737, 1738, 1742, 1743, 1748, 1752, 1753, 1755, 1757, 1763, 1767, 1768, 1770, 1775, 1776, 1779, 1782, 1785, 1791, 1795, 1797, 1799, 1801, 1802, 1804, 1809, 1810, 1817, 1828, 1832, 1833, 1835, 1837, 1838, 1842, 1844], "beyond": [106, 662, 1206, 1704, 1738, 1743, 1754, 1755, 1770, 1788, 1833, 1837], "bf": [106, 983, 1214, 1704, 1714, 1768, 1798, 1833, 1842], "bfdb": [1692, 1752], "bfg": [1226, 1329, 1704, 1802], "bfs_arrai": 106, "bfs_map": 106, "bfs_molecul": 106, "bg": [993, 1215, 1704, 1746], "bg_user_scftyp": 1801, "bg_user_wfn": 1801, "bh": [1714, 1842], "bhandh": [295, 318, 319, 1695, 1698, 1700, 1703, 1758, 1766, 1800], "bhandhlyp": [295, 318, 319, 1695, 1698, 1700, 1703, 1758, 1766, 1800], "bi": [1707, 1731], "biatom": [1692, 1752], "bibliographi": [400, 1764, 1777], "bibtex": 68, "big": [106, 1740, 1798], "biggest": 1810, "bimolecular": [1692, 1711, 1714, 1743, 1752, 1833, 1842], "bin": [2, 1735, 1738, 1748, 1750, 1759, 1764, 1767, 1808], "binari": [1, 86, 295, 1738, 1743, 1746, 1749, 1750, 1754, 1759, 1762, 1764, 1765, 1766, 1767, 1773, 1774, 1775, 1777, 1781, 1782, 1783, 1784, 1785, 1788, 1792, 1803, 1806, 1807, 1819, 1832, 1839], "bind": [1711, 1714, 1823, 1835, 1842], "binder": 1788, "bindex": 98, "binstar": 1748, "biofrag": [1692, 1752], "biolog": 1734, "biorthogon": [1714, 1842], "biorthonorm": 1841, "birad": [692, 1206, 1704], "bit": [2, 15, 120, 575, 651, 1206, 1704, 1767, 1770, 1781, 1786, 1810], "bizarr": 1730, "bj": [106, 267, 295, 318, 319, 1695, 1697, 1698, 1700, 1701, 1702, 1703, 1758, 1759, 1766, 1800], "bl_user_scftype_scf": 1801, "bl_user_wfn": 1801, "bl_user_wfn_scf": 1801, "bla": [2, 154, 155, 156, 1714, 1736, 1737, 1746, 1756, 1767, 1771, 1782, 1785, 1812, 1814, 1838, 1842], "blank": [86, 138, 1231, 1508, 1704, 1730, 1743, 1808, 1828, 1833, 1835, 1844], "blanklin": 1743, "blas1": 1810, "blas2": [1757, 1810], "blas3": [1757, 1810], "blas_librari": 1738, "blas_typ": 1738, "bld": 1788, "blend": [8, 1838], "bless": [267, 1759], "blindli": [660, 1206, 1704, 1743], "blob": [372, 1788, 1833], "block": [0, 13, 88, 100, 105, 110, 119, 138, 147, 148, 283, 300, 301, 302, 331, 333, 334, 366, 379, 399, 474, 501, 575, 603, 609, 615, 648, 664, 665, 671, 681, 795, 807, 830, 831, 832, 833, 834, 837, 1031, 1114, 1130, 1200, 1206, 1210, 1218, 1221, 1225, 1230, 1231, 1296, 1459, 1461, 1515, 1516, 1517, 1518, 1625, 1704, 1714, 1726, 1730, 1733, 1742, 1743, 1755, 1756, 1757, 1763, 1771, 1772, 1781, 1782, 1783, 1785, 1786, 1788, 1795, 1796, 1797, 1798, 1801, 1808, 1810, 1813, 1822, 1828, 1832, 1833, 1836, 1837, 1838, 1841, 1842, 1844], "block_diag": 334, "block_matrix": 1810, "block_siz": 1817, "block_start": 1817, "blockofpoint": 9, "blockopoint": [7, 105, 119, 147, 1827], "blockpq": 1817, "blockpq_idx": 1817, "blockr": 1817, "blockrs_idx": 1817, "blockspq": 1817, "blocksr": 1817, "blue": 1750, "blyp": [106, 267, 295, 318, 319, 1695, 1696, 1697, 1698, 1699, 1700, 1703, 1757, 1758, 1759, 1760, 1766, 1800], "bmk": [295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "bobjdir": 1738, "bodi": [112, 143, 279, 1708, 1714, 1756, 1757, 1768, 1770, 1776, 1780, 1783, 1790, 1794, 1798, 1801, 1804, 1828, 1829, 1837, 1838, 1842, 1844], "bofil": [1226, 1329, 1704, 1734, 1802], "bohr": [83, 106, 275, 306, 307, 388, 618, 632, 705, 781, 1032, 1033, 1115, 1116, 1206, 1209, 1218, 1221, 1226, 1231, 1340, 1343, 1348, 1598, 1660, 1704, 1706, 1714, 1750, 1754, 1772, 1776, 1782, 1800, 1803, 1833, 1837, 1838, 1842], "bohr2angstrom": [1706, 1754], "bohr2cm": 1706, "bohr2m": 1706, "bohr_magneton": 1706, "bohr_magneton_in_evpt": 1706, "bohr_magneton_in_hzpt": 1706, "bohr_magneton_in_inverse_meters_per_tesla": 1706, "bohr_magneton_in_kpt": 1706, "bohr_per_ang": 323, "bohr_radiu": 1706, "boi": [10, 965, 973, 974, 1214, 1704, 1763], "boilerpl": 1801, "boldsymbol": 1753, "bolton": 1734, "boltzmann": [1706, 1754], "boltzmann_const": 1706, "boltzmann_constant_in_evpk": 1706, "boltzmann_constant_in_hzpk": 1706, "boltzmann_constant_in_inverse_meters_per_kelvin": 1706, "bond": [106, 323, 1034, 1049, 1050, 1218, 1226, 1298, 1303, 1313, 1326, 1341, 1692, 1704, 1714, 1752, 1755, 1761, 1770, 1776, 1790, 1799, 1802, 1828, 1832, 1842, 1844], "bond_threshold": 106, "bond_width": 323, "bondi": [773, 1209, 1704, 1734, 1754], "bonding_alpha": 323, "bonn": [106, 1759, 1774], "book": 1843, "bookkeep": [1817, 1838], "bool": [2, 3, 8, 12, 13, 14, 18, 27, 61, 66, 76, 78, 80, 81, 84, 86, 87, 89, 90, 92, 96, 100, 103, 104, 106, 114, 119, 128, 130, 133, 138, 143, 144, 145, 148, 150, 182, 187, 207, 208, 209, 210, 211, 212, 213, 219, 246, 248, 250, 251, 252, 256, 259, 263, 265, 267, 277, 282, 283, 288, 289, 296, 308, 314, 332, 333, 339, 340, 342, 350, 356, 370, 374, 383, 386, 388, 389, 395, 399, 1759, 1768, 1769, 1785, 1791, 1794, 1797, 1817], "boolean": [2, 100, 114, 150, 265, 295, 300, 301, 302, 314, 318, 319, 359, 416, 417, 418, 424, 425, 426, 427, 429, 438, 440, 441, 448, 451, 453, 457, 458, 459, 460, 461, 462, 463, 468, 470, 471, 477, 478, 480, 481, 486, 488, 493, 494, 497, 498, 501, 503, 509, 510, 515, 517, 520, 526, 530, 532, 534, 536, 538, 540, 541, 544, 554, 555, 559, 561, 562, 566, 576, 579, 596, 597, 598, 602, 604, 605, 625, 626, 639, 642, 648, 653, 657, 658, 672, 675, 678, 679, 680, 682, 688, 691, 692, 694, 695, 697, 698, 699, 706, 713, 718, 742, 743, 745, 749, 753, 762, 765, 786, 787, 788, 792, 795, 799, 801, 802, 803, 807, 809, 812, 817, 821, 822, 823, 831, 836, 838, 839, 844, 849, 859, 860, 861, 863, 864, 865, 866, 867, 872, 875, 882, 883, 885, 886, 887, 888, 909, 910, 913, 915, 917, 919, 920, 921, 922, 925, 934, 940, 941, 942, 945, 952, 954, 956, 986, 990, 991, 994, 995, 996, 998, 999, 1004, 1010, 1012, 1014, 1016, 1017, 1019, 1020, 1022, 1024, 1025, 1026, 1027, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1044, 1045, 1059, 1061, 1064, 1069, 1071, 1073, 1074, 1076, 1078, 1083, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1105, 1117, 1121, 1124, 1132, 1145, 1151, 1152, 1157, 1171, 1172, 1173, 1175, 1179, 1182, 1183, 1186, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1212, 1213, 1215, 1216, 1217, 1218, 1219, 1221, 1222, 1225, 1226, 1228, 1229, 1230, 1231, 1244, 1252, 1253, 1254, 1255, 1258, 1259, 1260, 1261, 1262, 1264, 1268, 1270, 1276, 1277, 1278, 1280, 1288, 1295, 1298, 1300, 1306, 1312, 1315, 1316, 1317, 1327, 1330, 1334, 1337, 1355, 1356, 1361, 1367, 1369, 1370, 1372, 1373, 1374, 1378, 1381, 1385, 1386, 1390, 1392, 1404, 1406, 1407, 1411, 1413, 1414, 1415, 1418, 1419, 1420, 1421, 1422, 1428, 1430, 1431, 1432, 1434, 1435, 1436, 1441, 1447, 1448, 1449, 1450, 1451, 1452, 1459, 1460, 1461, 1464, 1465, 1466, 1467, 1468, 1480, 1483, 1491, 1510, 1535, 1541, 1546, 1549, 1553, 1554, 1557, 1558, 1560, 1564, 1565, 1566, 1578, 1583, 1585, 1587, 1591, 1593, 1594, 1596, 1606, 1610, 1613, 1614, 1623, 1624, 1637, 1643, 1647, 1656, 1663, 1704, 1735, 1740, 1742, 1743, 1746, 1749, 1752, 1754, 1755, 1766, 1770, 1771, 1772, 1785, 1791, 1794, 1795, 1796, 1798, 1800, 1801, 1803, 1837, 1841], "boost": [284, 1735, 1738, 1740], "bop": [295, 318, 319, 1695, 1697, 1698, 1699, 1701, 1703, 1758, 1766, 1800], "borb": 98, "border": [0, 1, 2, 106, 1379, 1384, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "border_n_redist": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "border_redist_ord": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "border_redist_pol": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "border_rmin": [0, 1, 2, 1383, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "border_rmin_unit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "border_typ": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "born": [597, 1206, 1704], "borrow": 1757, "bot": [1814, 1819], "both": [0, 2, 8, 106, 112, 278, 280, 284, 356, 373, 391, 539, 601, 609, 617, 664, 679, 741, 746, 830, 1203, 1206, 1208, 1210, 1225, 1226, 1231, 1279, 1352, 1615, 1704, 1714, 1715, 1716, 1722, 1726, 1730, 1735, 1738, 1740, 1742, 1743, 1747, 1750, 1753, 1755, 1756, 1757, 1759, 1763, 1764, 1767, 1770, 1771, 1774, 1775, 1776, 1781, 1785, 1788, 1792, 1795, 1796, 1798, 1802, 1805, 1808, 1810, 1817, 1828, 1832, 1833, 1835, 1837, 1838, 1842, 1844], "bottleneck": [1742, 1817, 1823, 1824, 1837, 1838], "bottom": [390, 1770, 1788, 1804, 1837, 1844], "boughton": [445, 1199, 1704], "bound": [1226, 1344, 1345, 1692, 1704, 1738, 1743, 1752, 1757, 1833, 1838, 1844], "boundari": [1754, 1770, 1803], "box": [313, 364], "boysloc": 1827, "bozkaya": [1692, 1734, 1752, 1781, 1786, 1798], "bp": [445, 1199, 1704], "bp86": [295, 318, 319, 1695, 1697, 1698, 1699, 1703, 1714, 1715, 1758, 1759, 1766, 1800, 1842], "br": [1707, 1731], "bra": [13, 1708, 1756], "bracket": [284, 1730, 1740, 1743, 1761, 1776, 1821, 1844], "bragg": 1757, "braggslat": [1714, 1715, 1724, 1842], "branch": [1737, 1738, 1764, 1783, 1786, 1787], "branch_protection_rul": 1788, "brand": 1838, "brandenburg": [1734, 1774], "breadth": 106, "break": [2, 342, 835, 1210, 1231, 1564, 1704, 1714, 1755, 1757, 1770, 1781, 1798, 1802, 1817, 1828, 1837, 1838, 1842], "breakdown": [1756, 1757, 1776, 1781], "breda": 1757, "breviti": 0, "brianqc": [400, 1105, 1221, 1704, 1738, 1777, 1780, 1842], "brianqc_dir": 1735, "brianqc_en": [0, 1, 2, 1704, 1730, 1733, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "brianqc_install_path": 1735, "brianqc_manual_v1_1_0": 1735, "brianqc_sdk_instal": 1735, "brief": [1757, 1781, 1802, 1835, 1837, 1842], "briefli": 1770, "brien": [1734, 1781], "bright_schem": 1750, "brillioun": 1756, "bring": 2, "broad": 1738, "broadcast": 1797, "broaden": [0, 322, 324, 325, 377, 1841], "broken": [697, 1206, 1231, 1564, 1692, 1704, 1752, 1768, 1790], "brook": [1734, 1781], "brought": [1804, 1841], "broughton": [443, 479, 519, 543, 1199, 1200, 1202, 1203, 1704], "browser": [1764, 1788], "brueckner": [295, 431, 432, 457, 579, 1066, 1199, 1206, 1219, 1669, 1704, 1742, 1766, 1776, 1785], "brueckner_maxit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "brueckner_orb": 1785, "brueckner_orbs_r_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "bryant": 1734, "bs1": 103, "bs2": 103, "bs3": 103, "bs4": 103, "bsd": [1781, 1806], "bse": [1714, 1842], "bsse": [106, 295, 1714, 1752, 1757, 1766, 1768, 1774, 1794, 1842], "bsse_typ": [1752, 1794, 1828, 1832, 1844], "bsseenum": 1794, "bsvec": 1827, "btwn": [1714, 1842], "bu": [993, 1215, 1704, 1746], "budapest": [586, 1206, 1704], "buf": [1231, 1576, 1704], "buffer": [12, 837, 902, 1210, 1212, 1230, 1481, 1704, 1755], "buffer_": 1817, "bug": [2, 1737, 1771, 1781, 1818, 1838], "bui": [284, 351, 370, 381, 382, 1740, 1743, 1752, 1826, 1838, 1840], "build": [2, 8, 18, 29, 64, 66, 68, 76, 92, 97, 138, 147, 150, 314, 346, 394, 463, 503, 1199, 1200, 1231, 1566, 1567, 1704, 1723, 1734, 1737, 1743, 1748, 1753, 1756, 1757, 1759, 1764, 1767, 1771, 1774, 1780, 1781, 1787, 1791, 1792, 1797, 1807, 1808, 1814, 1817, 1824, 1828, 1834, 1837, 1838, 1841, 1842], "build_alwai": 1738, "build_bas": 80, "build_cabs_spac": 115, "build_collocation_cach": 147, "build_jk": 92, "build_libint2_gener": [1738, 1783], "build_plan": [1785, 1788], "build_ri_spac": 115, "build_sad": 131, "build_task": [1740, 1772, 1794], "builder": 1757, "buildtim": 1738, "built": [1, 2, 8, 106, 1231, 1553, 1704, 1711, 1714, 1737, 1738, 1740, 1746, 1748, 1749, 1754, 1755, 1757, 1759, 1762, 1764, 1765, 1767, 1770, 1773, 1774, 1775, 1780, 1782, 1783, 1784, 1785, 1788, 1799, 1803, 1806, 1807, 1808, 1810, 1828, 1831, 1832, 1834, 1838, 1839, 1842, 1844], "builtin": [1158, 1221, 1704, 1792, 1832], "bukowski": 1734, "bulk": 138, "bullet": [1785, 1788, 1835, 1842], "bump": [1231, 1503, 1504, 1704, 1787, 1788, 1814], "bundl": [1746, 1749, 1762, 1765, 1773, 1775, 1782, 1783, 1784, 1803, 1839], "burdensom": 1833, "burk": [295, 318, 319, 1695, 1697, 1698, 1699, 1703, 1758, 1766, 1800], "burn": [106, 1692, 1734, 1740, 1743, 1746, 1752, 1759, 1765, 1773, 1774, 1781, 1782, 1783, 1784, 1786, 1802, 1804, 1807, 1839, 1843], "button": [1737, 1743, 1748, 1786, 1788], "bvec": [867, 1210, 1704], "bw": [1229, 1398, 1704], "bypass": [1738, 1788, 1809, 1832], "byproduct": [1739, 1781], "byrd": 1734, "byte": [198, 250, 305, 353, 374, 395, 620, 1206, 1704, 1767, 1821, 1828, 1832], "bz2": [1714, 1842], "bzbz_": [1692, 1752], "bzbz_pd": [1692, 1752], "bzbz_pd32": [1692, 1752], "bzbz_pd34": [1692, 1752], "bzbz_pd36": [1692, 1752], "bzbz_t": [1692, 1752], "bzh2": [1692, 1752], "bzme": [1692, 1752], "c": [0, 8, 11, 21, 76, 84, 90, 100, 106, 115, 130, 138, 141, 259, 351, 368, 369, 377, 392, 443, 479, 519, 543, 696, 804, 837, 993, 1017, 1018, 1019, 1020, 1047, 1199, 1200, 1202, 1203, 1206, 1210, 1215, 1216, 1218, 1229, 1230, 1231, 1427, 1469, 1540, 1560, 1582, 1679, 1704, 1706, 1707, 1708, 1710, 1713, 1714, 1715, 1716, 1730, 1731, 1734, 1736, 1737, 1743, 1746, 1747, 1748, 1749, 1753, 1754, 1755, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1767, 1769, 1770, 1773, 1774, 1775, 1776, 1777, 1781, 1782, 1783, 1784, 1786, 1788, 1789, 1791, 1792, 1798, 1799, 1801, 1802, 1803, 1806, 1807, 1808, 1809, 1810, 1817, 1818, 1819, 1822, 1824, 1828, 1829, 1832, 1833, 1836, 1837, 1838, 1839, 1841, 1842, 1844], "c1": [0, 2, 11, 14, 103, 128, 130, 143, 145, 150, 696, 993, 1206, 1215, 1231, 1564, 1704, 1708, 1713, 1714, 1730, 1735, 1743, 1746, 1749, 1754, 1757, 1763, 1770, 1782, 1802, 1803, 1805, 1810, 1833, 1837, 1838, 1841, 1842], "c1_deep_copi": [14, 128, 130, 145, 150], "c2": [103, 106, 139, 696, 993, 1206, 1215, 1704, 1714, 1746, 1802, 1833, 1838, 1842], "c2_x": 139, "c2_y": 139, "c2_z": 139, "c2h": [696, 993, 1206, 1215, 1704, 1746, 1833], "c2h2": [1714, 1842], "c2h3": [1692, 1752], "c2h4": [1692, 1752], "c2hx": 1833, "c2hy": 1833, "c2hz": 1833, "c2v": [696, 993, 1206, 1215, 1232, 1666, 1704, 1714, 1746, 1833, 1838, 1842, 1843], "c2vx": 1833, "c2vy": 1833, "c2vz": 1833, "c2x": 1833, "c2y": 1833, "c2z": 1833, "c3": 103, "c3v": 106, "c4": [103, 284, 295, 318, 319, 581, 586, 1206, 1704, 1740, 1743, 1744, 1745, 1766, 1800], "c4h4n": [1714, 1842], "c4h5n": [1714, 1842], "c4nh4": [1714, 1842], "c6": 1802, "c6cp00164e": [1734, 1781], "c6h6": 1782, "c852257": 1786, "c_": [1706, 1730, 1755, 1757, 1759, 1810, 1829, 1833, 1838], "c_0": 1755, "c_1": [14, 128, 130, 145, 150, 698, 829, 1206, 1210, 1704, 1752, 1833], "c_2": [829, 1210, 1704, 1833], "c_4h_4o": 0, "c_6": 1759, "c_8": 1759, "c_add": 92, "c_alpha": 138, "c_au": 1706, "c_clear": 92, "c_ddot": 1810, "c_dgemm": 1810, "c_dgemv": 1810, "c_dpotrf": 1810, "c_ene": 1833, "c_function": [138, 1757], "c_hybrid": [1695, 1696, 1697, 1699, 1700, 1701, 1702, 1758], "c_i": [829, 1210, 1704, 1755, 1833], "c_left_add": 92, "c_lrc": [1695, 1696, 1697, 1699, 1700, 1701, 1702, 1758], "c_method_nam": 1757, "c_mp2": 1757, "c_n": 1759, "c_omega": 138, "c_os_alpha": 138, "c_right_add": 92, "c_sc": [1695, 1696, 1697, 1699, 1700, 1701, 1702, 1758], "c_ss_alpha": 138, "c_yne": 1833, "ca": [2, 104, 131, 150, 314, 1707, 1714, 1731, 1746, 1786, 1791, 1805, 1810, 1829, 1842], "ca_subset": 150, "cach": [147, 329, 412, 433, 434, 466, 467, 507, 514, 537, 558, 580, 728, 900, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1206, 1208, 1212, 1225, 1231, 1242, 1507, 1704, 1738, 1742, 1748, 1808], "cachelevel": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cachetyp": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cal": [0, 1742, 1753, 1756, 1763, 1771], "cal2j": 1706, "calc": [170, 307, 1224, 1231, 1236, 1662, 1704, 1714, 1722, 1743, 1752, 1772, 1785, 1809, 1833, 1842], "calc_s_squar": [0, 1, 2, 884, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "calcul": [1, 2, 8, 11, 13, 70, 106, 150, 267, 275, 284, 295, 296, 300, 301, 302, 307, 312, 314, 318, 319, 356, 368, 369, 377, 381, 382, 399, 430, 433, 439, 443, 457, 466, 473, 476, 479, 495, 507, 514, 519, 539, 543, 550, 568, 569, 570, 571, 572, 573, 574, 575, 577, 581, 586, 588, 589, 593, 597, 598, 599, 600, 601, 605, 606, 607, 608, 609, 610, 611, 612, 614, 615, 616, 617, 619, 623, 625, 627, 635, 637, 639, 641, 648, 652, 653, 655, 657, 658, 660, 664, 665, 667, 669, 670, 671, 672, 673, 674, 675, 676, 679, 680, 681, 690, 692, 693, 695, 696, 698, 699, 701, 702, 703, 704, 707, 737, 775, 776, 786, 787, 804, 818, 850, 882, 924, 986, 989, 999, 1000, 1024, 1041, 1079, 1103, 1126, 1139, 1166, 1199, 1200, 1201, 1202, 1203, 1206, 1208, 1209, 1210, 1213, 1215, 1217, 1218, 1219, 1221, 1224, 1225, 1229, 1230, 1231, 1233, 1236, 1241, 1242, 1257, 1410, 1463, 1497, 1510, 1552, 1564, 1609, 1619, 1704, 1711, 1713, 1714, 1726, 1730, 1734, 1735, 1740, 1743, 1746, 1749, 1750, 1752, 1754, 1757, 1759, 1760, 1762, 1763, 1766, 1767, 1769, 1770, 1771, 1772, 1774, 1776, 1777, 1778, 1779, 1781, 1789, 1790, 1791, 1792, 1794, 1795, 1796, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1810, 1823, 1824, 1826, 1832, 1833, 1834, 1836, 1837, 1839, 1840, 1841, 1842], "calculu": 0, "caldeweyh": [1734, 1759], "calendar": [1730, 1733], "call": [0, 2, 84, 87, 92, 100, 106, 138, 150, 158, 168, 188, 213, 222, 235, 236, 266, 268, 269, 270, 271, 272, 276, 277, 278, 279, 284, 295, 300, 301, 302, 318, 319, 329, 350, 359, 380, 381, 382, 393, 399, 661, 662, 664, 891, 1070, 1138, 1198, 1199, 1201, 1204, 1206, 1210, 1215, 1216, 1219, 1221, 1222, 1223, 1224, 1231, 1240, 1669, 1677, 1678, 1682, 1690, 1698, 1703, 1704, 1714, 1715, 1726, 1730, 1738, 1740, 1742, 1743, 1744, 1745, 1746, 1748, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1763, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1774, 1775, 1779, 1782, 1785, 1788, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1808, 1809, 1812, 1814, 1823, 1824, 1826, 1828, 1832, 1833, 1834, 1837, 1838, 1842, 1844], "callabl": [2, 8, 84, 322, 324, 325, 335, 346, 1740, 1767, 1768, 1823, 1832], "callback": 8, "calle": 1779, "caller": [100, 342, 356, 1779, 1817], "calori": 1706, "calorie_joule_relationship": 1706, "cam": [295, 1695, 1697, 1698, 1700, 1701, 1714, 1758, 1766, 1842], "camb3lyp": [1714, 1842], "cammi": [1734, 1742, 1749, 1754, 1803], "can": [0, 1, 2, 8, 20, 86, 100, 106, 148, 150, 267, 279, 283, 284, 285, 295, 297, 300, 301, 302, 314, 318, 319, 328, 329, 331, 333, 335, 336, 347, 356, 386, 570, 574, 575, 577, 580, 586, 609, 628, 635, 641, 652, 657, 662, 672, 679, 697, 726, 727, 729, 738, 743, 751, 829, 842, 882, 993, 1065, 1104, 1125, 1127, 1128, 1158, 1164, 1165, 1206, 1208, 1210, 1215, 1219, 1221, 1226, 1228, 1229, 1231, 1304, 1394, 1405, 1620, 1655, 1704, 1714, 1730, 1733, 1735, 1737, 1738, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1779, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1817, 1821, 1822, 1823, 1824, 1828, 1829, 1831, 1832, 1833, 1835, 1836, 1837, 1838, 1839, 1841, 1842, 1844], "canc": [1734, 1754, 1803], "cancel": [1828, 1837, 1844], "canc\u00e8": 1734, "candid": 1794, "cannot": [584, 859, 860, 875, 1206, 1210, 1704, 1737, 1738, 1743, 1749, 1753, 1754, 1757, 1763, 1773, 1783, 1784, 1787, 1794, 1802, 1803, 1837, 1841, 1843], "canon": [150, 664, 665, 704, 1206, 1231, 1601, 1704, 1707, 1731, 1757, 1763, 1768, 1776, 1781, 1810, 1838], "canonic": [1171, 1172, 1222, 1704], "canonicalize_active_favg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "canonicalize_inactive_favg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cap": [114, 326, 1738, 1764, 1785], "cap0": [295, 318, 319, 1695, 1698, 1700, 1703, 1758, 1766, 1800], "capabilit": 1738, "capabl": [2, 68, 106, 138, 381, 382, 1736, 1749, 1755, 1762, 1764, 1765, 1767, 1775, 1777, 1782, 1788, 1790, 1803, 1809, 1826, 1829, 1838, 1841], "capac": [1755, 1832], "capit": [1743, 1785, 1810], "captur": [350, 351, 370, 476, 1110, 1200, 1221, 1704, 1750, 1757, 1759, 1771, 1799, 1838], "carbon": [1706, 1714, 1730, 1770, 1792, 1802, 1833, 1842], "card": [901, 1212, 1704], "care": [329, 1225, 1296, 1704, 1743, 1770, 1797, 1798, 1810, 1817, 1838, 1844], "carefulli": [2, 1763, 1817, 1824], "carrel": 1734, "carri": [306, 570, 706, 1206, 1704, 1742, 1756, 1768, 1776, 1794, 1800, 1802, 1837, 1841, 1844], "cart": 2, "cart_hess_read": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cartao": 1817, "cartesian": [8, 15, 16, 81, 82, 103, 106, 134, 139, 149, 318, 319, 350, 389, 592, 618, 637, 691, 707, 1206, 1226, 1231, 1300, 1301, 1306, 1308, 1352, 1623, 1704, 1711, 1714, 1730, 1743, 1750, 1768, 1800, 1802, 1810, 1817, 1828, 1832, 1833, 1835, 1837, 1838, 1842, 1844], "cartesian_sym_toler": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cartiesian": 1832, "casci": [1755, 1781, 1829], "case": [0, 13, 81, 106, 150, 151, 174, 175, 176, 207, 211, 212, 238, 244, 254, 255, 262, 279, 283, 284, 330, 333, 342, 355, 356, 358, 367, 374, 376, 377, 395, 397, 586, 601, 609, 626, 641, 655, 659, 660, 664, 665, 681, 695, 697, 727, 729, 778, 833, 1125, 1170, 1206, 1208, 1209, 1210, 1221, 1224, 1229, 1230, 1231, 1235, 1237, 1241, 1405, 1441, 1584, 1690, 1704, 1714, 1724, 1730, 1738, 1739, 1740, 1742, 1743, 1747, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1764, 1767, 1768, 1770, 1771, 1772, 1777, 1785, 1791, 1794, 1795, 1796, 1798, 1799, 1801, 1802, 1804, 1809, 1810, 1814, 1815, 1817, 1824, 1828, 1829, 1832, 1833, 1834, 1835, 1837, 1838, 1841, 1842, 1844], "casewit": 1734, "caspt2": [295, 986, 987, 988, 989, 1215, 1677, 1704, 1712, 1746, 1766, 1776, 1781], "casscf": [150, 295, 314, 381, 382, 676, 783, 828, 891, 1206, 1210, 1673, 1704, 1714, 1746, 1755, 1766, 1776, 1781, 1789, 1791, 1807, 1826, 1829, 1842], "cast": [393, 1714, 1756, 1809, 1821, 1838, 1842], "cast_up": 1752, "castabl": 2, "castup": [1714, 1842], "castup1": [1714, 1842], "castup2": [1714, 1842], "castup3": [1714, 1842], "cat": [1738, 1748, 1786, 1833], "catch": [86, 1786, 1810, 1821], "categori": [2, 1798], "cater": 1824, "cation": [660, 1206, 1704, 1714, 1757, 1768, 1833, 1837, 1842], "cation_mult": 1768, "cauchi": 1838, "caught": 1809, "caus": [11, 570, 644, 837, 1206, 1210, 1226, 1330, 1704, 1738, 1755, 1808, 1837], "caution": [150, 296, 605, 1206, 1704, 1726, 1769, 1833], "cautiou": 1802, "caveat": 1757, "caviti": [771, 772, 773, 1209, 1704, 1780, 1803], "caxi": 323, "cb": [104, 131, 150, 295, 300, 301, 302, 318, 319, 1714, 1740, 1741, 1743, 1752, 1766, 1768, 1772, 1776, 1779, 1800, 1832, 1842], "cb_subset": 150, "cbee32b": 1786, "cbs1": [1711, 1714, 1740, 1743, 1842], "cbs_func": 1779, "cbs_metadata": [284, 1740], "cbsmeta": 1768, "cbsmetadata": 1768, "cbsrec": [1740, 1794], "cc": [0, 1, 2, 11, 74, 106, 130, 150, 179, 218, 262, 265, 271, 284, 295, 296, 318, 319, 342, 376, 397, 433, 443, 447, 455, 457, 466, 473, 474, 476, 479, 483, 487, 491, 495, 496, 498, 499, 500, 507, 514, 519, 525, 529, 543, 549, 552, 568, 579, 582, 583, 584, 585, 586, 600, 606, 608, 612, 613, 646, 653, 662, 670, 671, 672, 680, 731, 789, 790, 791, 792, 796, 797, 798, 800, 801, 802, 803, 812, 868, 1063, 1069, 1076, 1079, 1080, 1086, 1106, 1154, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1206, 1208, 1213, 1218, 1219, 1221, 1224, 1225, 1231, 1236, 1242, 1244, 1629, 1669, 1675, 1680, 1683, 1684, 1692, 1694, 1704, 1707, 1708, 1710, 1711, 1714, 1715, 1716, 1719, 1720, 1723, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1735, 1738, 1739, 1740, 1741, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1779, 1780, 1782, 1783, 1784, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1814, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1828, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "cc1": [1714, 1738, 1842], "cc10": [1714, 1842], "cc11": [1714, 1842], "cc12": [1714, 1842], "cc13": [1714, 1842], "cc13a": [1714, 1842], "cc13b": [1714, 1842], "cc13c": [1714, 1842], "cc13d": [1714, 1842], "cc14": [1714, 1842], "cc15": [1714, 1842], "cc16": [1714, 1842], "cc17": [1714, 1842], "cc18": [1714, 1842], "cc19": [1714, 1842], "cc2": [0, 284, 295, 318, 319, 381, 382, 1669, 1683, 1714, 1739, 1740, 1742, 1743, 1744, 1745, 1766, 1776, 1781, 1792, 1793, 1800, 1826, 1842], "cc21": [1714, 1842], "cc22": [1714, 1842], "cc23": [1714, 1842], "cc24": [1714, 1842], "cc25": [1714, 1842], "cc26": [1714, 1842], "cc27": [1714, 1842], "cc28": [1714, 1842], "cc29": [1714, 1842], "cc3": [284, 295, 318, 319, 463, 468, 471, 504, 586, 665, 1199, 1200, 1206, 1669, 1683, 1704, 1708, 1711, 1714, 1739, 1740, 1742, 1743, 1744, 1745, 1766, 1776, 1781, 1792, 1793, 1800, 1842], "cc30": [1714, 1842], "cc31": [1714, 1842], "cc32": [1714, 1842], "cc33": [1714, 1842], "cc34": [1714, 1842], "cc35": [1714, 1842], "cc36": [1714, 1842], "cc37": [1714, 1842], "cc38": [1714, 1842], "cc39": [1714, 1842], "cc3_follow_root": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc4": [295, 1683, 1714, 1738, 1766, 1776, 1792, 1793, 1842], "cc40": [1714, 1842], "cc41": [1714, 1842], "cc42": [1714, 1842], "cc43": [1714, 1842], "cc44": [1714, 1842], "cc45": [1714, 1842], "cc46": [1714, 1842], "cc47": [1714, 1842], "cc48": [1714, 1842], "cc49": [1714, 1842], "cc4a": [1714, 1842], "cc5": [295, 1714, 1766, 1792, 1793, 1842], "cc50": [1714, 1842], "cc51": [1714, 1842], "cc52": [1714, 1842], "cc53": [1714, 1842], "cc54": [283, 333, 1714, 1726, 1842], "cc55": [1714, 1842], "cc56": [1714, 1842], "cc6": [295, 1714, 1766, 1792, 1793, 1842], "cc7": [1714, 1842], "cc8": [1714, 1842], "cc8a": [1714, 1842], "cc8b": [1714, 1842], "cc8c": [1714, 1842], "cc9": [1714, 1842], "cc9a": [1714, 1842], "cc_a_ras3_max": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc_b_ras3_max": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc_diis_max_vec": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc_diis_min_vec": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc_ex_level": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc_ex_lvl": [795, 1210, 1704], "cc_fix_extern": [0, 1, 2, 793, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc_fix_external_min": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc_full": [662, 1206, 1704], "cc_lambda": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc_macro": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc_maxit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc_mix": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc_num_thread": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc_os_scal": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc_program": 1743, "cc_ras34_max": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc_ras3_max": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc_ras4_max": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc_scale_o": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc_scale_ss": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc_ss_scale": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc_time": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc_type": [0, 1, 2, 1704, 1730, 1733, 1735, 1740, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc_update_ep": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc_val_ex_level": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc_variat": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc_vecs_read": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc_vecs_writ": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cccbdb": 1837, "cccc": 1838, "ccd": [295, 318, 319, 346, 431, 1106, 1199, 1221, 1230, 1438, 1439, 1440, 1447, 1451, 1456, 1458, 1461, 1675, 1689, 1704, 1708, 1714, 1739, 1742, 1766, 1776, 1781, 1798, 1800, 1809, 1837, 1842], "ccd_e_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ccd_maxit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ccd_t_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ccdensiti": [400, 1704, 1705, 1742], "ccdl": [1714, 1842], "ccenergi": [11, 295, 372, 400, 1158, 1221, 1704, 1705, 1709, 1714, 1739, 1755, 1766, 1792, 1832, 1842], "cceom": [11, 400, 472, 1704, 1705, 1742], "ccgradient": 11, "cchbar": [400, 1158, 1221, 1704, 1705, 1742], "ccl_energi": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cclambda": [400, 1704, 1705, 1742], "cclr": [550, 1203, 1704, 1790], "ccn": [612, 1206, 1683, 1704, 1776, 1792], "ccname": [1669, 1776], "ccnn": [1683, 1776], "ccrespons": [400, 1704, 1705, 1742], "ccsd": [11, 150, 190, 284, 295, 296, 300, 301, 302, 307, 314, 318, 319, 381, 382, 444, 446, 453, 458, 471, 482, 484, 521, 523, 545, 547, 568, 581, 586, 597, 605, 610, 662, 664, 665, 923, 951, 1067, 1068, 1075, 1083, 1084, 1085, 1087, 1092, 1093, 1106, 1199, 1200, 1202, 1203, 1205, 1206, 1213, 1219, 1221, 1224, 1227, 1229, 1235, 1241, 1375, 1399, 1402, 1669, 1670, 1675, 1680, 1683, 1688, 1692, 1704, 1711, 1714, 1720, 1721, 1723, 1724, 1726, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1752, 1755, 1766, 1769, 1772, 1776, 1777, 1781, 1790, 1791, 1792, 1793, 1794, 1798, 1799, 1800, 1803, 1826, 1828, 1829, 1832, 1838, 1842, 1844], "ccsd_no": [150, 314, 1791], "ccsd_t": [1229, 1402, 1704, 1714, 1829, 1842], "ccsd_t_": [1711, 1723, 1743], "ccsdl": [1714, 1842], "ccsdt": [295, 318, 319, 586, 665, 699, 1206, 1224, 1235, 1241, 1683, 1704, 1711, 1723, 1740, 1742, 1743, 1744, 1745, 1755, 1766, 1776, 1792, 1793, 1800], "ccsdt_q_": 1723, "ccsdtq": [295, 1224, 1235, 1241, 1683, 1704, 1742, 1755, 1766, 1776, 1792, 1793], "ccsdtqp": [295, 1766, 1792, 1793], "ccsdtqph": [295, 1766, 1792, 1793], "ccsort": [561, 1204, 1704, 1738, 1809], "cct3": [1158, 1221, 1704, 1738], "cctransort": [400, 561, 1704, 1705], "cctripl": [400, 1704, 1705, 1742], "ccwavefunct": [160, 162, 1827], "cd": [568, 575, 641, 708, 951, 1106, 1146, 1147, 1166, 1206, 1213, 1221, 1231, 1609, 1704, 1707, 1708, 1714, 1731, 1735, 1737, 1738, 1739, 1742, 1748, 1749, 1754, 1756, 1757, 1763, 1767, 1771, 1781, 1788, 1798, 1803, 1805, 1806, 1808, 1809, 1838, 1842], "cdgesv": [929, 1213, 1704], "cdomp2": [1714, 1842], "cdoremp": [1714, 1842], "cdot": [377, 1733, 1742, 1755, 1757, 1759, 1836, 1838], "cdremp": [1714, 1842], "cdsalc": [103, 1827], "cdsalclist": [103, 1827], "cdsgroup": [1738, 1788], "ce_mp2": 1834, "ce_mp25": 1834, "ce_mp3": 1834, "ceas": [1231, 1644, 1704], "cell": 1828, "center": [8, 89, 103, 106, 112, 113, 141, 158, 322, 325, 1057, 1218, 1685, 1704, 1757, 1759, 1774, 1776, 1782, 1790, 1794, 1799, 1802, 1817, 1838], "center_of_mass": 106, "centimet": 1706, "central": [1714, 1842], "cepa": [190, 284, 295, 923, 948, 1070, 1078, 1088, 1093, 1106, 1213, 1219, 1221, 1225, 1248, 1680, 1704, 1708, 1714, 1739, 1740, 1766, 1776, 1777, 1781, 1790, 1842], "cepa0": [730, 948, 1208, 1213, 1225, 1248, 1704], "cepa1": [948, 1213, 1225, 1248, 1704, 1714, 1842], "cepa2": [1714, 1842], "cepa3": [1714, 1842], "cepa_level": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cepa_no_singl": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cepa_os_scal": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cepa_sos_scal": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cepa_ss_scal": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cepa_typ": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cerjan": [635, 652, 1206, 1704], "certain": [215, 433, 466, 507, 514, 616, 882, 1199, 1200, 1201, 1202, 1206, 1210, 1225, 1231, 1242, 1620, 1704, 1730, 1738, 1740, 1742, 1743, 1747, 1752, 1755, 1767, 1795, 1799, 1802, 1829, 1832, 1833, 1837, 1838], "certainli": [605, 620, 1206, 1704, 1824, 1837], "cf": [89, 1728, 1764, 1788], "cfg": 1788, "cflow": [1692, 1752], "cfour": [8, 284, 295, 318, 319, 400, 575, 577, 581, 586, 599, 614, 620, 632, 643, 661, 682, 713, 1130, 1157, 1221, 1226, 1231, 1324, 1497, 1498, 1577, 1599, 1704, 1705, 1707, 1709, 1714, 1731, 1738, 1740, 1744, 1745, 1766, 1776, 1777, 1780, 1781, 1800, 1802, 1842], "cfour_": 1743, "cfour_abcdtyp": [0, 1, 2, 575, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_active_orbi": [0, 1, 2, 593, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_anh_algorithm": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_anh_deriv": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_anh_steps": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_anh_symmetri": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_anharmon": [0, 1, 2, 570, 573, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_ao_ladd": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_av_scf": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_basi": [0, 1, 2, 691, 1704, 1711, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_bruck_conv": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_brueckn": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_cache_rec": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_calc_level": [0, 1, 2, 586, 694, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_cc_conv": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_cc_expord": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_cc_extrapol": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_cc_maxcyc": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_cc_program": [0, 1, 2, 642, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_charg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_cis_conv": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_continuum": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_contract": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_coordin": [0, 1, 2, 637, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_core_orbit": [0, 1, 2, 569, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_cphf_conv": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_cphf_maxcyc": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_curvilinear": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_dboc": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_dct": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_deriv_level": [0, 1, 2, 586, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_diff_typ": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_dropmo": [0, 1, 2, 625, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_ecp": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_eigenvector": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_el_anharm": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_eom_nonit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_eom_nst": [655, 1206, 1704], "cfour_estate_conv": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_estate_maxcyc": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_estate_prop": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_estate_sym": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_estate_tran": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_eval_hess": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_excit": [0, 1, 2, 605, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_fc_field": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_fd_calctyp": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_fd_irrep": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_fd_project": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_fd_steps": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_fd_usegroup": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_file_recsiz": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_file_strip": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_finite_perturb": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_fock": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_freq_algorithm": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_frozen_cor": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_frozen_virt": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_gamma_abcd": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_genbas_1": [0, 1, 2, 629, 630, 631, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_genbas_2": [0, 1, 2, 630, 631, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_genbas_3": [0, 1, 2, 631, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_genbas_4": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_geo_conv": [0, 1, 2, 591, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_geo_maxcyc": [0, 1, 2, 663, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_geo_maxstep": [0, 1, 2, 649, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_geo_method": [0, 1, 2, 656, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_giao": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_grid": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_guess": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_hbar": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_hfstabl": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_incor": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_input_mrcc": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_integr": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_joda_print": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_lineq_conv": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_lineq_maxci": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_lineq_typ": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_lock_orbocc": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_maxstep": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_mem_unit": [0, 1, 2, 651, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_memori": 1743, "cfour_memory_s": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_method": [0, 1, 2, 603, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_mrcc": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_multipl": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_nacoupl": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_negev": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_newnorm": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_nonhf": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_ntop_tamp": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_occup": [0, 1, 2, 569, 593, 609, 648, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_omp_num_thread": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_open": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_opt_maxcyc": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_orbit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_pert_orb": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_point": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_print": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_prop": [0, 1, 2, 636, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_prop_integr": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_qrhf_gener": [0, 1, 2, 671, 672, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_qrhf_orbit": [0, 1, 2, 672, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_qrhf_spin": [672, 1206, 1704], "cfour_qrhfgu": [0, 1, 2, 670, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_raman_int": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_raman_orb": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_rdo": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_refer": [0, 1, 2, 586, 672, 694, 1231, 1599, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_relativist": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_relax_den": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_res_raman": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_restart_cc": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_rot_evec": [0, 1, 2, 640, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_save_int": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_scale_on": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_scf_conv": [0, 1, 2, 1231, 1497, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_scf_damp": [0, 1, 2, 1231, 1498, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_scf_expord": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_scf_expstart": [0, 1, 2, 685, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_scf_extrapol": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_scf_maxcyc": [0, 1, 2, 1231, 1577, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_sd_field": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_spher": [0, 1, 2, 577, 1157, 1221, 1704, 1711, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_spin_flip": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_spin_orbit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_spin_sc": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_spinrot": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_subgroup": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_sym_check": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_symmetri": [0, 1, 2, 696, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_t3_extrapol": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_tamp_sum": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_thermochemistri": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_trans_inv": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_treat_pert": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_uij_threshold": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_unit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_update_hessian": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_vibr": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_vtran": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_xfield": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_xform_tol": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_yfield": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_zfield": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cg": [335, 1725], "cgi": [1692, 1752], "ch": [1714, 1792, 1828, 1842, 1844], "ch2": [377, 1714, 1734, 1757, 1781, 1828, 1842, 1844], "ch2f2": 1743, "ch2o": [1692, 1752], "ch3": [1714, 1842], "ch3oh": 1782, "ch4": [1692, 1714, 1752, 1842], "chaban": [1734, 1789], "chai": [1734, 1759], "chain": [100, 1838], "chain_dot": 100, "challeng": [1692, 1752, 1755], "champion": 1757, "chan": [1692, 1752], "chanc": 1756, "chandemonium": 1738, "chang": [0, 2, 86, 106, 138, 150, 192, 193, 203, 204, 220, 267, 276, 277, 326, 328, 342, 356, 383, 455, 473, 499, 529, 552, 582, 648, 684, 692, 738, 829, 833, 1070, 1076, 1088, 1096, 1125, 1126, 1129, 1199, 1200, 1202, 1203, 1206, 1208, 1210, 1219, 1221, 1226, 1231, 1330, 1331, 1332, 1350, 1507, 1704, 1730, 1738, 1742, 1743, 1748, 1750, 1754, 1757, 1762, 1764, 1767, 1770, 1771, 1785, 1787, 1790, 1792, 1795, 1801, 1804, 1808, 1824, 1828, 1833, 1834, 1835, 1837, 1838, 1844], "change_file_namespac": [86, 1837], "changeabl": 1776, "changedonli": 370, "changelog": 1788, "channel": [1736, 1737, 1738, 1748, 1785, 1787, 1816, 1825], "chaotic": 1838, "chapter": [1734, 1770], "char": [386, 1772, 1786, 1810], "char_tabl": 120, "charact": [2, 17, 81, 91, 285, 313, 336, 364, 373, 391, 392, 829, 1210, 1704, 1743, 1753, 1756, 1759, 1764, 1776, 1787, 1802, 1814, 1835, 1844], "character": 1759, "characterist": [761, 774, 1209, 1704, 1706, 1754, 1764, 1767], "characteristic_impedance_of_vacuum": 1706, "charactert": [120, 1827], "charg": [73, 103, 106, 150, 255, 262, 263, 274, 275, 295, 587, 983, 1015, 1034, 1058, 1125, 1206, 1214, 1216, 1218, 1221, 1227, 1228, 1229, 1376, 1380, 1400, 1685, 1692, 1704, 1706, 1714, 1734, 1743, 1749, 1752, 1754, 1757, 1766, 1768, 1771, 1776, 1782, 1785, 1790, 1794, 1799, 1803, 1805, 1817, 1828, 1833, 1835, 1838, 1842, 1844], "chat": 1804, "chdir": 1788, "cheap": [1753, 1756], "cheaper": [295, 1757, 1766, 1771, 1792, 1793, 1817], "cheapest": [295, 1766, 1792, 1793], "cheatsheet": 1820, "check": [0, 2, 11, 84, 86, 106, 284, 342, 356, 392, 443, 479, 519, 543, 647, 681, 751, 752, 754, 755, 756, 757, 1199, 1200, 1202, 1203, 1206, 1208, 1226, 1231, 1328, 1649, 1704, 1710, 1711, 1714, 1726, 1730, 1738, 1740, 1747, 1748, 1759, 1764, 1770, 1774, 1781, 1786, 1788, 1808, 1817, 1821, 1832, 1833, 1838, 1842], "check_nam": 2, "check_phas": 84, "checkfortrancompilerflag": 1738, "checkout": 1788, "checkpoint": [2, 285, 336, 991, 996, 1215, 1231, 1560, 1704, 1714, 1746, 1767, 1769, 1775, 1842], "checkrun": [1714, 1842], "chem": [356, 443, 479, 519, 543, 885, 1199, 1200, 1202, 1203, 1210, 1225, 1230, 1256, 1469, 1692, 1704, 1714, 1715, 1722, 1734, 1740, 1752, 1762, 1781, 1837, 1842], "chemi": [106, 1759, 1774], "chemic": [1, 669, 695, 703, 1206, 1704, 1734, 1740, 1742, 1746, 1749, 1752, 1755, 1757, 1759, 1762, 1765, 1770, 1775, 1781, 1803, 1833, 1834, 1838], "chemist": [1756, 1757, 1781, 1833, 1837, 1838], "chemistri": [2, 265, 284, 608, 1206, 1232, 1666, 1704, 1734, 1738, 1740, 1743, 1748, 1752, 1756, 1757, 1771, 1781, 1782, 1794, 1797, 1810, 1827, 1828, 1837, 1838, 1841, 1843, 1844], "chemps2": [181, 295, 400, 993, 1215, 1677, 1704, 1736, 1738, 1748, 1766, 1777, 1780, 1781, 1785, 1842], "chemps2_dir": 1746, "chemps2config": 1746, "chenei": 1734, "cheng": [1714, 1734, 1781, 1836, 1842], "cherri": 1788, "chg": [267, 1759], "chgmult": [106, 1833], "chi": 1837, "chi_": [1750, 1763, 1836, 1837], "chi_0": 1837, "chi_1": 1829, "chi_2": 1829, "chi_mu": 110, "chi_nu": 110, "child": 1840, "chim": 1734, "chip": 1737, "chipset": 1839, "chiral": [1714, 1842], "chlorid": [1754, 1833], "chmod": 1738, "choic": [402, 539, 650, 662, 668, 681, 715, 1197, 1203, 1206, 1207, 1704, 1737, 1738, 1742, 1752, 1753, 1757, 1763, 1771, 1824, 1828, 1835, 1836, 1838, 1840, 1844], "choleski": [0, 1, 2, 100, 916, 1072, 1076, 1219, 1230, 1231, 1443, 1486, 1600, 1704, 1714, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "cholesky_factor": 100, "cholesky_toler": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "choos": [2, 393, 671, 708, 730, 1206, 1208, 1704, 1735, 1736, 1748, 1767, 1781, 1798, 1802, 1833, 1838], "choosen": [946, 1213, 1225, 1281, 1704], "chose": 1730, "chosen": [318, 319, 377, 570, 612, 620, 637, 638, 679, 772, 1084, 1206, 1209, 1219, 1231, 1569, 1615, 1704, 1754, 1756, 1757, 1771, 1800, 1802, 1828, 1829, 1833, 1837, 1838, 1844], "chown": [265, 1738, 1740, 1794], "chrgfield": 1838, "christoph": 1734, "chunk": 1817, "ci": [0, 2, 13, 284, 295, 296, 314, 476, 499, 500, 588, 612, 641, 692, 696, 786, 804, 807, 808, 811, 819, 820, 821, 827, 828, 829, 833, 837, 839, 842, 844, 859, 860, 870, 871, 876, 881, 882, 883, 884, 885, 890, 891, 993, 995, 1107, 1164, 1165, 1173, 1182, 1200, 1206, 1210, 1215, 1221, 1222, 1224, 1236, 1673, 1704, 1708, 1712, 1714, 1725, 1729, 1734, 1735, 1739, 1740, 1743, 1746, 1754, 1766, 1769, 1776, 1777, 1780, 1786, 1788, 1789, 1790, 1791, 1810, 1823, 1833, 1842], "ci100219f": [1714, 1842], "ci5": [295, 300, 301, 302, 318, 319, 381, 382, 1766, 1772, 1800, 1826], "ci6": 1755, "ci_dii": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ci_file_start": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ci_maxit": [0, 1, 2, 842, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ci_nat_orb": 13, "ci_num_thread": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ci_typ": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ciblks_print": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cid": [1107, 1221, 1704, 1833], "cin": [1673, 1776], "circ": 268, "circa": 1837, "circul": 1706, "circular": [368, 377, 1790], "circumst": [1767, 1770, 1789], "circumv": 1767, "cisd": [284, 295, 381, 382, 860, 875, 1078, 1107, 1210, 1219, 1221, 1673, 1680, 1704, 1714, 1739, 1740, 1742, 1755, 1766, 1771, 1776, 1781, 1826, 1842], "cisd_": [295, 1766], "cisd_wfn": [295, 1766], "cisdt": [284, 295, 381, 382, 1673, 1740, 1755, 1766, 1776, 1826], "cisdtq": [284, 295, 381, 382, 1673, 1740, 1755, 1766, 1776, 1826], "cist": [819, 1210, 1704], "citat": [68, 80, 96, 138, 267, 1692, 1730, 1733, 1752, 1757, 1759, 1781, 1786], "cite": [0, 1753, 1777, 1798, 1836, 1837], "civect": [804, 1210, 1704], "civector": [13, 1827], "ciwavefunct": [150, 314, 1791, 1827], "ck": 133, "ckel": [1781, 1838], "cl": [293, 1707, 1731], "clamp": 1838, "clang": [1738, 1748, 1777, 1781, 1808, 1814, 1822], "clang401": 1738, "clang_osx": 1738, "clangxx": 1738, "clangxx_osx": 1738, "clarif": 1801, "clarifi": [671, 1206, 1704, 1743, 1828, 1844], "clariti": 1822, "clark": 1734, "clash": [1743, 1832], "class": [3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 26, 27, 28, 29, 30, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 183, 184, 233, 265, 267, 273, 274, 275, 293, 310, 315, 316, 321, 322, 323, 324, 325, 326, 327, 329, 331, 361, 882, 1210, 1226, 1367, 1692, 1704, 1714, 1740, 1743, 1752, 1755, 1756, 1757, 1759, 1767, 1768, 1772, 1783, 1794, 1797, 1801, 1817, 1819, 1823, 1824, 1832, 1833, 1838, 1842], "classchemps2_1_1irrep": [993, 1215, 1704, 1746], "classic": [267, 1706, 1738, 1759, 1774], "classical_electron_radiu": 1706, "classif": [1058, 1218, 1704], "classifi": 1776, "classmethod": [64, 100, 106, 148], "claus": [1781, 1806], "clean": [2, 84, 87, 106, 169, 1230, 1483, 1704, 1714, 1735, 1743, 1757, 1767, 1782, 1788, 1817, 1831, 1833, 1837, 1838, 1842], "clean_opt": [1788, 1832], "clean_tim": 1788, "clean_vari": [1743, 1832], "cleaner": 1738, "cleanup": [844, 849, 1210, 1704, 1734], "cleanup_ci": 13, "cleanup_dpd": 13, "clear": [5, 18, 73, 84, 106, 111, 147, 235, 236, 357, 1738, 1743, 1801, 1822, 1824, 1832, 1844], "clear_al": 27, "clear_collocation_cach": 147, "clear_d_prev": 18, "clear_external_cpscf_perturb": 84, "clear_external_potenti": 84, "clear_spac": 27, "clearli": [609, 1206, 1704], "clebsch": 1837, "clever": [786, 1210, 1704, 1743, 1757], "cli": [2, 1788], "click": [1743, 1748, 1788, 1822], "client": [265, 1740, 1772, 1794], "clobber": 1801, "clockwis": 139, "clone": [88, 100, 106, 148, 1736, 1738, 1747, 1748, 1767, 1786, 1788, 1805, 1806, 1817], "close": [86, 87, 106, 172, 188, 223, 224, 586, 681, 865, 1206, 1210, 1224, 1238, 1704, 1714, 1739, 1750, 1753, 1755, 1756, 1757, 1771, 1786, 1788, 1802, 1809, 1828, 1833, 1835, 1837, 1838, 1842, 1844], "close_io_fil": 12, "closer": 1838, "closest": [829, 1210, 1704, 1761], "clpse": [1714, 1842], "clue": 367, "cluster": [95, 140, 160, 161, 162, 164, 165, 166, 167, 232, 284, 295, 318, 319, 381, 382, 436, 437, 440, 457, 530, 788, 794, 1120, 1198, 1199, 1200, 1201, 1202, 1204, 1221, 1222, 1229, 1669, 1673, 1682, 1688, 1704, 1714, 1724, 1740, 1741, 1743, 1744, 1745, 1748, 1753, 1766, 1776, 1777, 1790, 1794, 1800, 1824, 1826, 1829, 1832, 1837, 1842, 1844], "clutter": [2, 1801], "cm": [106, 265, 377, 386, 390, 1706, 1740, 1761, 1772, 1776, 1794, 1828, 1844], "cmake": [1, 2, 1735, 1736, 1746, 1748, 1749, 1754, 1762, 1764, 1765, 1767, 1773, 1775, 1777, 1782, 1783, 1784, 1785, 1788, 1803, 1808, 1815, 1823, 1839], "cmake_build_typ": 1738, "cmake_c_compil": 1738, "cmake_c_flag": 1738, "cmake_current_binary_dir": 2, "cmake_current_source_dir": 1738, "cmake_cxx_compil": 1738, "cmake_cxx_flag": 1738, "cmake_cxx_standard": 1738, "cmake_disable_find_package_": 1738, "cmake_disable_find_package_chemps2": 1746, "cmake_disable_find_package_dkh": 1762, "cmake_disable_find_package_ecpint": 1765, "cmake_disable_find_package_gau2grid": 1773, "cmake_disable_find_package_gdma": 1775, "cmake_disable_find_package_libefp": 1782, "cmake_disable_find_package_libint2": 1783, "cmake_disable_find_package_libxc": 1784, "cmake_disable_find_package_pcmsolv": 1803, "cmake_disable_find_package_simint": 1839, "cmake_fortran_compil": 1738, "cmake_fortran_flag": 1738, "cmake_gener": 1738, "cmake_insist_find_package_": [1738, 1788], "cmake_insist_find_package_chemps2": 1746, "cmake_insist_find_package_dkh": 1762, "cmake_insist_find_package_ecpint": 1765, "cmake_insist_find_package_gau2grid": 1773, "cmake_insist_find_package_gdma": 1775, "cmake_insist_find_package_libefp": 1782, "cmake_insist_find_package_libint2": 1783, "cmake_insist_find_package_libxc": 1784, "cmake_insist_find_package_pcmsolv": 1803, "cmake_insist_find_package_simint": 1839, "cmake_install_bindir": 1738, "cmake_install_datadir": 1738, "cmake_install_includedir": 1738, "cmake_install_libdir": 1738, "cmake_install_prefix": [2, 1738], "cmake_module_path": 1738, "cmake_polici": 1738, "cmake_prefix_path": [1738, 1746, 1762, 1765, 1773, 1775, 1782, 1783, 1784, 1803, 1808, 1839], "cmake_vers": 1738, "cmakecach": 1738, "cmakefil": 1808, "cmakelist": [1738, 1764, 1783, 1785, 1788, 1804, 1808, 1823], "cmat": 90, "cmath": 159, "cmbi": [2, 287, 338, 388, 1791], "cmd": [1748, 1788], "cmp0167": 1738, "cn": [1692, 1714, 1752, 1842], "cnv": 106, "co": [444, 482, 521, 545, 1199, 1200, 1202, 1203, 1692, 1704, 1707, 1731, 1752, 1759, 1829], "co2": [1692, 1714, 1752, 1842], "coars": [1750, 1817], "codata": 1832, "code": [0, 1, 2, 89, 106, 160, 161, 162, 163, 164, 165, 166, 167, 173, 177, 178, 179, 180, 181, 185, 186, 190, 208, 209, 210, 215, 216, 217, 218, 222, 231, 232, 237, 267, 279, 295, 297, 308, 323, 347, 392, 434, 457, 607, 641, 697, 827, 829, 882, 1104, 1124, 1125, 1199, 1204, 1206, 1210, 1221, 1231, 1670, 1690, 1704, 1708, 1713, 1714, 1725, 1730, 1735, 1740, 1742, 1743, 1746, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1773, 1774, 1775, 1776, 1777, 1781, 1782, 1783, 1784, 1785, 1787, 1789, 1791, 1792, 1794, 1797, 1798, 1799, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1814, 1815, 1817, 1818, 1821, 1822, 1828, 1829, 1831, 1832, 1833, 1834, 1836, 1837, 1838, 1839, 1841, 1842, 1843, 1844], "codebas": [2, 1737, 1738, 1759, 1777, 1787, 1788, 1814, 1817], "codedep": 1738, "codemeta": 1788, "coder": 1739, "codeset": 1738, "coef": [73, 81, 134], "coeff": [19, 1708], "coeffic": [1182, 1222, 1704], "coeffici": [19, 73, 81, 97, 103, 115, 118, 130, 134, 368, 369, 704, 827, 829, 842, 978, 979, 1029, 1173, 1175, 1206, 1210, 1214, 1218, 1222, 1225, 1230, 1268, 1270, 1442, 1704, 1714, 1755, 1757, 1759, 1776, 1789, 1791, 1798, 1829, 1837, 1838, 1842], "coffe": [273, 284, 351, 370, 381, 382, 1740, 1743, 1752, 1826, 1840], "cohes": 1785, "coincid": [106, 1743], "col": 100, "colatitud": [1231, 1659, 1704], "coldim": [100, 183, 184], "collabor": 1757, "collaps": [277, 342, 356, 470, 808, 842, 1200, 1210, 1704, 1714, 1739, 1743, 1833, 1842], "collapse_s": [0, 1, 2, 842, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "collapse_with_last": [0, 1, 2, 471, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "collapse_with_last_cc3": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "collect": [2, 327, 328, 342, 344, 356, 357, 371, 1226, 1347, 1692, 1704, 1738, 1743, 1748, 1752, 1772, 1787, 1794, 1834, 1835, 1840], "collinear": [1226, 1335, 1704], "colloc": [105, 147, 1773], "collocation_s": 105, "colon": [1767, 1782], "color": [323, 1738, 1750, 1770, 1786], "color1": 1750, "color2": 1750, "column": [0, 2, 100, 183, 184, 1138, 1221, 1226, 1362, 1704, 1730, 1733, 1740, 1755, 1775, 1776, 1810, 1817, 1832], "colwel": 1734, "com": [372, 561, 1204, 1692, 1704, 1735, 1737, 1738, 1746, 1748, 1751, 1752, 1759, 1781, 1782, 1784, 1785, 1786, 1788, 1799, 1805, 1806, 1822, 1833, 1837], "com_fix": 106, "combat": [1757, 1838], "combin": [16, 106, 115, 143, 144, 158, 284, 346, 569, 593, 1125, 1206, 1221, 1226, 1231, 1339, 1663, 1704, 1714, 1739, 1740, 1743, 1748, 1750, 1753, 1755, 1757, 1759, 1771, 1774, 1779, 1781, 1782, 1802, 1805, 1809, 1810, 1817, 1828, 1833, 1835, 1836, 1837, 1838, 1842, 1843], "combo": 1785, "come": [150, 1157, 1221, 1704, 1714, 1738, 1743, 1756, 1757, 1764, 1781, 1782, 1808, 1810, 1817, 1828, 1838, 1842, 1844], "comma": [671, 1206, 1704, 1730, 1733, 1743, 1844], "command": [2, 235, 236, 284, 303, 351, 370, 581, 586, 599, 614, 650, 651, 661, 1206, 1224, 1240, 1704, 1730, 1736, 1737, 1740, 1743, 1747, 1750, 1768, 1770, 1772, 1775, 1777, 1779, 1786, 1788, 1796, 1800, 1801, 1808, 1810, 1828, 1832, 1833, 1834, 1838, 1844], "commandsinsteaddict": 370, "commenc": 1743, "comment": [2, 106, 304, 386, 1206, 1692, 1730, 1740, 1743, 1750, 1752, 1764, 1768, 1772, 1786, 1788, 1801, 1808, 1817, 1834, 1835, 1844], "commit": [279, 1738, 1747, 1785, 1786, 1788, 1804], "common": [0, 149, 159, 195, 197, 393, 1738, 1740, 1742, 1743, 1755, 1756, 1757, 1767, 1781, 1782, 1785, 1790, 1802, 1810, 1828, 1833, 1836, 1837, 1838, 1839, 1844], "common_model": [265, 1740, 1772, 1794], "commonli": [0, 342, 1738, 1763, 1789, 1829, 1832, 1834, 1838], "commun": [297, 347, 1734, 1743, 1777, 1781, 1785, 1816, 1818], "commut": [89, 103], "comp": [297, 347, 443, 479, 519, 543, 619, 1199, 1200, 1202, 1203, 1206, 1692, 1704, 1734, 1752, 1781], "compact": [1736, 1757, 1763, 1767, 1771, 1782, 1817, 1838], "compani": 1748, "companion": [1781, 1829], "compar": [2, 285, 286, 287, 336, 337, 338, 383, 1711, 1714, 1743, 1753, 1755, 1757, 1770, 1781, 1783, 1832, 1834, 1837, 1838, 1842], "compare_": [2, 1788], "compare_arrai": 2, "compare_cub": 2, "compare_fchkfil": 2, "compare_fcidump": 2, "compare_integ": 2, "compare_matric": 2, "compare_moldenfil": 2, "compare_molrec": 2, "compare_recurs": 2, "compare_str": 2, "compare_valu": [2, 278, 1738, 1833], "compare_vector": 2, "compare_vibinfo": 2, "compare_wavefunct": 2, "comparison": [278, 285, 286, 287, 336, 337, 338, 1714, 1717, 1753, 1777, 1837, 1842], "compat": [296, 1737, 1738, 1763, 1769, 1781, 1804, 1817, 1837], "compatibli": 1767, "compchem": [2, 285, 296, 336, 1769], "compens": [1770, 1802, 1837], "competit": [1743, 1838], "compil": [106, 1129, 1221, 1231, 1629, 1704, 1736, 1737, 1759, 1767, 1771, 1774, 1777, 1781, 1783, 1785, 1786, 1788, 1819, 1821, 1828, 1831, 1838, 1839, 1842, 1844], "compilervar": 1738, "complain": [1743, 1808], "complaint": [284, 1740], "complement": [89, 1785], "complementari": [306, 307, 1772, 1800], "complet": [8, 84, 106, 267, 295, 318, 319, 443, 479, 519, 543, 570, 676, 729, 885, 1034, 1199, 1200, 1202, 1203, 1206, 1208, 1210, 1218, 1229, 1231, 1405, 1499, 1616, 1673, 1704, 1714, 1730, 1738, 1742, 1743, 1746, 1752, 1753, 1755, 1757, 1759, 1766, 1767, 1770, 1774, 1776, 1777, 1779, 1781, 1786, 1788, 1789, 1790, 1799, 1800, 1802, 1809, 1818, 1828, 1829, 1831, 1832, 1833, 1837, 1838, 1840, 1842, 1844], "complete_basis_set": [284, 1740], "complex": [2, 385, 386, 472, 1200, 1692, 1704, 1711, 1714, 1730, 1743, 1752, 1755, 1757, 1768, 1771, 1772, 1781, 1794, 1802, 1817, 1824, 1828, 1831, 1832, 1833, 1837, 1841, 1842, 1844], "complex_toler": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "complianc": [1738, 1781], "compliant": [296, 1738, 1769], "complic": [2, 303, 608, 1206, 1704, 1738, 1740, 1743, 1755, 1757, 1775, 1789, 1810, 1833, 1837, 1838, 1844], "compon": [0, 111, 134, 284, 295, 390, 458, 459, 657, 694, 709, 711, 712, 865, 884, 921, 1199, 1205, 1206, 1210, 1213, 1230, 1453, 1673, 1704, 1711, 1714, 1722, 1738, 1740, 1755, 1756, 1766, 1770, 1771, 1775, 1776, 1780, 1781, 1794, 1799, 1808, 1817, 1828, 1829, 1832, 1835, 1836, 1837, 1838, 1841, 1842, 1844], "compos": [292, 343, 1752, 1794, 1837, 1838], "composit": [106, 284, 295, 318, 319, 1695, 1698, 1699, 1700, 1701, 1703, 1740, 1758, 1766, 1768, 1771, 1774, 1781, 1782, 1784, 1800, 1838], "compositecomput": [1740, 1768, 1794], "compositejk": 1827, "compound": [685, 1206, 1704, 1743, 1752, 1776, 1833], "comprehend": 1838, "comprehens": [1692, 1752, 1781], "compress": [100, 148, 367], "compris": [1764, 1771, 1794, 1832], "comptc": [1714, 1842], "compton": 1706, "compton_wavelength": 1706, "compton_wavelength_over_2_pi": 1706, "compuat": 1837, "comput": [0, 1, 2, 4, 13, 21, 26, 61, 65, 68, 69, 70, 71, 72, 73, 76, 84, 87, 89, 92, 93, 94, 95, 100, 103, 106, 107, 109, 110, 111, 112, 116, 121, 127, 138, 140, 141, 142, 143, 144, 147, 150, 160, 199, 243, 251, 259, 265, 267, 278, 284, 285, 286, 287, 288, 289, 294, 295, 300, 301, 302, 307, 309, 312, 314, 317, 318, 319, 329, 336, 337, 338, 339, 340, 342, 345, 352, 356, 360, 365, 368, 369, 370, 377, 381, 382, 383, 386, 387, 399, 403, 416, 418, 419, 422, 425, 430, 446, 471, 472, 474, 475, 483, 484, 489, 490, 504, 508, 509, 526, 527, 531, 539, 569, 575, 581, 586, 593, 599, 600, 608, 609, 615, 616, 655, 660, 668, 669, 675, 678, 695, 698, 707, 726, 727, 731, 732, 733, 742, 743, 750, 756, 758, 775, 776, 788, 794, 801, 810, 817, 836, 860, 861, 866, 872, 875, 887, 888, 892, 895, 896, 899, 901, 909, 917, 921, 922, 925, 935, 940, 942, 952, 963, 1012, 1014, 1015, 1016, 1017, 1019, 1020, 1041, 1071, 1073, 1074, 1076, 1078, 1096, 1099, 1106, 1107, 1108, 1111, 1112, 1120, 1125, 1132, 1146, 1147, 1148, 1149, 1155, 1156, 1158, 1166, 1167, 1186, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1244, 1256, 1258, 1259, 1260, 1261, 1262, 1264, 1268, 1276, 1278, 1295, 1296, 1323, 1394, 1398, 1399, 1403, 1406, 1411, 1417, 1420, 1423, 1428, 1429, 1435, 1436, 1441, 1445, 1446, 1448, 1449, 1450, 1452, 1454, 1459, 1460, 1461, 1464, 1465, 1466, 1467, 1502, 1568, 1596, 1649, 1658, 1666, 1668, 1669, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1682, 1684, 1686, 1687, 1688, 1690, 1692, 1704, 1708, 1711, 1713, 1714, 1715, 1716, 1718, 1725, 1726, 1730, 1734, 1735, 1737, 1738, 1739, 1740, 1742, 1743, 1750, 1752, 1753, 1754, 1756, 1757, 1759, 1761, 1762, 1766, 1767, 1768, 1769, 1771, 1772, 1774, 1775, 1776, 1779, 1781, 1782, 1785, 1786, 1788, 1790, 1791, 1792, 1794, 1795, 1798, 1799, 1800, 1801, 1802, 1809, 1810, 1817, 1821, 1824, 1826, 1828, 1829, 1831, 1832, 1833, 1834, 1836, 1838, 1840, 1841, 1842, 1843, 1844], "comput_s2": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "computation": [874, 1210, 1704, 1755, 1771, 1785, 1837], "compute_": 84, "compute_afock": 133, "compute_dens": 21, "compute_df": 61, "compute_energi": [68, 84, 150, 267], "compute_esp_over_grid_in_memori": 70, "compute_field_over_grid_in_memori": 70, "compute_fock_like_matric": 90, "compute_funct": [7, 80, 138], "compute_fvpi": 84, "compute_gradi": [68, 147, 150, 267], "compute_guess": 131, "compute_hessain": 147, "compute_hessian": [68, 150, 267], "compute_hk": 133, "compute_initial_": 84, "compute_list": [1740, 1794], "compute_mp4_tripl": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "compute_orbit": 21, "compute_orbital_gradi": [14, 84, 128, 130, 145], "compute_pair": 1817, "compute_phi": 8, "compute_point": 119, "compute_product": 329, "compute_properti": 21, "compute_q": 133, "compute_qk": 133, "compute_shel": [112, 141, 143, 144], "compute_shell_block": 1817, "compute_spin_contamin": 84, "compute_state_transf": 13, "compute_thc_factor": 94, "compute_tripl": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "compute_v": 147, "compute_vx": 147, "computed_shells_per_it": 92, "computeexternexterninteract": 73, "computenuclearenergi": 73, "computepotentialmatrix": 73, "con": 1838, "concaten": [380, 1768], "conceiv": [833, 1210, 1704], "concern": [106, 1763, 1771, 1779, 1801], "concern_mol": 106, "concert": [1756, 1757, 1838], "concienti": 2, "concis": 1754, "concomitantli": 1833, "concret": [1743, 1824], "concur": 1743, "concurr": 1759, "cond": 1785, "conda": [1, 1736, 1746, 1747, 1749, 1754, 1759, 1762, 1764, 1765, 1767, 1773, 1774, 1775, 1777, 1781, 1782, 1783, 1784, 1785, 1803, 1806, 1807, 1819, 1828, 1839], "conda_build_config": 1788, "conda_cos6": 1738, "conda_prefix": [1738, 1767], "condadist": 1738, "condadoc": 1786, "condarc": 1748, "condens": [284, 1740], "condit": [2, 100, 106, 268, 300, 301, 302, 326, 327, 390, 1055, 1218, 1231, 1506, 1620, 1704, 1738, 1753, 1756, 1757, 1771, 1772, 1785, 1798, 1809, 1838], "condition": 1785, "conduct": [1706, 1777, 1818], "conductance_quantum": 1706, "conductor": 1754, "conf": 1788, "conf_spac": 1805, "confid": [2, 1786], "config": [1738, 1747, 1748, 1765, 1783, 1788], "configdir": [1746, 1762, 1765, 1773, 1775, 1782, 1783, 1784, 1839], "configur": [177, 265, 295, 308, 310, 361, 381, 382, 676, 1071, 1182, 1206, 1210, 1219, 1222, 1229, 1432, 1673, 1704, 1735, 1740, 1742, 1747, 1748, 1764, 1766, 1768, 1776, 1777, 1780, 1788, 1790, 1794, 1805, 1808, 1826, 1829, 1832, 1838, 1844], "confin": 1743, "confirm": [2, 106, 1714, 1771, 1842], "conflict": [1736, 1743, 1747, 1767, 1804, 1814], "conform": [1785, 1838], "conftest": [2, 1788], "confus": [392, 671, 993, 1206, 1215, 1704, 1738, 1746, 1764, 1767, 1837], "conjug": [335, 946, 949, 950, 1213, 1225, 1281, 1285, 1286, 1704, 1753, 1757], "conjunct": [576, 1206, 1704, 1752, 1833, 1838], "connect": [0, 106, 308, 426, 592, 1198, 1206, 1226, 1303, 1341, 1704, 1734, 1737, 1738, 1768, 1770, 1771, 1781, 1798, 1802, 1829, 1833], "consecut": [1224, 1226, 1241, 1302, 1704, 1788], "consecutive_backstep": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "consensu": 1804, "consequ": [1763, 1767, 1798, 1810], "consequenti": 1838, "conserv": [1226, 1230, 1305, 1455, 1704, 1837], "consid": [0, 88, 148, 575, 582, 594, 625, 681, 684, 1183, 1206, 1222, 1225, 1231, 1288, 1591, 1704, 1737, 1738, 1743, 1757, 1768, 1771, 1776, 1785, 1788, 1809, 1817, 1824, 1828, 1829, 1833, 1838, 1844], "consider": [457, 623, 666, 1199, 1206, 1704, 1742, 1752, 1754, 1757, 1770, 1798, 1835, 1837, 1838], "consist": [0, 1, 295, 318, 319, 381, 382, 1210, 1231, 1673, 1690, 1714, 1734, 1743, 1747, 1753, 1755, 1760, 1766, 1770, 1771, 1776, 1777, 1781, 1782, 1785, 1786, 1790, 1800, 1802, 1817, 1821, 1826, 1829, 1833, 1837, 1838, 1840, 1842], "consol": 1750, "consolid": 1838, "const": 1817, "constant": [8, 106, 307, 368, 369, 386, 390, 400, 573, 574, 596, 614, 615, 618, 669, 679, 690, 707, 779, 780, 1206, 1209, 1226, 1338, 1342, 1704, 1714, 1743, 1754, 1755, 1763, 1764, 1767, 1772, 1777, 1817, 1828, 1831, 1838, 1842, 1844], "constitu": 64, "constrain": [1226, 1357, 1358, 1359, 1360, 1704, 1714, 1753, 1757, 1781, 1790, 1798, 1838, 1842], "constraint": [1231, 1620, 1704, 1714, 1788, 1802, 1838, 1842], "constrast": 1770, "construct": [0, 1, 8, 14, 92, 100, 106, 115, 128, 130, 145, 147, 148, 150, 295, 381, 382, 623, 837, 1197, 1206, 1210, 1231, 1521, 1668, 1704, 1714, 1726, 1730, 1734, 1738, 1753, 1755, 1763, 1766, 1770, 1771, 1776, 1782, 1788, 1790, 1797, 1801, 1802, 1817, 1823, 1826, 1835, 1836, 1837, 1842], "construct_from_pydict": 8, "constructor": [106, 1714, 1726, 1748, 1788, 1810, 1817, 1842], "consult": [2, 381, 382, 1730, 1733, 1736, 1737, 1738, 1739, 1743, 1748, 1752, 1759, 1770, 1826, 1828, 1832], "consum": 1818, "contact": [614, 669, 1206, 1704, 1735, 1770, 1837, 1838], "contain": [1, 2, 8, 17, 81, 92, 97, 106, 115, 120, 138, 150, 295, 296, 313, 364, 374, 377, 383, 395, 628, 829, 1027, 1065, 1123, 1127, 1128, 1130, 1168, 1206, 1210, 1217, 1219, 1221, 1226, 1304, 1336, 1704, 1708, 1714, 1726, 1730, 1735, 1736, 1738, 1743, 1746, 1749, 1750, 1752, 1754, 1755, 1756, 1757, 1762, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1775, 1782, 1783, 1784, 1786, 1791, 1792, 1799, 1801, 1802, 1803, 1808, 1817, 1823, 1828, 1829, 1833, 1835, 1837, 1838, 1839, 1841, 1842, 1844], "contamin": [1756, 1757, 1828, 1838, 1844], "content": [5, 86, 376, 397, 1228, 1393, 1704, 1708, 1738, 1740, 1743, 1749, 1767, 1772, 1788, 1794, 1804, 1832], "context": [288, 289, 328, 339, 340, 357, 1755, 1785, 1801, 1810, 1837, 1838], "contigu": 1810, "continu": [2, 584, 606, 656, 1206, 1704, 1738, 1752, 1759, 1774, 1788, 1802, 1817, 1838, 1840], "continum": 1780, "continuous_guess": 1768, "continuum": [589, 1206, 1209, 1227, 1672, 1686, 1704, 1742, 1748, 1754, 1776, 1780], "contiuum": 1738, "contract": [8, 13, 81, 103, 590, 628, 1206, 1704, 1708, 1743, 1781, 1817, 1829, 1838], "contradict": 1743, "contradictori": 1743, "contrari": 1746, "contrast": [2, 1743, 1754, 1776, 1804, 1838], "contribut": [61, 73, 106, 147, 284, 346, 372, 575, 614, 669, 677, 690, 835, 1073, 1074, 1095, 1206, 1210, 1219, 1225, 1229, 1230, 1231, 1288, 1296, 1413, 1455, 1460, 1650, 1704, 1714, 1737, 1740, 1742, 1753, 1756, 1757, 1759, 1770, 1771, 1776, 1777, 1781, 1782, 1785, 1788, 1794, 1798, 1817, 1825, 1828, 1836, 1837, 1838, 1841, 1842, 1844], "contributor": [346, 1756, 1786, 1788], "contriv": 1838, "control": [2, 84, 150, 282, 295, 303, 314, 318, 319, 332, 346, 376, 383, 397, 572, 575, 605, 623, 627, 637, 640, 644, 645, 667, 683, 685, 692, 695, 727, 728, 736, 745, 746, 747, 749, 754, 1125, 1208, 1221, 1225, 1293, 1490, 1658, 1704, 1737, 1738, 1740, 1743, 1744, 1745, 1753, 1754, 1755, 1757, 1763, 1766, 1767, 1770, 1771, 1775, 1777, 1785, 1788, 1791, 1795, 1798, 1799, 1800, 1802, 1809, 1828, 1833, 1838, 1841], "contruct": [443, 479, 519, 543, 1199, 1200, 1202, 1203, 1704], "conv": [0, 1, 408, 415, 432, 439, 455, 472, 473, 491, 496, 499, 500, 529, 552, 722, 732, 736, 737, 739, 740, 747, 752, 754, 777, 818, 841, 850, 854, 858, 876, 893, 903, 904, 905, 916, 924, 930, 935, 949, 953, 958, 967, 971, 973, 976, 1029, 1030, 1053, 1054, 1072, 1079, 1085, 1086, 1106, 1107, 1113, 1131, 1137, 1140, 1146, 1147, 1174, 1178, 1197, 1198, 1199, 1200, 1202, 1203, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1218, 1219, 1221, 1222, 1224, 1225, 1226, 1228, 1229, 1230, 1231, 1233, 1234, 1257, 1266, 1285, 1287, 1290, 1301, 1328, 1335, 1349, 1350, 1351, 1364, 1365, 1389, 1410, 1424, 1438, 1440, 1442, 1455, 1462, 1486, 1487, 1488, 1489, 1497, 1498, 1514, 1520, 1545, 1552, 1567, 1569, 1572, 1573, 1600, 1602, 1603, 1604, 1605, 1621, 1622, 1627, 1638, 1644, 1648, 1654, 1704, 1714, 1739, 1742, 1743, 1749, 1754, 1755, 1771, 1781, 1785, 1789, 1798, 1809, 1837, 1841, 1842], "conv_tol": 84, "convcrit": [1714, 1842], "convei": [266, 279], "conveni": [295, 991, 993, 1010, 1215, 1704, 1733, 1740, 1743, 1746, 1748, 1763, 1766, 1767, 1771, 1776, 1782, 1801, 1809, 1810, 1832, 1833, 1836, 1838, 1844], "convent": [11, 106, 288, 289, 339, 340, 823, 993, 1095, 1210, 1213, 1215, 1219, 1225, 1675, 1684, 1704, 1706, 1714, 1730, 1738, 1739, 1742, 1743, 1746, 1753, 1754, 1756, 1757, 1759, 1771, 1777, 1781, 1785, 1790, 1802, 1810, 1817, 1833, 1834, 1835, 1837, 1838, 1841, 1842], "convention": 1754, "conventional_value_of_josephson_const": 1706, "conventional_value_of_von_klitzing_const": 1706, "converg": [0, 1, 2, 11, 84, 97, 266, 277, 295, 318, 319, 335, 342, 356, 393, 408, 432, 438, 439, 455, 470, 473, 491, 499, 500, 515, 529, 538, 548, 552, 582, 583, 584, 588, 594, 606, 632, 645, 647, 657, 660, 672, 681, 684, 685, 686, 687, 688, 697, 699, 722, 726, 729, 737, 738, 739, 746, 747, 754, 755, 812, 818, 830, 833, 841, 843, 846, 847, 848, 850, 854, 856, 876, 924, 928, 930, 949, 953, 958, 971, 973, 975, 976, 995, 1002, 1006, 1029, 1054, 1079, 1086, 1121, 1140, 1166, 1173, 1174, 1175, 1178, 1184, 1188, 1189, 1190, 1191, 1197, 1199, 1200, 1202, 1203, 1206, 1207, 1208, 1210, 1213, 1214, 1215, 1218, 1219, 1221, 1222, 1224, 1225, 1228, 1229, 1230, 1233, 1257, 1266, 1285, 1287, 1290, 1312, 1324, 1349, 1350, 1351, 1364, 1365, 1389, 1405, 1410, 1424, 1430, 1438, 1440, 1442, 1485, 1490, 1497, 1498, 1499, 1510, 1546, 1552, 1554, 1557, 1573, 1604, 1605, 1615, 1638, 1641, 1642, 1643, 1644, 1649, 1654, 1655, 1658, 1669, 1704, 1714, 1742, 1743, 1746, 1749, 1753, 1755, 1756, 1757, 1760, 1766, 1768, 1770, 1771, 1776, 1781, 1785, 1789, 1790, 1795, 1799, 1800, 1824, 1828, 1832, 1837, 1841, 1842, 1844], "convergenceerror": 1827, "convergnec": [1714, 1842], "convers": [106, 377, 562, 1204, 1704, 1706, 1739, 1743, 1767, 1773, 1783, 1784, 1797, 1828, 1844], "convert": [14, 100, 128, 130, 145, 148, 150, 314, 318, 319, 331, 334, 363, 367, 368, 369, 377, 380, 385, 461, 497, 566, 679, 1199, 1200, 1205, 1206, 1704, 1711, 1714, 1737, 1738, 1764, 1767, 1768, 1791, 1797, 1800, 1801, 1802, 1828, 1832, 1838, 1842, 1844], "convolut": [377, 1797, 1841], "cookbook": [400, 1842], "cooler": 1810, "coord": [81, 103, 106, 388, 1226, 1360, 1704, 1714, 1833, 1842], "coordiant": 1767, "coordin": [15, 81, 103, 106, 149, 384, 388, 389, 572, 574, 592, 596, 617, 618, 619, 632, 637, 679, 683, 707, 1156, 1170, 1206, 1221, 1231, 1298, 1299, 1304, 1306, 1308, 1313, 1314, 1334, 1337, 1339, 1340, 1343, 1349, 1351, 1352, 1364, 1365, 1623, 1704, 1708, 1711, 1714, 1743, 1759, 1767, 1768, 1772, 1782, 1786, 1791, 1798, 1799, 1828, 1832, 1835, 1836, 1838, 1842, 1844], "coordsi": 1802, "copi": [2, 12, 64, 76, 88, 100, 106, 148, 150, 151, 262, 288, 289, 295, 329, 339, 340, 344, 380, 384, 993, 1215, 1704, 1708, 1714, 1730, 1738, 1746, 1764, 1766, 1767, 1768, 1785, 1788, 1797, 1809, 1810, 1817, 1835, 1842, 1844], "coplanar": [1692, 1752], "copy_file_to_scratch": [288, 339], "copy_lower_to_upp": 100, "copy_pymol": 1770, "copy_pymol2": 1770, "copy_upper_to_low": 100, "copyright": 1787, "corannulen": [1692, 1752], "core": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 268, 274, 275, 284, 293, 295, 298, 306, 307, 314, 331, 348, 370, 371, 374, 395, 406, 463, 503, 593, 602, 623, 625, 638, 641, 644, 650, 651, 660, 765, 809, 837, 904, 1125, 1126, 1148, 1197, 1199, 1200, 1206, 1209, 1210, 1212, 1221, 1230, 1231, 1454, 1563, 1695, 1696, 1697, 1698, 1700, 1704, 1708, 1711, 1714, 1715, 1738, 1739, 1740, 1742, 1743, 1754, 1755, 1756, 1757, 1758, 1763, 1764, 1766, 1767, 1768, 1770, 1771, 1777, 1781, 1785, 1787, 1788, 1790, 1791, 1792, 1797, 1798, 1800, 1801, 1809, 1814, 1818, 1824, 1828, 1829, 1832, 1837, 1841, 1842, 1844], "core_hamiltonian_grad": 103, "coriani": [377, 1734], "corl": [284, 1740, 1741, 1743], "corl_alpha": [284, 1740], "corl_basi": [284, 1740, 1741, 1743, 1832], "corl_schem": [284, 295, 318, 319, 1740, 1741, 1766, 1800, 1832], "corl_wfn": [284, 1740, 1741], "corl_xtpl_helgaker_2": [284, 1740, 1741, 1743, 1832], "corminboeuf": [1734, 1781], "cornerston": 1838, "corr": [103, 295, 318, 319, 1231, 1524, 1695, 1698, 1699, 1703, 1704, 1758, 1766, 1800, 1837, 1843], "corr_ansatz": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "corr_ccsd_t": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "corr_charg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "corr_multp": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "corr_wfn": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "correcli": 1817, "correct": [2, 68, 84, 100, 106, 138, 145, 148, 265, 267, 284, 295, 314, 318, 319, 329, 356, 394, 400, 446, 484, 574, 597, 605, 677, 701, 758, 874, 889, 900, 903, 961, 1041, 1199, 1200, 1206, 1208, 1210, 1212, 1213, 1218, 1225, 1229, 1230, 1231, 1256, 1406, 1420, 1447, 1451, 1452, 1467, 1472, 1507, 1521, 1522, 1523, 1524, 1525, 1526, 1541, 1582, 1669, 1670, 1675, 1680, 1684, 1690, 1691, 1692, 1695, 1696, 1698, 1699, 1700, 1702, 1703, 1704, 1706, 1708, 1710, 1711, 1714, 1715, 1716, 1726, 1730, 1734, 1738, 1740, 1741, 1743, 1748, 1752, 1753, 1755, 1756, 1766, 1767, 1770, 1771, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1788, 1790, 1791, 1798, 1800, 1805, 1821, 1829, 1831, 1832, 1833, 1834, 1837, 1838, 1842, 1843], "correctli": [1714, 1738, 1743, 1764, 1817, 1828, 1832, 1842, 1844], "correl": [0, 1, 2, 20, 62, 103, 138, 150, 284, 286, 294, 295, 296, 318, 319, 337, 345, 441, 478, 517, 541, 625, 626, 658, 675, 678, 680, 703, 999, 1125, 1127, 1128, 1148, 1149, 1199, 1200, 1202, 1203, 1206, 1215, 1221, 1229, 1231, 1402, 1513, 1530, 1668, 1669, 1670, 1671, 1673, 1674, 1675, 1676, 1680, 1683, 1684, 1689, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1714, 1734, 1740, 1741, 1742, 1743, 1746, 1752, 1753, 1755, 1756, 1757, 1758, 1759, 1760, 1763, 1766, 1769, 1771, 1776, 1781, 1789, 1799, 1800, 1828, 1829, 1832, 1834, 1837, 1838, 1842, 1844], "correlationfactor": [77, 1827], "correlationt": 1827, "correspond": [0, 8, 13, 92, 106, 115, 150, 267, 277, 318, 319, 342, 356, 380, 568, 574, 590, 603, 625, 662, 664, 669, 671, 672, 681, 704, 727, 729, 795, 1206, 1208, 1210, 1229, 1231, 1405, 1499, 1556, 1704, 1714, 1733, 1738, 1749, 1753, 1757, 1759, 1761, 1768, 1771, 1775, 1776, 1782, 1794, 1798, 1799, 1800, 1802, 1817, 1829, 1833, 1836, 1837, 1838, 1841, 1842], "corrupt": 1801, "cosmo": [769, 1209, 1704, 1754], "cost": [0, 2, 259, 575, 704, 727, 1206, 1208, 1230, 1435, 1436, 1704, 1714, 1730, 1742, 1753, 1754, 1757, 1763, 1771, 1789, 1796, 1817, 1837, 1838, 1842], "costli": [150, 314, 1755, 1757, 1791], "cosx": [18, 721, 1166, 1207, 1221, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1704, 1790], "cosx_basis_toler": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cosx_density_toler": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cosx_ints_toler": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cosx_maxiter_fin": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cosx_overlap_fit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cosx_pruning_schem": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cosx_radial_points_fin": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cosx_radial_points_initi": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cosx_spherical_points_fin": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cosx_spherical_points_initi": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cotton": [15, 300, 301, 302, 1065, 1123, 1168, 1189, 1219, 1221, 1222, 1229, 1433, 1704, 1772, 1801, 1833], "could": [272, 329, 359, 609, 786, 827, 833, 1206, 1210, 1231, 1499, 1704, 1738, 1740, 1743, 1748, 1759, 1779, 1785, 1817, 1824, 1828, 1832, 1833, 1844], "coulomb": [76, 103, 1231, 1509, 1704, 1757, 1790, 1817], "count": [5, 277, 342, 356, 1767, 1785, 1794], "counter": [1787, 1802], "counterpart": [713, 1206, 1704, 1714, 1743, 1763, 1767, 1794, 1798, 1802, 1837, 1838, 1842], "counterpois": [1711, 1714, 1743, 1752, 1776, 1778, 1779, 1781, 1794, 1832, 1833, 1842], "coup": 1837, "coupl": [0, 1, 2, 95, 140, 160, 161, 162, 164, 165, 166, 167, 232, 284, 295, 318, 319, 381, 382, 436, 437, 440, 442, 457, 518, 530, 542, 598, 614, 655, 669, 690, 745, 788, 794, 831, 832, 835, 972, 1041, 1044, 1070, 1071, 1120, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1206, 1208, 1214, 1218, 1219, 1221, 1222, 1230, 1404, 1441, 1669, 1673, 1682, 1688, 1704, 1706, 1714, 1724, 1730, 1733, 1735, 1739, 1740, 1741, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1777, 1779, 1780, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1790, 1791, 1792, 1794, 1795, 1797, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "coupled_induct": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "coupling_term": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cours": [603, 611, 615, 648, 679, 696, 1206, 1226, 1323, 1704, 1743, 1776, 1798, 1801, 1802, 1828, 1832, 1844], "courtesi": 1738, "couterpois": 1828, "coval": [106, 1226, 1230, 1299, 1303, 1341, 1689, 1704, 1763, 1770, 1781, 1832], "covalent_connect": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cover": [2, 284, 285, 336, 351, 1158, 1221, 1704, 1740, 1748, 1764, 1770, 1781, 1788, 1794, 1822, 1828, 1844], "coverag": [2, 1714, 1738, 1822, 1842], "cowork": [1692, 1752], "cp": [288, 289, 339, 340, 900, 1212, 1231, 1507, 1692, 1704, 1714, 1715, 1743, 1752, 1776, 1779, 1794, 1828, 1832, 1842, 1843, 1844], "cp_energy_body_dict": 1794, "cp_gradient_body_dict": 1794, "cp_hessian_body_dict": 1794, "cpc": 1781, "cphf": [84, 400, 594, 595, 704, 715, 1029, 1062, 1206, 1218, 1230, 1231, 1435, 1441, 1442, 1457, 1638, 1639, 1704, 1705, 1714, 1725, 1823, 1837, 1838, 1842], "cphf_converg": 84, "cphf_hx": 84, "cphf_mem_safety_factor": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cphf_r_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "cphf_solv": 84, "cphf_task": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cpk": [1230, 1231, 1442, 1638, 1639, 1704, 1837], "cplett": 1734, "cpp": [1738, 1790, 1822], "cppe": [1738, 1777, 1780, 1817], "cppe_dir": 1749, "cppeconfig": 1749, "cpscf": 84, "cpu": [704, 1206, 1704, 1838], "cpuinfo": 1738, "cpython": 1738, "cr": [1707, 1731, 1738], "cr00031a008": 1781, "cr0505627": 1734, "craft": 1757, "crai": [575, 1206, 1704, 1736, 1767], "crash": [87, 1714, 1742, 1755, 1842], "crashclean": 87, "crawdad": 1781, "crawford": [1714, 1734, 1742, 1781, 1786, 1798, 1803, 1842], "cray_add_rpath": 1738, "craype_link_typ": 1738, "creat": [2, 100, 101, 115, 132, 148, 150, 304, 329, 346, 946, 996, 1213, 1215, 1225, 1281, 1704, 1735, 1737, 1738, 1743, 1746, 1748, 1750, 1751, 1752, 1757, 1764, 1767, 1777, 1782, 1785, 1787, 1791, 1797, 1801, 1802, 1804, 1814, 1817, 1819, 1823, 1824, 1828, 1833, 1834, 1844], "create_matric": [16, 108], "create_matrix": 101, "create_psi4_string_from_molecul": 106, "creation": [1748, 1802, 1817, 1833], "creator": 372, "credenti": 372, "crit": [1714, 1743, 1842], "criteria": [2, 439, 473, 737, 818, 850, 924, 967, 971, 973, 975, 976, 1079, 1131, 1140, 1199, 1200, 1208, 1210, 1213, 1214, 1219, 1221, 1224, 1225, 1226, 1229, 1231, 1233, 1257, 1312, 1324, 1410, 1487, 1488, 1489, 1497, 1552, 1621, 1622, 1627, 1704, 1742, 1743, 1755, 1757, 1763, 1771, 1789, 1790, 1798, 1799], "criterion": [432, 439, 455, 467, 473, 491, 499, 500, 529, 552, 582, 594, 632, 664, 684, 737, 739, 747, 818, 850, 854, 876, 924, 930, 949, 953, 958, 1029, 1079, 1174, 1178, 1199, 1200, 1202, 1203, 1206, 1208, 1210, 1213, 1218, 1219, 1222, 1224, 1225, 1226, 1229, 1230, 1231, 1233, 1257, 1266, 1285, 1287, 1290, 1349, 1350, 1351, 1364, 1365, 1410, 1424, 1442, 1497, 1552, 1604, 1605, 1704, 1742, 1755, 1771, 1789, 1798, 1802, 1837, 1838, 1841], "criterium": 1802, "critic": [1730, 1738, 1757, 1768, 1810, 1822], "crontab": 1788, "cross": [114, 149, 1106, 1107, 1146, 1147, 1221, 1704, 1706, 1748, 1757, 1798], "crossov": 1763, "crude": [106, 1225, 1279, 1704, 1754, 1798, 1838], "csam": [1167, 1221, 1231, 1569, 1704, 1838], "csh": [1738, 1748, 1767], "csx": [1714, 1833, 1842], "csy": 1833, "csz": 1833, "ct": [130, 295, 1689, 1766, 1776, 1837], "ct300780u": 1781, "ct301078q": 1781, "ct400250u": 1781, "ct500186j": 1781, "ct500231c": 1781, "ct500634": [1734, 1781], "ct500724p": 1781, "ct6002737": 1776, "ct7": [1692, 1752], "ct800246v": [295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "ctest": [1736, 1767, 1777, 1785, 1788, 1842], "ctest_label": 2, "ctest_runn": [2, 1788], "cu": [394, 1706, 1707, 1731], "cu_x_unit": 1706, "cube": [2, 21, 76, 291, 314, 341, 1035, 1036, 1037, 1108, 1109, 1111, 1218, 1221, 1704, 1714, 1777, 1790, 1791, 1831, 1842], "cubefil": 1750, "cubeprop": [21, 1714, 1777, 1831, 1842], "cubeprop_basis_funct": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cubeprop_filepath": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cubeprop_isocontour_threshold": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cubeprop_orbit": [0, 1, 2, 291, 341, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cubeprop_task": [0, 1, 2, 291, 341, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cubeproperti": 1827, "cubic": [573, 574, 1206, 1229, 1403, 1704], "cubic_basis_toler": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cubic_block_max_point": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cubic_grid_overag": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cubic_grid_spac": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cubicscalargrid": [1030, 1031, 1032, 1033, 1113, 1114, 1115, 1116, 1218, 1221, 1704, 1750], "cuda": [1231, 1629, 1704, 1738], "cuhf": [1231, 1599, 1704, 1714, 1757, 1781, 1827, 1838, 1842], "cuk": 1757, "cumbersom": [1808, 1824], "cumul": [173, 295, 318, 319, 381, 382, 726, 736, 739, 746, 747, 749, 759, 1208, 1671, 1704, 1714, 1766, 1776, 1777, 1790, 1794, 1800, 1826, 1842], "cunha": 1734, "curl": [1748, 1788], "current": [0, 1, 3, 18, 73, 84, 86, 87, 92, 100, 106, 114, 150, 191, 214, 227, 228, 262, 265, 281, 284, 295, 296, 310, 318, 319, 321, 335, 351, 354, 357, 361, 370, 371, 378, 390, 407, 430, 444, 474, 482, 488, 570, 573, 577, 586, 592, 597, 601, 652, 657, 664, 676, 685, 690, 692, 697, 701, 706, 729, 739, 742, 882, 934, 948, 1025, 1026, 1027, 1097, 1197, 1199, 1200, 1206, 1208, 1210, 1213, 1217, 1220, 1224, 1225, 1226, 1229, 1231, 1241, 1248, 1293, 1327, 1405, 1499, 1578, 1651, 1668, 1669, 1670, 1671, 1673, 1675, 1676, 1677, 1678, 1679, 1680, 1682, 1684, 1685, 1688, 1689, 1704, 1706, 1708, 1714, 1730, 1735, 1738, 1740, 1743, 1748, 1750, 1752, 1753, 1754, 1755, 1757, 1766, 1767, 1768, 1769, 1771, 1772, 1774, 1775, 1776, 1781, 1782, 1786, 1788, 1791, 1794, 1796, 1797, 1800, 1801, 1802, 1808, 1809, 1810, 1817, 1828, 1829, 1832, 1834, 1837, 1838, 1841, 1842], "current_afock": 133, "current_ci_energi": 133, "current_docc_energi": 133, "current_ifock": 133, "current_total_energi": 133, "curtiss": [1734, 1771], "curv": [1692, 1726, 1743, 1752, 1761, 1790, 1798], "curvilinear": [596, 1206, 1704], "custom": [106, 150, 267, 283, 333, 771, 1126, 1209, 1221, 1225, 1226, 1283, 1293, 1294, 1352, 1674, 1676, 1684, 1704, 1714, 1718, 1730, 1738, 1743, 1754, 1757, 1759, 1770, 1776, 1777, 1783, 1832, 1838, 1842], "custom_coord": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "custom_cxxstandard": 1738, "custom_funct": 1757, "customari": [1730, 1733, 1740, 1759, 1772, 1794], "customis": 1754, "customiz": 1788, "cut": [1714, 1750, 1770, 1824, 1842], "cutlass": [1231, 1629, 1704], "cutoff": [0, 1, 2, 100, 106, 442, 518, 542, 927, 1030, 1084, 1085, 1113, 1137, 1199, 1202, 1203, 1218, 1219, 1221, 1230, 1231, 1478, 1514, 1520, 1538, 1543, 1545, 1650, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cutoff_amps_print": [2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cv": [0, 295, 381, 382, 1739, 1742, 1756, 1757, 1766, 1771, 1781, 1798, 1826, 1843], "cxx": [1738, 1808], "cxx_standard": 1738, "cycl": [2, 84, 279, 318, 319, 595, 611, 633, 706, 1206, 1229, 1426, 1704, 1711, 1743, 1800, 1808, 1828, 1844], "d": [0, 18, 21, 68, 76, 84, 92, 103, 106, 110, 267, 284, 295, 306, 318, 319, 329, 384, 628, 692, 804, 819, 830, 842, 1112, 1206, 1210, 1221, 1230, 1231, 1469, 1521, 1694, 1695, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1707, 1708, 1714, 1715, 1716, 1729, 1730, 1731, 1732, 1733, 1734, 1737, 1738, 1740, 1748, 1750, 1757, 1758, 1759, 1763, 1766, 1768, 1776, 1777, 1780, 1781, 1785, 1786, 1788, 1798, 1800, 1802, 1804, 1809, 1810, 1817, 1828, 1829, 1836, 1838, 1841, 1842, 1844], "d09": [295, 318, 319, 1695, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "d1": [267, 1669, 1680, 1759, 1776], "d10": [295, 318, 319, 1695, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "d2": [106, 267, 696, 993, 1206, 1215, 1669, 1704, 1714, 1715, 1746, 1757, 1759, 1776, 1781, 1833, 1842], "d2h": [696, 993, 1206, 1215, 1704, 1746, 1833], "d3": [106, 267, 295, 318, 319, 1695, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1729, 1757, 1758, 1759, 1766, 1770, 1781, 1800, 1837], "d32b": 1759, "d3bj": [106, 267, 295, 318, 319, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1757, 1758, 1759, 1766, 1800], "d3bj2b": [267, 295, 318, 319, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1758, 1759, 1766, 1800], "d3bjatm": [267, 295, 318, 319, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1758, 1759, 1766, 1800], "d3m": 1759, "d3m2b": 1759, "d3mbj": [295, 318, 319, 1695, 1697, 1698, 1699, 1703, 1758, 1759, 1766, 1800, 1837], "d3mbj2b": [267, 295, 318, 319, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1703, 1758, 1759, 1766, 1800], "d3mbjatm": [267, 295, 318, 319, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1703, 1758, 1759, 1766, 1800], "d3mzero": 1759, "d3mzero2b": [267, 295, 318, 319, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1703, 1758, 1759, 1766, 1800], "d3mzeroatm": [267, 295, 318, 319, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1703, 1758, 1759, 1766, 1800], "d3zero": [1757, 1759], "d3zero2b": [267, 295, 318, 319, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1758, 1759, 1766, 1800], "d3zeroatm": [267, 295, 318, 319, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1758, 1759, 1766, 1800], "d4": [295, 1695, 1698, 1700, 1701, 1716, 1758, 1759, 1766, 1770, 1781], "d4bj": 1759, "d4bjeeqatm": [267, 1759], "d_": [329, 685, 698, 1206, 1704, 1730, 1757, 1763, 1833, 1838], "d_2": 1833, "d_conv": [84, 276], "d_converg": [0, 1, 2, 684, 1206, 1604, 1654, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "d_e": 1832, "d_gaussian": [968, 1214, 1231, 1532, 1704], "d_slater": [968, 1214, 1231, 1532, 1704], "d_vector": 13, "d_x": [1033, 1116, 1218, 1221, 1704, 1750], "d_y": [1033, 1116, 1218, 1221, 1704, 1750], "d_z": [1033, 1116, 1218, 1221, 1704, 1750], "da": [111, 131, 150, 314, 1112, 1221, 1704, 1750, 1770, 1791], "da_mo": [314, 1791], "da_so": [314, 1791], "da_subset": 150, "daddon_dir": 1738, "dagger": [1763, 1798, 1836], "dagger_a": 1829, "dagger_b": 1829, "dai": [1786, 1788, 1824], "dam": 1781, "damp": [685, 729, 1013, 1015, 1018, 1206, 1208, 1216, 1225, 1228, 1229, 1231, 1271, 1385, 1386, 1387, 1388, 1405, 1498, 1499, 1704, 1714, 1757, 1759, 1785, 1837, 1838, 1842], "damp_induc": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "damp_multipol": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dampen": 92, "damping_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "damping_factor_induc": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "damping_factor_multipol": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "damping_percentag": [0, 1, 2, 685, 1206, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "damping_upd": 84, "dancoff": [1231, 1656, 1704, 1841], "daniel": [1734, 1740, 1742, 1755, 1757, 1760, 1789, 1794, 1797, 1803, 1837, 1841], "dany_addl_cmake_v": 1748, "dao": 147, "darwin": [677, 1206, 1704], "darwin13": 1738, "das2009": [267, 1759], "das2010": [106, 267, 1759], "dash": [373, 391, 601, 1206, 1704, 1754, 1806, 1828, 1833, 1835, 1844], "dashcoeff": [106, 267, 1759], "dashcoeff_suppl": [267, 1759], "dashlevel": [267, 1759], "dashlevel_cit": [267, 1759], "dashlvl": [106, 1759], "dashparam": [106, 267, 1759], "dashparams_cit": [267, 1759], "dat": [170, 1738, 1764, 1767, 1770, 1788, 1799, 1801, 1805, 1806, 1808, 1828, 1844], "data": [0, 14, 84, 88, 100, 128, 130, 145, 148, 150, 255, 265, 285, 287, 295, 296, 329, 331, 336, 338, 342, 356, 384, 386, 412, 467, 1043, 1046, 1052, 1097, 1104, 1198, 1200, 1218, 1220, 1221, 1231, 1584, 1704, 1714, 1738, 1740, 1743, 1752, 1754, 1755, 1761, 1766, 1767, 1769, 1770, 1772, 1775, 1780, 1788, 1794, 1801, 1810, 1817, 1824, 1832, 1837, 1838, 1841, 1842], "data_fil": 1801, "databas": [284, 318, 319, 350, 1692, 1711, 1714, 1715, 1726, 1738, 1740, 1743, 1751, 1764, 1767, 1776, 1777, 1779, 1781, 1795, 1796, 1800, 1828, 1831, 1832, 1840, 1842, 1844], "database_group": [1692, 1752], "database_noncov": [1692, 1752], "database_therm_bh": [1692, 1752], "datafil": [303, 1775], "datafram": 1832, "datakei": 1788, "date": [1, 1786, 1788], "datum": [2, 383, 384, 386, 388, 389], "daunt": 1808, "david": [1755, 1789, 1791], "davidson": [0, 356, 470, 473, 476, 491, 496, 499, 500, 609, 751, 754, 757, 808, 811, 832, 835, 842, 874, 876, 889, 1005, 1200, 1206, 1208, 1210, 1215, 1704, 1742, 1746, 1755, 1817, 1838, 1841], "davidson_solv": 329, "daxpi": 1810, "db": [111, 131, 150, 314, 1112, 1221, 1704, 1750, 1752, 1763, 1779, 1791, 1840], "db1": [1711, 1714, 1743, 1842], "db3": [1714, 1842], "db_func": [1752, 1779], "db_mode": 1779, "db_name": [1752, 1776], "db_rgt": 1752, "db_rxn": 1752, "db_subset": 150, "dblas_typ": 1738, "dboc": [597, 1206, 1704, 1737], "dbuild_libint2_gener": 1783, "dbuild_shared_lib": [1738, 1783], "dc": [730, 742, 750, 1208, 1704, 1714, 1734, 1753, 1781, 1842], "dcalc": 12, "dcccn": 1833, "dcft": 1781, "dchemps2_dir": 1746, "dcmake_ar": 1746, "dcmake_build_typ": 1738, "dcmake_c_compil": 1738, "dcmake_c_flag": 1738, "dcmake_cxx_compil": 1738, "dcmake_cxx_flag": 1738, "dcmake_disable_find_package_chemps2": 1746, "dcmake_disable_find_package_dkh": 1762, "dcmake_disable_find_package_ecpint": 1765, "dcmake_disable_find_package_gau2grid": 1773, "dcmake_disable_find_package_gdma": 1775, "dcmake_disable_find_package_libefp": 1782, "dcmake_disable_find_package_libint2": 1783, "dcmake_disable_find_package_libxc": 1784, "dcmake_disable_find_package_simint": 1839, "dcmake_fortran_compil": 1738, "dcmake_fortran_flag": 1738, "dcmake_install_path": 1738, "dcmake_install_prefix": 1738, "dcmake_prefix_path": [1738, 1746, 1762, 1765, 1773, 1775, 1782, 1783, 1784, 1839], "dcmake_ranlib": 1746, "dcon": 1838, "dcopi": 1810, "dct": [295, 296, 318, 319, 381, 382, 400, 598, 726, 730, 731, 732, 733, 738, 745, 753, 1206, 1704, 1705, 1708, 1709, 1714, 1766, 1769, 1776, 1777, 1790, 1800, 1809, 1826, 1842], "dct1": [1714, 1842], "dct10": [1714, 1842], "dct11": [1714, 1842], "dct12": [1714, 1842], "dct2": [1714, 1842], "dct3": [1714, 1842], "dct4": [1714, 1842], "dct5": [1714, 1842], "dct6": [1714, 1842], "dct7": [1714, 1842], "dct8": [1714, 1842], "dct9": [1714, 1842], "dct_function": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dct_guess": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dct_type": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dcuhna": 1841, "dd": [0, 1672, 1692, 1752, 1776, 1780], "dd_density_integr": 110, "ddd": [1714, 1842], "ddkh_dir": 1762, "ddot": [1810, 1838], "ddsolvat": 1738, "ddx": [0, 1, 2, 400, 760, 767, 768, 775, 776, 777, 1704, 1705, 1709, 1730, 1733, 1735, 1738, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ddx_diis_max_vec": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ddx_eta": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ddx_fmm": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ddx_fmm_local_lmax": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ddx_fmm_multipole_lmax": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ddx_incor": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ddx_lmax": [0, 1, 2, 764, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ddx_logfil": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ddx_maxit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ddx_model": [0, 1, 2, 781, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ddx_n_lebedev": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ddx_radii": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ddx_radii_sc": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ddx_radii_set": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ddx_shift": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ddx_solute_radial_point": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ddx_solute_spherical_point": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ddx_solvation_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ddx_solvent": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ddx_solvent_epsilon": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ddx_solvent_epsilon_opt": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ddx_solvent_kappa": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "de": [106, 344, 520, 1202, 1231, 1650, 1704, 1708, 1734, 1743, 1757, 1759, 1761, 1767, 1774, 1832, 1841], "deactivate_all_frag": 106, "deal": [1737, 1750, 1757, 1781, 1790, 1832], "dealt": [1757, 1828, 1844], "debug": [0, 1, 75, 147, 296, 644, 767, 906, 1153, 1206, 1209, 1212, 1231, 1576, 1591, 1620, 1636, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "debugg": 1813, "deby": [781, 1209, 1704, 1706, 1754], "dec": [575, 1206, 1704, 1738, 1838], "decacen": [1692, 1752], "decad": [368, 369], "decai": [1231, 1532, 1704, 1757, 1776, 1838], "decalin": 1735, "decemb": 1748, "decid": [306, 307, 1772, 1785, 1786, 1800, 1809], "decim": [2, 285, 287, 336, 338, 389, 1795, 1821, 1828, 1844], "decis": [1737, 1824], "declar": [1743, 1796, 1809, 1810, 1812, 1814, 1819, 1832], "decompos": [1714, 1739, 1742, 1756, 1757, 1771, 1781, 1798, 1838, 1842], "decomposit": [874, 915, 916, 1072, 1076, 1209, 1210, 1213, 1219, 1231, 1486, 1600, 1603, 1672, 1704, 1714, 1726, 1738, 1754, 1771, 1776, 1781, 1798, 1803, 1810, 1837, 1838, 1842], "decon": [8, 1730, 1836], "decontract": [1103, 1221, 1704, 1714, 1832, 1836, 1842], "decor": 2, "decoupl": [1801, 1836], "decpint_dir": 1765, "decreas": [0, 1738, 1747, 1750, 1757, 1828, 1838, 1844], "dedic": 1767, "deduc": 1821, "deduct": 1821, "deep": [2, 150], "deep_copi": 150, "deepdiff": 1738, "deeper": 1767, "def": [2, 1788, 1809, 1834], "def2": [106, 1231, 1485, 1694, 1704, 1707, 1714, 1730, 1731, 1732, 1733, 1740, 1772, 1774, 1794, 1842], "default": [0, 1, 2, 8, 61, 62, 86, 87, 92, 101, 106, 195, 197, 200, 210, 265, 267, 284, 288, 289, 297, 300, 301, 302, 304, 318, 319, 339, 340, 347, 354, 370, 377, 381, 382, 389, 390, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1704, 1708, 1714, 1730, 1733, 1735, 1738, 1740, 1743, 1746, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1759, 1760, 1762, 1763, 1767, 1768, 1770, 1772, 1774, 1775, 1779, 1782, 1788, 1789, 1790, 1791, 1792, 1794, 1796, 1800, 1801, 1802, 1803, 1808, 1809, 1826, 1828, 1832, 1833, 1836, 1837, 1839, 1840, 1841, 1842, 1843, 1844], "default_benchmark_nam": [1692, 1752], "default_polici": [265, 1740, 1794], "defer": 1824, "defi": 1822, "defin": [8, 63, 64, 83, 98, 106, 243, 265, 267, 275, 284, 295, 297, 300, 301, 302, 312, 318, 319, 323, 329, 347, 356, 381, 382, 581, 592, 622, 643, 662, 708, 1206, 1226, 1231, 1312, 1336, 1497, 1521, 1539, 1540, 1564, 1582, 1692, 1704, 1714, 1726, 1738, 1740, 1748, 1750, 1751, 1752, 1753, 1754, 1756, 1757, 1759, 1760, 1763, 1766, 1767, 1768, 1771, 1772, 1774, 1776, 1777, 1782, 1786, 1794, 1798, 1800, 1802, 1808, 1810, 1824, 1826, 1828, 1832, 1833, 1835, 1837, 1838, 1842, 1844], "definit": [100, 106, 130, 138, 265, 267, 279, 284, 295, 335, 356, 372, 389, 445, 522, 546, 575, 632, 647, 1199, 1202, 1203, 1206, 1226, 1326, 1704, 1730, 1733, 1738, 1740, 1746, 1757, 1759, 1764, 1766, 1772, 1780, 1784, 1785, 1794, 1801, 1804, 1833, 1837, 1838, 1841], "deflect": 106, "deform": 1752, "deg": 1776, "degen": 20, "degener": [576, 697, 1206, 1704], "degeneraci": [20, 386, 1057, 1218, 1704, 1772, 1805], "degenerci": 20, "degrad": [1742, 1755], "degre": [295, 386, 617, 763, 764, 766, 1024, 1188, 1206, 1209, 1217, 1222, 1704, 1713, 1730, 1733, 1754, 1757, 1766, 1772, 1776, 1798, 1802, 1833, 1837], "del_array_vari": 150, "del_potential_vari": 150, "del_scalar_vari": 150, "del_vari": [150, 174, 175], "delai": [1743, 1832], "delet": [2, 86, 87, 279, 295, 434, 559, 601, 626, 682, 1199, 1204, 1206, 1704, 1738, 1742, 1743, 1766, 1767, 1786, 1788, 1810, 1833, 1838], "delete_tei": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "deleteri": 1804, "deliber": [2, 1759], "delic": 1770, "delimit": [1743, 1764, 1801], "deloc": [1763, 1770], "delta": [6, 76, 100, 284, 295, 318, 319, 377, 823, 1210, 1230, 1444, 1467, 1704, 1714, 1740, 1743, 1766, 1770, 1800, 1802, 1817, 1828, 1837, 1838, 1842, 1844], "delta1": [284, 1740], "delta2": [284, 1740], "delta2_basi": [284, 1740, 1741], "delta2_schem": [284, 1740, 1741], "delta2_wfn": [284, 1740, 1741], "delta2_wfn_less": [284, 1740, 1741], "delta3_basi": [284, 1740, 1741], "delta3_schem": [284, 1740, 1741], "delta3_wfn": [284, 1740, 1741], "delta3_wfn_less": [284, 1740, 1741], "delta4_basi": [284, 1740, 1741], "delta4_schem": [284, 1740, 1741], "delta4_wfn": [284, 1740, 1741], "delta4_wfn_less": [284, 1740, 1741], "delta5_basi": [284, 1740, 1741], "delta5_schem": [284, 1740, 1741], "delta5_wfn": [284, 1740, 1741], "delta5_wfn_less": [284, 1740, 1741], "delta_": [284, 1740, 1741, 1757, 1763, 1771, 1837], "delta_alpha": [284, 1740], "delta_basi": [284, 1740, 1741, 1743], "delta_i": 1771, "delta_schem": [284, 1740, 1741], "delta_v": [277, 342, 356], "delta_wfn": [284, 1740, 1741, 1743], "delta_wfn_less": [284, 1740, 1741], "deltan_": 1740, "demand": [703, 1206, 1704, 1771, 1837], "demo": [1714, 1842], "demonstr": [1714, 1730, 1775, 1798, 1799, 1808, 1817, 1832, 1833, 1838, 1841, 1842], "den": [1714, 1842], "denable_adcc": 1, "denable_chemps2": 1746, "denable_cpp": 1749, "denable_ddx": 1754, "denable_dkh": 1762, "denable_ecpint": 1765, "denable_gdma": [1738, 1775], "denable_libefp": 1782, "denable_pcmsolv": 1803, "denable_simint": 1839, "denomin": [95, 100, 140, 744, 759, 956, 1208, 1213, 1226, 1229, 1230, 1231, 1328, 1427, 1443, 1444, 1651, 1704, 1837, 1839, 1841], "denominator_algorithm": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "denominator_delta": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "denominator_occ": [95, 140], "denominator_vir": [95, 140], "denot": [0, 495, 774, 1200, 1209, 1704, 1730, 1742, 1753, 1754, 1757, 1802, 1817, 1837], "dens": [100, 148, 331, 888, 1210, 1704, 1797], "densiti": [2, 13, 21, 26, 61, 74, 75, 76, 84, 92, 103, 138, 143, 147, 150, 160, 173, 179, 217, 276, 284, 285, 291, 295, 296, 300, 301, 302, 303, 314, 318, 319, 336, 341, 352, 356, 381, 382, 413, 416, 417, 609, 614, 627, 665, 669, 675, 678, 684, 686, 697, 726, 729, 733, 736, 738, 739, 743, 747, 749, 759, 810, 828, 872, 887, 888, 892, 899, 909, 910, 963, 998, 1002, 1035, 1076, 1110, 1112, 1120, 1167, 1174, 1198, 1204, 1206, 1208, 1211, 1212, 1213, 1214, 1215, 1218, 1219, 1221, 1222, 1230, 1231, 1445, 1446, 1488, 1497, 1498, 1499, 1500, 1501, 1502, 1510, 1520, 1538, 1567, 1569, 1572, 1591, 1603, 1604, 1622, 1671, 1674, 1675, 1690, 1704, 1706, 1708, 1714, 1730, 1733, 1734, 1735, 1738, 1739, 1740, 1742, 1743, 1744, 1745, 1750, 1754, 1755, 1759, 1760, 1763, 1766, 1767, 1769, 1770, 1772, 1775, 1776, 1777, 1784, 1785, 1790, 1791, 1798, 1799, 1800, 1806, 1808, 1823, 1824, 1826, 1828, 1832, 1837, 1842, 1844], "density_a": [314, 1791], "density_b": [314, 1791], "density_cutoff": [80, 96], "density_integr": 110, "density_toler": 138, "dep": [1738, 1759, 1794], "depend": [0, 1, 8, 11, 100, 115, 148, 324, 342, 356, 368, 369, 432, 539, 669, 672, 772, 977, 1199, 1203, 1206, 1209, 1214, 1225, 1231, 1232, 1283, 1294, 1602, 1620, 1666, 1669, 1704, 1710, 1714, 1730, 1734, 1735, 1739, 1742, 1743, 1746, 1748, 1749, 1753, 1754, 1757, 1762, 1763, 1764, 1765, 1767, 1771, 1773, 1775, 1776, 1777, 1781, 1782, 1783, 1784, 1785, 1788, 1790, 1794, 1797, 1802, 1803, 1808, 1810, 1817, 1821, 1833, 1836, 1837, 1838, 1839, 1842, 1843], "deploi": [1770, 1788], "deploy": 1748, "depopul": [671, 1206, 1704], "deprec": [96, 100, 150, 192, 193, 203, 204, 206, 253, 263, 264, 279, 281, 295, 304, 375, 396, 1231, 1588, 1704, 1766, 1767, 1828], "deprinc": [1734, 1771, 1777, 1780, 1781, 1782, 1786], "depscach": 1748, "depsmklcach": 1748, "depth": [2, 476, 1200, 1704], "der": [106, 1759, 1781, 1832, 1837], "dergam": [621, 1206, 1704], "derint": [621, 1206, 1704], "deriv": [0, 7, 89, 103, 106, 138, 267, 268, 269, 300, 301, 302, 310, 361, 378, 386, 568, 570, 586, 590, 599, 600, 608, 615, 647, 665, 667, 673, 702, 704, 707, 904, 1119, 1206, 1212, 1217, 1221, 1226, 1231, 1370, 1538, 1704, 1708, 1714, 1738, 1743, 1753, 1757, 1759, 1768, 1772, 1774, 1776, 1796, 1798, 1802, 1809, 1819, 1823, 1824, 1827, 1828, 1835, 1836, 1837, 1838, 1839, 1842, 1844], "deriv_calc_typ": 61, "deriv_dens": 61, "deriv_level": 1817, "derivative_int": 268, "derivcalctyp": [61, 1827], "derricott": [1734, 1781, 1836], "dertyp": [0, 1, 2, 106, 300, 301, 302, 318, 319, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "descend": 63, "descent": [1225, 1279, 1704, 1798, 1802], "describ": [106, 132, 266, 268, 269, 270, 276, 277, 278, 279, 280, 329, 356, 661, 693, 1156, 1206, 1221, 1224, 1230, 1231, 1240, 1437, 1586, 1704, 1714, 1730, 1733, 1740, 1742, 1750, 1753, 1755, 1757, 1761, 1767, 1770, 1771, 1772, 1775, 1776, 1779, 1781, 1782, 1786, 1792, 1794, 1795, 1798, 1802, 1804, 1817, 1824, 1828, 1829, 1831, 1832, 1833, 1834, 1835, 1837, 1838, 1841, 1842, 1844], "descript": [2, 11, 68, 80, 138, 265, 267, 285, 287, 296, 336, 338, 386, 1206, 1692, 1695, 1696, 1697, 1699, 1700, 1701, 1702, 1706, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1740, 1749, 1752, 1753, 1754, 1755, 1757, 1758, 1759, 1768, 1769, 1771, 1772, 1776, 1781, 1792, 1794, 1796, 1798, 1801, 1802, 1803, 1832, 1837, 1842], "descriptive_filenam": 1767, "descriptor": 1750, "deseri": 150, "deshawresearch": [1738, 1806], "design": [2, 87, 100, 691, 1206, 1704, 1714, 1733, 1743, 1751, 1755, 1757, 1767, 1770, 1779, 1804, 1817, 1824, 1828, 1833, 1836, 1838, 1842, 1844], "desir": [0, 138, 329, 342, 356, 446, 454, 484, 523, 547, 550, 551, 616, 823, 829, 884, 930, 958, 1077, 1199, 1200, 1202, 1203, 1206, 1210, 1213, 1219, 1225, 1266, 1290, 1704, 1738, 1742, 1748, 1750, 1753, 1755, 1770, 1771, 1775, 1786, 1788, 1798, 1802, 1805, 1824, 1838, 1841], "despit": [388, 1746, 1759, 1762, 1765, 1773, 1775, 1782, 1783, 1784, 1839, 1841], "destin": [2, 150, 296, 314, 1769, 1791, 1838], "detail": [0, 1, 2, 8, 138, 292, 295, 300, 301, 302, 318, 319, 343, 1106, 1107, 1146, 1147, 1220, 1221, 1224, 1226, 1236, 1324, 1681, 1704, 1714, 1730, 1735, 1736, 1746, 1750, 1752, 1753, 1754, 1755, 1759, 1763, 1766, 1767, 1770, 1772, 1780, 1781, 1788, 1793, 1797, 1799, 1800, 1802, 1803, 1805, 1806, 1809, 1810, 1817, 1821, 1823, 1824, 1828, 1832, 1833, 1836, 1837, 1838, 1839, 1842, 1844], "detca": [891, 1210, 1704], "detci": [150, 295, 314, 400, 806, 838, 861, 882, 883, 887, 891, 1158, 1221, 1704, 1705, 1708, 1709, 1714, 1725, 1739, 1766, 1776, 1781, 1789, 1790, 1791, 1805, 1809, 1834, 1842], "detci__calc_s_squar": 1755, "detci_freeze_cor": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "detci_psivar": 1764, "detect": [2, 106, 1730, 1735, 1738, 1746, 1749, 1759, 1762, 1765, 1768, 1773, 1774, 1775, 1782, 1783, 1784, 1785, 1802, 1803, 1833, 1838, 1839], "determin": [0, 16, 100, 106, 143, 144, 148, 150, 177, 314, 331, 390, 432, 573, 574, 575, 579, 609, 616, 639, 647, 648, 660, 662, 707, 823, 824, 825, 826, 827, 829, 833, 861, 869, 884, 885, 914, 932, 934, 966, 1025, 1026, 1027, 1065, 1099, 1199, 1206, 1210, 1213, 1214, 1217, 1219, 1220, 1224, 1225, 1226, 1229, 1230, 1231, 1236, 1238, 1243, 1267, 1303, 1404, 1416, 1431, 1434, 1472, 1578, 1704, 1708, 1714, 1740, 1742, 1750, 1754, 1755, 1757, 1761, 1763, 1764, 1770, 1771, 1772, 1775, 1776, 1781, 1782, 1788, 1789, 1791, 1794, 1797, 1798, 1801, 1802, 1805, 1810, 1817, 1824, 1829, 1835, 1837, 1838, 1841, 1842], "determinedli": 1743, "deuterium": 1833, "deuteron": 1706, "deuteron_electron_mag_mom_ratio": 1706, "deuteron_electron_mass_ratio": 1706, "deuteron_g_factor": 1706, "deuteron_mag_mom": 1706, "deuteron_mag_mom_to_bohr_magneton_ratio": 1706, "deuteron_mag_mom_to_nuclear_magneton_ratio": 1706, "deuteron_mass": 1706, "deuteron_mass_energy_equival": 1706, "deuteron_mass_energy_equivalent_in_mev": 1706, "deuteron_mass_in_u": 1706, "deuteron_molar_mass": 1706, "deuteron_neutron_mag_mom_ratio": 1706, "deuteron_proton_mag_mom_ratio": 1706, "deuteron_proton_mass_ratio": 1706, "deuteron_rms_charge_radiu": 1706, "dev": [153, 372, 1736, 1737, 1738, 1743, 1752, 1767, 1786, 1788], "dev1": [1786, 1788], "dev17": 1786, "dev249": 1748, "dev417": 1786, "dev525": 1767, "devel": 1738, "develop": [0, 1, 2, 284, 351, 370, 381, 382, 430, 444, 482, 521, 545, 704, 835, 1199, 1200, 1202, 1203, 1206, 1210, 1704, 1734, 1735, 1736, 1737, 1740, 1743, 1747, 1748, 1749, 1752, 1754, 1755, 1757, 1759, 1764, 1767, 1768, 1770, 1775, 1777, 1781, 1782, 1783, 1785, 1786, 1788, 1791, 1802, 1803, 1806, 1816, 1817, 1818, 1819, 1825, 1826, 1829, 1833, 1837, 1838, 1839, 1840], "deviat": [386, 1752, 1757, 1760, 1772, 1776, 1837, 1838], "devic": [672, 1206, 1704], "devis": 1838, "devot": 1770, "devtool": [1748, 1764], "df": [2, 73, 92, 178, 241, 242, 381, 382, 721, 732, 851, 858, 902, 917, 927, 962, 1075, 1106, 1132, 1146, 1147, 1166, 1207, 1208, 1210, 1212, 1213, 1219, 1221, 1230, 1231, 1436, 1455, 1481, 1507, 1609, 1620, 1704, 1708, 1714, 1715, 1720, 1730, 1738, 1739, 1742, 1749, 1750, 1752, 1754, 1757, 1763, 1767, 1770, 1771, 1777, 1781, 1785, 1789, 1790, 1798, 1803, 1806, 1809, 1826, 1828, 1832, 1837, 1838, 1842, 1844], "df_basis_cc": [0, 1, 2, 8, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "df_basis_dct": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "df_basis_elst": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "df_basis_ep2": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "df_basis_guess": [0, 1, 2, 295, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "df_basis_mcscf": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "df_basis_mp2": [0, 1, 2, 8, 326, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "df_basis_sad": [0, 1, 2, 8, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "df_basis_sapt": [0, 1, 2, 1445, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "df_basis_scf": [0, 1, 2, 8, 92, 327, 376, 397, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "df_bump_r0": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "df_bump_r1": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "df_domain": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "df_fitting_condit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "df_ints_io": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "df_ints_num_thread": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "df_metric": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "df_scf_guess": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "df_theta": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dfa": 1757, "dfcasscf": [1714, 1842], "dfcc": [0, 1, 2, 1704, 1708, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dfccd": [1714, 1842], "dfccd1": [1714, 1842], "dfccdl1": [1714, 1842], "dfccsd": [1714, 1842], "dfccsd1": [1714, 1842], "dfccsdat": [1734, 1798], "dfccsdat1": [1714, 1842], "dfccsdat2": [1714, 1842], "dfccsdgrad": [1734, 1798], "dfccsdl1": [1714, 1842], "dfccsdt1": [1714, 1842], "dfccsdt2": [1714, 1842], "dfccsdtgrad": [1734, 1798], "dfdirj": [721, 1166, 1207, 1221, 1704, 1838], "dfdl": 1757, "dfep2": [400, 1704, 1705, 1714, 1842], "dfep2wavefunct": 1827, "dfh": 102, "dfhelper": [102, 1821, 1827], "dfile": [830, 1210, 1704], "dfj": 1838, "dfmp2": [372, 400, 1158, 1221, 1704, 1705, 1708, 1709, 1711, 1714, 1725, 1739, 1743, 1767, 1771, 1808, 1809, 1832, 1833, 1838, 1842], "dfmp2_1": [1714, 1842], "dfmp2_mem_factor": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dfmp2_p2_toler": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dfmp2_p_toler": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dfmp2_wfn": 1809, "dfocc": [400, 930, 949, 958, 1158, 1221, 1704, 1705, 1708, 1709, 1714, 1738, 1790, 1842], "dfoccd": [1734, 1798], "dfolccd": [1734, 1798], "dfomp2": [1714, 1842], "dfomp2grad": [1734, 1798], "dfomp2p5": [1714, 1842], "dfomp3": [1714, 1734, 1798, 1842], "dfomp3grad": [1734, 1798], "dforemp": [1714, 1842], "dfrasscf": [1714, 1842], "dfremp": [1714, 1842], "dfscf": [1714, 1842], "dfsomcscf": 1827, "dft": [84, 92, 106, 110, 147, 150, 267, 295, 296, 300, 301, 302, 306, 314, 318, 319, 400, 739, 1104, 1208, 1221, 1442, 1448, 1450, 1470, 1471, 1512, 1513, 1514, 1518, 1527, 1529, 1530, 1690, 1698, 1703, 1704, 1710, 1714, 1715, 1716, 1718, 1724, 1735, 1739, 1754, 1756, 1759, 1764, 1766, 1767, 1768, 1769, 1772, 1773, 1774, 1776, 1777, 1781, 1790, 1791, 1798, 1800, 1803, 1836, 1838, 1841, 1842], "dft1": [1714, 1842], "dft2": [1714, 1842], "dft3": [1714, 1842], "dft_alpha": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_alpha_c": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_basis_toler": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_block_max_point": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_block_max_radiu": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_block_min_point": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_block_schem": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_bs_radius_alpha": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_builder": 1757, "dft_density_toler": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_dict": 1759, "dft_dispersion_paramet": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_function": [1757, 1798], "dft_grac_alpha": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_grac_beta": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_grac_c_func": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_grac_shift": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_grac_x_func": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_grid_nam": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_nuclear_schem": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_omega": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_omega_c": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_pruning_alpha": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_pruning_schem": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_radial_point": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_radial_schem": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_remove_distant_point": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_spherical_point": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_spherical_schem": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_v2_rho_cutoff": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_vv10_b": [0, 1, 2, 1704, 1714, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "dft_vv10_c": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_vv10_postscf": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_vv10_radial_point": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_vv10_rho_cutoff": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_vv10_spherical_point": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_weights_toler": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dftd3": [2, 106, 267, 400, 1738, 1757, 1767, 1770, 1774, 1777, 1780, 1781, 1842], "dftd4": [106, 267, 400, 1738, 1770, 1774, 1780, 1781, 1842], "dftensor": 1827, "dftgrid": [110, 147, 1827], "dga": 1713, "dgasmith": 1751, "dgau2grid_dir": 1773, "dgauss": [1694, 1707, 1731, 1732], "dgdma_dir": 1775, "dgeev": 1810, "dgemm": [1756, 1767, 1810], "dgemv": 1810, "dger": 1810, "dgesv": 1810, "dgesvd": 1810, "dgetr": 1810, "dgetrf": 1810, "dgetri": 1810, "dgma": 1775, "dh": [295, 1695, 1696, 1697, 1698, 1700, 1739, 1757, 1758, 1766, 1776, 1781], "dhccc1": 1833, "dhccc2": 1833, "dhccc3": 1833, "dhdf": [1714, 1842], "dhf": 76, "di": [1121, 1221, 1704, 1734, 1777, 1780, 1781, 1782, 1786, 1804, 1833, 1841], "di6": [1692, 1752], "diag": [835, 842, 1210, 1704], "diag_h": 13, "diag_method": [0, 1, 2, 837, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "diagnost": [11, 1669, 1680, 1776], "diagon": [63, 100, 148, 329, 331, 334, 342, 356, 501, 597, 606, 609, 655, 660, 664, 665, 738, 751, 754, 757, 805, 811, 835, 836, 874, 1005, 1171, 1172, 1200, 1206, 1208, 1215, 1222, 1225, 1229, 1279, 1406, 1407, 1420, 1704, 1708, 1746, 1753, 1755, 1757, 1763, 1771, 1781, 1797, 1798, 1802, 1810, 1824, 1829, 1837, 1838, 1841], "diagonal_ccsd_t": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "diagonalis": [0, 1, 408, 1197, 1704], "diagonalize_heff": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "diagonalizeord": [100, 1827], "diagram": [1069, 1219, 1704, 1771, 1798, 1810], "diagrammat": [0, 1, 295, 381, 382, 1197, 1668, 1738, 1766, 1810, 1826], "diatom": [1231, 1505, 1704, 1777, 1782, 1831], "dichroism": [368, 377, 1790], "dicitonari": [1226, 1304, 1704], "dict": [2, 7, 8, 11, 29, 75, 76, 80, 92, 96, 100, 106, 119, 138, 147, 148, 150, 152, 187, 216, 217, 220, 239, 263, 265, 267, 277, 284, 294, 298, 308, 310, 318, 319, 342, 345, 346, 348, 356, 359, 361, 370, 371, 372, 375, 376, 377, 378, 383, 384, 386, 388, 389, 390, 396, 397, 399, 1714, 1740, 1757, 1759, 1761, 1767, 1768, 1772, 1794, 1800, 1842], "dict_func": 1757, "dictat": 1810, "dictionari": [2, 96, 100, 106, 148, 150, 152, 220, 239, 267, 268, 277, 284, 294, 296, 298, 310, 318, 319, 345, 346, 348, 359, 361, 370, 371, 372, 375, 376, 377, 383, 384, 386, 396, 397, 399, 1226, 1336, 1704, 1740, 1743, 1752, 1757, 1759, 1761, 1767, 1768, 1769, 1794, 1800, 1802, 1809, 1828, 1832, 1835, 1843, 1844], "did": 97, "didn": [1786, 1794, 1828, 1844], "die": [1230, 1480, 1704, 1837], "die_if_not_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dielectr": [779, 780, 1209, 1704, 1754], "dielectric_const": 1754, "diff": [1747, 1770, 1786, 1788], "diff1": [1714, 1842], "differ": [2, 130, 158, 265, 267, 278, 284, 300, 301, 302, 306, 307, 318, 319, 329, 439, 473, 603, 615, 616, 617, 618, 619, 632, 666, 679, 737, 818, 835, 850, 881, 887, 924, 1023, 1024, 1028, 1079, 1150, 1166, 1199, 1200, 1206, 1208, 1210, 1213, 1217, 1219, 1221, 1224, 1225, 1226, 1229, 1231, 1232, 1233, 1257, 1313, 1401, 1410, 1497, 1552, 1666, 1692, 1704, 1706, 1713, 1714, 1724, 1726, 1727, 1738, 1740, 1742, 1743, 1748, 1752, 1753, 1755, 1756, 1757, 1759, 1763, 1764, 1767, 1768, 1771, 1772, 1776, 1782, 1783, 1785, 1788, 1789, 1790, 1794, 1796, 1798, 1800, 1801, 1802, 1803, 1809, 1810, 1815, 1817, 1821, 1823, 1824, 1828, 1829, 1832, 1833, 1834, 1836, 1837, 1838, 1840, 1842, 1843, 1844], "differenti": [615, 666, 707, 1206, 1704, 1714, 1824, 1842], "difficult": [672, 1206, 1704, 1757, 1799, 1802, 1824, 1833, 1834, 1837, 1838], "difficulti": [2, 1767, 1782, 1802, 1838], "diffus": [275, 1730, 1743, 1757, 1763, 1828, 1838, 1844], "digit": [2, 285, 287, 336, 338, 1757, 1795, 1828, 1844], "dihedr": [1226, 1309, 1315, 1320, 1358, 1371, 1704, 1802], "dii": [0, 1, 2, 14, 84, 128, 130, 145, 584, 647, 686, 687, 688, 699, 734, 735, 736, 760, 813, 814, 815, 816, 845, 846, 847, 848, 911, 912, 919, 931, 990, 991, 1001, 1077, 1173, 1176, 1206, 1208, 1209, 1213, 1215, 1219, 1225, 1229, 1230, 1250, 1251, 1252, 1279, 1408, 1409, 1430, 1456, 1458, 1547, 1548, 1550, 1557, 1571, 1615, 1616, 1617, 1704, 1708, 1714, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "diis_enabled_": 84, "diis_freq": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "diis_manager_": 84, "diis_max_vec": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "diis_min_vec": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "diis_rms_error": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "diis_start": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "diis_start_": 84, "diis_start_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "diis_start_it": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dim": [64, 88, 115, 148, 1797], "dim1": [100, 148, 331, 1797], "dim2": [100, 148, 331, 1797], "dimens": [2, 13, 16, 88, 100, 101, 106, 115, 137, 148, 150, 183, 184, 259, 262, 263, 329, 331, 342, 356, 367, 1231, 1551, 1595, 1704, 1743, 1797, 1812, 1814, 1817, 1827, 1828, 1844], "dimension": [150, 262, 263, 1838, 1841], "dimensionless": [572, 1206, 1704], "dimer": [295, 1226, 1336, 1692, 1704, 1708, 1711, 1714, 1722, 1728, 1743, 1752, 1766, 1770, 1776, 1794, 1798, 1806, 1809, 1828, 1832, 1833, 1835, 1837, 1842, 1844], "dimer_wfn": 237, "dimerfrag": 1802, "dimerintro_": 1802, "dimersection_": 1802, "dimethylcyclohexan": 1754, "dimm": [374, 395], "dimpi": [88, 148], "diol": 1833, "dipder": [386, 1714, 1842], "dipmom": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dipmom_au2deby": 1706, "dipmom_au2si": 1706, "dipmom_debye2si": 1706, "dipol": [0, 65, 89, 103, 106, 111, 150, 262, 317, 365, 368, 369, 377, 381, 382, 386, 402, 454, 539, 551, 598, 608, 615, 669, 690, 817, 985, 1078, 1197, 1199, 1203, 1206, 1210, 1214, 1219, 1231, 1586, 1588, 1589, 1657, 1669, 1673, 1685, 1692, 1704, 1706, 1714, 1724, 1726, 1742, 1743, 1752, 1755, 1770, 1771, 1776, 1798, 1799, 1803, 1817, 1826, 1838, 1841, 1842], "dipole_field": 106, "dipole_grad": 103, "dipole_i": [1231, 1589, 1704], "dipole_x": [1231, 1589, 1704], "dipole_z": [1231, 1589, 1704], "dipoleint": [1817, 1827], "dir": [1736, 1738, 1748, 1750, 1767, 1770, 1785, 1787, 1788, 1808], "dir1": 1770, "dir2": 1770, "dirac": [1103, 1221, 1704, 1714, 1781, 1836, 1838, 1842], "dirad": [1829, 1838], "direct": [0, 92, 106, 120, 134, 149, 278, 280, 284, 411, 430, 513, 557, 574, 609, 620, 627, 640, 641, 677, 679, 681, 721, 935, 961, 1166, 1198, 1199, 1202, 1204, 1206, 1207, 1213, 1221, 1225, 1226, 1228, 1231, 1270, 1296, 1346, 1394, 1510, 1586, 1609, 1704, 1714, 1735, 1737, 1738, 1740, 1743, 1748, 1749, 1754, 1757, 1767, 1770, 1781, 1785, 1786, 1788, 1790, 1798, 1801, 1803, 1809, 1810, 1814, 1816, 1819, 1823, 1832, 1840, 1842, 1844], "directclon": 1738, "directjk": [1817, 1827], "directli": [0, 150, 265, 329, 359, 568, 623, 1130, 1206, 1221, 1225, 1226, 1296, 1341, 1704, 1714, 1715, 1716, 1737, 1738, 1740, 1743, 1754, 1770, 1772, 1779, 1782, 1792, 1794, 1798, 1800, 1802, 1817, 1828, 1832, 1833, 1837, 1838, 1842, 1844], "directori": [2, 202, 380, 1043, 1046, 1052, 1109, 1218, 1221, 1704, 1730, 1735, 1736, 1743, 1746, 1748, 1749, 1750, 1752, 1762, 1764, 1765, 1767, 1768, 1770, 1773, 1775, 1781, 1782, 1783, 1784, 1786, 1787, 1788, 1803, 1805, 1806, 1814, 1819, 1823, 1824, 1828, 1832, 1835, 1839, 1842, 1844], "directory_nam": 2, "dirnam": 1748, "dirti": 1786, "disabl": [1231, 1490, 1545, 1629, 1663, 1704, 1735, 1748, 1752, 1757, 1759, 1764, 1822, 1838, 1839], "disallow": [374, 395, 819, 1210, 1704, 1738], "disappear": [786, 1210, 1704], "disc": [1226, 1373, 1704], "discard": [100, 148, 150, 314, 331, 875, 1085, 1145, 1210, 1219, 1221, 1230, 1462, 1704, 1763, 1771, 1791, 1797, 1833, 1837, 1838], "discontinu": [1757, 1776, 1798], "discount": [1024, 1217, 1704], "discourag": [656, 1206, 1704, 1737, 1770, 1810, 1838], "discov": 1837, "discrep": 1837, "discretis": [1780, 1803], "discuss": [0, 608, 1206, 1704, 1738, 1757, 1759, 1770, 1771, 1772, 1781, 1786, 1798, 1800, 1801, 1804, 1813, 1828, 1832, 1837, 1838, 1844], "disengag": [1748, 1786], "disjoint": 2, "disk": [62, 75, 86, 87, 148, 150, 157, 411, 430, 474, 493, 510, 513, 554, 557, 568, 623, 627, 638, 639, 641, 644, 647, 679, 699, 703, 710, 727, 802, 803, 811, 836, 842, 883, 961, 991, 1010, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1206, 1208, 1210, 1213, 1215, 1223, 1226, 1230, 1372, 1435, 1436, 1704, 1714, 1735, 1738, 1742, 1746, 1747, 1750, 1753, 1755, 1756, 1763, 1767, 1801, 1809, 1823, 1824, 1837, 1838, 1842], "disk_df": [1166, 1221, 1231, 1507, 1609, 1620, 1704, 1714, 1838, 1842], "diskdf": [1714, 1842], "diskdfjk": [1231, 1507, 1704], "disksomcscf": 1827, "disp": [76, 106, 267, 346, 1230, 1444, 1454, 1469, 1470, 1475, 1678, 1679, 1689, 1704, 1714, 1743, 1759, 1770, 1776, 1802, 1828, 1837, 1842, 1844], "disp2": [346, 1230, 1470, 1689, 1704, 1776, 1837], "disp20": [346, 1679, 1689, 1714, 1776, 1828, 1837, 1842, 1844], "disp21": [1689, 1776, 1837], "disp22": [346, 1689, 1776, 1837], "disp30": [1689, 1776, 1837], "disp_siz": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dispar": [1226, 1341, 1704], "dispe20": 76, "dispers": [76, 106, 138, 267, 295, 394, 400, 1012, 1013, 1039, 1216, 1218, 1230, 1231, 1447, 1448, 1451, 1460, 1468, 1470, 1476, 1477, 1481, 1521, 1582, 1690, 1692, 1695, 1696, 1698, 1699, 1700, 1701, 1702, 1704, 1714, 1734, 1752, 1766, 1770, 1774, 1776, 1780, 1781, 1790, 1827, 1828, 1837, 1842, 1844], "dispersionless": [295, 318, 319, 1695, 1698, 1700, 1702, 1703, 1714, 1758, 1766, 1800, 1842], "displac": [15, 16, 134, 386, 388, 551, 573, 1023, 1150, 1203, 1206, 1217, 1221, 1226, 1349, 1364, 1692, 1704, 1706, 1714, 1742, 1752, 1802, 1824, 1828, 1842, 1844], "displai": [0, 1738, 1767, 1781, 1833, 1838], "disregard": [1229, 1419, 1704, 1735, 1798], "dissoci": [1692, 1714, 1743, 1752, 1832, 1842], "distanc": [106, 149, 299, 309, 349, 360, 1226, 1299, 1303, 1310, 1321, 1326, 1341, 1359, 1704, 1714, 1759, 1802, 1828, 1837, 1842, 1844], "distance_matrix": 106, "distant": 1763, "distinct": [0, 329, 1752, 1794, 1810, 1817, 1828, 1835, 1844], "distinguish": [2, 1034, 1218, 1704, 1837], "distort": [1714, 1833, 1842], "distribut": [271, 350, 351, 1220, 1231, 1551, 1606, 1661, 1681, 1704, 1714, 1719, 1734, 1736, 1737, 1738, 1743, 1752, 1767, 1770, 1776, 1777, 1780, 1781, 1787, 1789, 1794, 1806, 1808, 1814, 1824, 1832, 1842], "distributed_matrix": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ditto": 1738, "diverg": 1782, "divers": 1824, "divert": 1794, "divid": [12, 1752, 1757, 1770], "dk": [1694, 1707, 1714, 1731, 1732, 1733, 1762, 1836, 1842], "dkh": [103, 284, 400, 1103, 1221, 1704, 1736, 1738, 1740, 1777, 1780, 1785, 1836, 1842], "dkh_dir": 1762, "dkh_mangl": 1762, "dkh_order": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dkhconfig": 1762, "dl": [724, 1207, 1694, 1704, 1707, 1731, 1732, 1733], "dlapack_include_dir": 1738, "dlapack_librari": 1738, "dlapack_typ": 1738, "dlbtn": 1788, "dldf": [295, 318, 319, 1695, 1698, 1700, 1702, 1703, 1714, 1758, 1766, 1800, 1842], "dlibefp_dir": 1782, "dlibint_dir2": 1783, "dlibxc_dir": 1784, "dlpno": [295, 400, 964, 975, 1704, 1705, 1709, 1714, 1766, 1777, 1781, 1790, 1842], "dlpno_algorithm": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dlpno_local_orbit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dlpno_maxit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dlpnomp2": [1714, 1763, 1842], "dm": 1776, "dma": [303, 1098, 1099, 1101, 1220, 1681, 1704, 1775, 1776], "dma_result": 1775, "dmax_am_eri": 1738, "dmp2": [267, 295, 1689, 1714, 1759, 1766, 1776, 1837, 1842], "dmrcc": [1767, 1792], "dmrg": [295, 400, 986, 989, 990, 993, 995, 997, 999, 1000, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1704, 1705, 1709, 1712, 1738, 1766, 1776, 1780], "dmrg_": 1746, "dmrg_caspt2_calc": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dmrg_caspt2_imag": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dmrg_caspt2_ipea": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dmrg_caspt2_orb": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dmrg_dii": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dmrg_diis_writ": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dmrg_excit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dmrg_irrep": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dmrg_local_init": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dmrg_molden_writ": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dmrg_mps_write": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dmrg_multipl": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dmrg_opdm_ao_print": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dmrg_print_corr": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dmrg_scf_active_spac": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dmrg_scf_diis_thr": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dmrg_scf_grad_thr": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dmrg_scf_max_it": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dmrg_scf_state_avg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dmrg_sweep_dvdson_rtol": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dmrg_sweep_energy_conv": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dmrg_sweep_max_sweep": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dmrg_sweep_noise_prefac": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dmrg_sweep_stat": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dmrg_unitary_writ": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dmrgscf": [986, 989, 1215, 1704, 1746], "dna": 1781, "dne": [655, 665, 1206, 1704], "dnrm2": 1810, "do": [0, 2, 8, 11, 84, 92, 106, 138, 150, 314, 324, 329, 335, 374, 395, 417, 424, 425, 426, 427, 429, 438, 440, 441, 448, 451, 453, 457, 458, 459, 460, 463, 468, 477, 478, 481, 486, 493, 494, 498, 501, 503, 509, 510, 515, 517, 520, 530, 532, 534, 536, 538, 540, 541, 544, 554, 555, 586, 644, 656, 660, 664, 675, 688, 697, 713, 718, 786, 787, 788, 792, 795, 799, 801, 802, 803, 804, 807, 809, 812, 813, 817, 821, 822, 823, 831, 836, 838, 839, 846, 855, 859, 860, 861, 863, 864, 865, 866, 867, 872, 875, 882, 883, 885, 886, 887, 888, 909, 910, 913, 915, 917, 919, 920, 921, 922, 925, 934, 940, 941, 942, 945, 952, 954, 956, 986, 1011, 1012, 1014, 1016, 1017, 1019, 1020, 1022, 1024, 1025, 1026, 1027, 1038, 1039, 1042, 1044, 1045, 1047, 1064, 1069, 1073, 1074, 1076, 1083, 1087, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1124, 1157, 1171, 1172, 1173, 1175, 1179, 1182, 1183, 1186, 1198, 1199, 1200, 1201, 1202, 1203, 1206, 1207, 1210, 1212, 1213, 1215, 1216, 1217, 1218, 1219, 1221, 1222, 1225, 1226, 1229, 1230, 1231, 1244, 1252, 1258, 1259, 1260, 1261, 1262, 1264, 1268, 1270, 1276, 1277, 1278, 1280, 1288, 1295, 1298, 1300, 1316, 1317, 1330, 1334, 1361, 1369, 1370, 1404, 1406, 1407, 1411, 1413, 1414, 1415, 1418, 1419, 1420, 1428, 1430, 1431, 1434, 1435, 1436, 1447, 1451, 1452, 1459, 1460, 1461, 1480, 1491, 1510, 1546, 1557, 1558, 1560, 1566, 1570, 1578, 1585, 1587, 1593, 1594, 1596, 1606, 1610, 1612, 1643, 1647, 1704, 1714, 1736, 1737, 1742, 1746, 1750, 1753, 1754, 1755, 1756, 1757, 1767, 1768, 1770, 1771, 1772, 1781, 1785, 1787, 1789, 1791, 1798, 1801, 1808, 1810, 1814, 1817, 1824, 1828, 1829, 1832, 1833, 1837, 1838, 1839, 1841, 1842, 1844], "do_ccd_disp": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "do_cd": 1809, "do_cub": 76, "do_dii": [0, 1, 2, 1279, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "do_disp_exch_sinf": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "do_incfock_it": [18, 66], "do_ind30_exch_sinf": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "do_ind_exch_sinf": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "do_level_shift": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "do_mbpt_disp": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "do_mirror": 106, "do_plot": 106, "do_resort": 106, "do_rot": 106, "do_sc": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "do_shift": 106, "do_so": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "do_third_ord": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "do_virtu": 150, "do_wk": 92, "doc": [268, 323, 1736, 1737, 1738, 1748, 1764, 1786, 1787, 1788, 1804, 1808, 1810, 1814, 1815, 1823, 1828], "docc": [0, 1, 2, 13, 1168, 1172, 1704, 1714, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "doccpi": 150, "doccupi": [589, 1206, 1704], "docker": 1787, "dockerhub": 1788, "docstr": [3, 6, 7, 8, 9, 12, 13, 14, 18, 19, 21, 22, 23, 24, 25, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 66, 67, 68, 75, 77, 78, 80, 84, 85, 86, 90, 92, 96, 102, 105, 108, 111, 114, 119, 123, 128, 129, 130, 131, 133, 138, 145, 146, 147, 150, 183, 184, 233, 1764, 1808], "doctsr": [30, 147], "document": [0, 1, 3, 5, 6, 7, 8, 9, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 26, 27, 29, 30, 61, 62, 63, 64, 66, 68, 70, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 86, 87, 88, 89, 90, 91, 92, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 108, 110, 111, 112, 113, 114, 115, 118, 119, 120, 122, 126, 128, 130, 131, 132, 133, 134, 135, 137, 138, 139, 140, 141, 143, 144, 145, 147, 148, 149, 150, 183, 184, 267, 275, 292, 321, 322, 323, 324, 325, 326, 327, 329, 343, 671, 1206, 1704, 1734, 1738, 1743, 1750, 1752, 1754, 1756, 1757, 1759, 1767, 1770, 1777, 1781, 1782, 1787, 1795, 1796, 1803, 1804, 1805, 1806, 1808, 1815, 1817, 1823, 1828, 1831, 1832, 1833, 1837, 1838], "document_psivari": 1764, "doe": [2, 8, 84, 106, 138, 150, 255, 278, 284, 329, 351, 380, 640, 661, 738, 761, 774, 874, 887, 946, 1121, 1124, 1206, 1208, 1209, 1210, 1213, 1221, 1224, 1225, 1240, 1281, 1704, 1714, 1730, 1736, 1738, 1740, 1743, 1748, 1754, 1755, 1756, 1767, 1768, 1770, 1774, 1781, 1785, 1801, 1802, 1817, 1824, 1828, 1829, 1833, 1837, 1838, 1842, 1843, 1844], "doesn": [153, 370, 605, 697, 1206, 1704, 1714, 1735, 1738, 1740, 1743, 1748, 1770, 1774, 1786, 1788, 1801, 1809, 1842], "doi": [297, 347, 377, 967, 968, 969, 970, 980, 981, 982, 1231, 1616, 1617, 1692, 1704, 1714, 1734, 1740, 1752, 1761, 1762, 1776, 1781, 1842], "doi_": 1763, "doi_basis_toler": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "doi_pruning_schem": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "doi_radial_point": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "doi_spherical_point": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dollar": [1764, 1832], "domain": [295, 322, 324, 325, 443, 445, 479, 519, 522, 543, 546, 978, 979, 980, 982, 983, 1199, 1200, 1202, 1203, 1209, 1214, 1231, 1505, 1672, 1704, 1738, 1754, 1766, 1776, 1777, 1782, 1790, 1803, 1828, 1844], "domin": [2, 342, 1692, 1752, 1828, 1837, 1838, 1844], "domo": 1750, "don": [2, 84, 786, 1210, 1704, 1737, 1738, 1743, 1748, 1757, 1764, 1785, 1786, 1788, 1801, 1809, 1810, 1828, 1838, 1844], "donchev": 1734, "done": [277, 295, 342, 356, 570, 664, 764, 986, 989, 1206, 1209, 1215, 1704, 1714, 1738, 1743, 1746, 1748, 1753, 1754, 1756, 1760, 1763, 1766, 1767, 1781, 1801, 1804, 1808, 1828, 1836, 1838, 1842, 1844], "dopenmp_cxx_flag": 1738, "dopenmp_library_dir": 1738, "doption": 1808, "dot": [11, 100, 148, 149, 329, 1738, 1740, 1810, 1835], "doubl": [0, 1, 89, 92, 95, 103, 114, 150, 159, 171, 175, 176, 211, 212, 238, 239, 246, 248, 254, 255, 262, 284, 295, 318, 319, 376, 381, 382, 397, 400, 401, 408, 415, 432, 436, 437, 439, 442, 443, 449, 450, 455, 470, 472, 473, 479, 491, 496, 499, 500, 518, 519, 529, 542, 543, 552, 666, 714, 722, 729, 736, 737, 738, 739, 740, 744, 747, 752, 754, 759, 761, 772, 774, 777, 779, 780, 781, 818, 835, 841, 850, 852, 854, 856, 857, 873, 876, 884, 893, 902, 903, 904, 905, 907, 908, 916, 923, 924, 928, 930, 933, 936, 937, 938, 939, 943, 949, 953, 955, 957, 958, 967, 971, 972, 973, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 987, 988, 1001, 1002, 1023, 1029, 1030, 1034, 1051, 1053, 1054, 1055, 1058, 1067, 1068, 1072, 1079, 1081, 1082, 1084, 1085, 1086, 1101, 1110, 1113, 1131, 1135, 1137, 1140, 1174, 1178, 1184, 1188, 1196, 1197, 1198, 1199, 1200, 1202, 1203, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1245, 1246, 1247, 1256, 1257, 1265, 1266, 1269, 1271, 1272, 1273, 1274, 1275, 1283, 1285, 1287, 1289, 1290, 1294, 1299, 1301, 1303, 1326, 1328, 1331, 1332, 1335, 1340, 1341, 1343, 1344, 1345, 1348, 1349, 1350, 1351, 1353, 1362, 1364, 1365, 1366, 1382, 1387, 1388, 1389, 1396, 1405, 1410, 1424, 1427, 1438, 1440, 1442, 1444, 1455, 1462, 1469, 1473, 1474, 1476, 1478, 1481, 1482, 1486, 1487, 1488, 1489, 1497, 1498, 1499, 1503, 1504, 1506, 1511, 1512, 1513, 1514, 1516, 1519, 1520, 1522, 1523, 1525, 1529, 1530, 1531, 1538, 1539, 1540, 1543, 1545, 1552, 1555, 1556, 1567, 1569, 1570, 1571, 1572, 1573, 1588, 1598, 1600, 1602, 1603, 1604, 1605, 1616, 1617, 1618, 1621, 1622, 1627, 1638, 1644, 1648, 1650, 1654, 1660, 1665, 1667, 1669, 1674, 1675, 1676, 1680, 1684, 1690, 1695, 1697, 1698, 1700, 1702, 1704, 1714, 1740, 1741, 1743, 1744, 1745, 1746, 1748, 1749, 1754, 1755, 1764, 1766, 1770, 1775, 1776, 1785, 1789, 1792, 1793, 1795, 1800, 1801, 1806, 1809, 1810, 1817, 1826, 1828, 1829, 1837, 1838, 1841, 1842, 1843, 1844], "doublet": [100, 314, 576, 1206, 1704, 1714, 1791, 1837, 1838, 1842], "doubli": [150, 1123, 1127, 1164, 1177, 1221, 1222, 1692, 1704, 1742, 1750, 1752, 1755, 1776, 1789, 1801, 1810, 1829, 1833, 1838], "doubt": [1838, 1843], "dougla": [1122, 1221, 1704, 1730, 1762], "douglass": 1836, "dovirtu": [104, 314, 1791], "dowload": 1806, "down": [2, 342, 1231, 1508, 1704, 1738, 1743, 1767, 1770, 1774, 1786, 1804, 1837, 1838, 1841], "downhil": [1828, 1844], "download": [1735, 1736, 1737, 1738, 1743, 1749, 1750, 1759, 1767, 1773, 1774, 1782, 1783, 1784, 1785, 1787, 1803, 1805, 1806, 1824], "download_command": 1738, "downloads_updat": 1788, "downsampl": 1788, "downstream": [1, 1738, 1746, 1749, 1754, 1762, 1765, 1773, 1775, 1782, 1783, 1784, 1788, 1803, 1839], "doxygen": [993, 1215, 1704, 1746], "dozen": [1742, 1755, 1782], "dpd": [728, 849, 1208, 1210, 1704, 1708], "dpd_id": 90, "dpd_info": 187, "dpdbuf4": 1827, "dpdfile2": 1827, "dpotr": 1810, "dpotrf": 1810, "dpotri": 1810, "dpt": [677, 1206, 1704], "dpt2": [677, 1206, 1704], "dpt4": [677, 1206, 1704], "dpt6": [677, 1206, 1704], "dpython_execut": 1738, "dpython_include_dir": 1738, "dpython_librari": 1738, "dq0": [386, 1772], "dqg": 1729, "dr": [1757, 1788], "draft": 1788, "draw": 1804, "drawback": 1837, "drc": 13, "dreuw": [0, 1734, 1781], "dreuw2005": [1734, 1841], "drink": [605, 1206, 1704], "drive": [342, 356, 1743, 1767, 1801, 1802, 1824, 1843], "driven": [1743, 1807, 1823, 1824], "driver": [2, 84, 106, 150, 235, 236, 250, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 1070, 1076, 1088, 1219, 1231, 1629, 1704, 1711, 1714, 1730, 1735, 1736, 1740, 1743, 1752, 1755, 1757, 1759, 1761, 1764, 1767, 1768, 1769, 1771, 1777, 1779, 1785, 1794, 1797, 1800, 1808, 1812, 1819, 1828, 1831, 1832, 1834, 1837, 1838, 1841, 1842, 1843, 1844], "driver_cb": [284, 1740, 1794], "driver_cbs_help": 1740, "driver_findif": [1772, 1794], "driver_nbodi": [1768, 1794], "driver_nbody_multilevel": 1794, "driverenum": [265, 1740, 1768, 1772, 1794], "drop": [0, 344, 601, 1043, 1046, 1052, 1206, 1218, 1704, 1738, 1743, 1763, 1781, 1788], "dropped_docc": 1810, "dropped_uocc": 1810, "drot": 1810, "drv": 13, "dsd": [295, 1695, 1696, 1697, 1698, 1700, 1702, 1714, 1758, 1766, 1842], "dsimint_dir": 1839, "dsyev": 1810, "dsymm": 1810, "dsymv": 1810, "dt": [284, 295, 1112, 1221, 1704, 1708, 1714, 1740, 1741, 1743, 1750, 1766, 1779, 1832, 1842], "dto": 1833, "dtq": [284, 1733, 1740], "dtq5": 1733, "dtq56": [1730, 1733], "dtrmm": 1810, "dtrmv": 1810, "dtrsm": 1810, "dtype": [106, 1768], "du": [1734, 1841], "dual": [1707, 1730, 1731, 1750, 1838], "dual_descriptor": [1112, 1221, 1704, 1750], "dual_n_homo": [1112, 1221, 1704, 1750], "dub": 1840, "due": [586, 727, 1206, 1208, 1226, 1231, 1335, 1626, 1629, 1634, 1704, 1714, 1724, 1743, 1748, 1753, 1756, 1757, 1763, 1782, 1799, 1802, 1808, 1810, 1824, 1829, 1837, 1838, 1841, 1842], "dum": 98, "dummi": [106, 318, 319, 380, 386, 1714, 1726, 1740, 1768, 1772, 1785, 1788, 1794, 1800, 1802, 1835, 1842], "dump": [21, 644, 767, 1104, 1206, 1209, 1221, 1704, 1754, 1788, 1801], "dun": [1707, 1730, 1731, 1836], "duplic": [150, 263, 344], "durat": 1743, "dure": [84, 87, 92, 106, 656, 679, 699, 706, 756, 972, 982, 1002, 1005, 1006, 1007, 1009, 1099, 1179, 1206, 1208, 1214, 1215, 1220, 1222, 1231, 1565, 1641, 1642, 1704, 1711, 1714, 1737, 1738, 1746, 1757, 1759, 1767, 1768, 1770, 1774, 1775, 1799, 1802, 1817, 1824, 1828, 1833, 1838, 1842, 1844], "duti": 1738, "dvec": [867, 1210, 1673, 1704, 1776], "dvipng": 1764, "dvirtual": [589, 1206, 1704], "dx": [388, 1231, 1583, 1589, 1704, 1714, 1842], "dy": [388, 1714, 1842], "dyld_library_path": 1808, "dylib": 1738, "dyn": [673, 1206, 1704], "dyn_hyp": [669, 1206, 1704], "dyn_pol": [669, 1206, 1704], "dynam": [293, 669, 673, 1206, 1226, 1305, 1344, 1345, 1704, 1714, 1738, 1756, 1763, 1802, 1822, 1838, 1842], "dynamic_level": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dz": [388, 1694, 1707, 1714, 1730, 1731, 1732, 1733, 1802, 1842], "dzp": [1694, 1707, 1711, 1714, 1731, 1732, 1733, 1743, 1802, 1842], "dzvp": [1694, 1707, 1731, 1732], "e": [0, 2, 8, 11, 74, 76, 81, 84, 106, 139, 150, 226, 265, 266, 267, 268, 270, 276, 285, 287, 288, 289, 291, 295, 296, 297, 300, 301, 302, 314, 317, 318, 319, 322, 325, 336, 338, 339, 340, 341, 346, 347, 354, 356, 365, 374, 377, 386, 393, 395, 433, 444, 466, 482, 507, 514, 574, 575, 586, 609, 668, 669, 680, 697, 781, 795, 823, 875, 884, 893, 1002, 1106, 1107, 1147, 1199, 1200, 1201, 1202, 1206, 1209, 1210, 1211, 1215, 1221, 1224, 1225, 1226, 1228, 1229, 1230, 1231, 1232, 1235, 1241, 1242, 1327, 1380, 1434, 1438, 1453, 1478, 1490, 1506, 1543, 1658, 1666, 1692, 1704, 1706, 1708, 1713, 1714, 1722, 1730, 1734, 1737, 1738, 1740, 1743, 1746, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1759, 1760, 1763, 1764, 1766, 1767, 1768, 1769, 1770, 1772, 1774, 1776, 1777, 1779, 1780, 1782, 1785, 1786, 1787, 1789, 1791, 1792, 1794, 1795, 1799, 1800, 1802, 1804, 1805, 1808, 1809, 1812, 1814, 1817, 1824, 1828, 1829, 1832, 1833, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "e0": [390, 1706], "e10": 1706, "e11": 1706, "e12": 1706, "e13": 1706, "e14": 1706, "e15": 1706, "e17": 1706, "e18": 1706, "e19": 1706, "e2014": 1781, "e21": 1706, "e22": 1706, "e23": 1706, "e24": 1706, "e25": 1706, "e25945": 1734, "e26": 1706, "e32": 1706, "e33": 1706, "e34": 1706, "e35": 1706, "e39": 1706, "e3_scal": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "e4": 1706, "e41": 1706, "e5": 1706, "e50": 1706, "e6": 1706, "e7": 1706, "e8": 1706, "e9": 1706, "e_": [284, 864, 1029, 1210, 1218, 1230, 1442, 1444, 1454, 1704, 1740, 1741, 1753, 1756, 1757, 1759, 1760, 1763, 1776, 1837, 1838], "e_0": 1771, "e_c": 1771, "e_conv": [84, 276], "e_converg": [0, 1, 2, 326, 432, 930, 958, 1086, 1266, 1290, 1605, 1704, 1730, 1733, 1735, 1739, 1740, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "e_h": [1706, 1776, 1795], "e_int": [1828, 1844], "e_mp2": [1832, 1834], "e_mp25": 1834, "e_mp3": 1834, "e_scf": 1834, "e_scs_mp2": 1832, "e_tdm_len": [1231, 1657, 1704, 1841], "e_tdm_vel": [1231, 1657, 1704, 1841], "ea": [104, 1714, 1777, 1780, 1842], "ea_pol": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "each": [0, 2, 92, 106, 110, 111, 154, 155, 156, 157, 158, 159, 182, 259, 277, 284, 286, 295, 298, 318, 319, 327, 329, 337, 342, 348, 356, 470, 551, 569, 593, 609, 659, 660, 784, 787, 794, 819, 823, 842, 897, 1032, 1033, 1069, 1097, 1115, 1116, 1125, 1126, 1200, 1203, 1206, 1210, 1211, 1218, 1219, 1220, 1221, 1224, 1229, 1230, 1231, 1241, 1431, 1432, 1434, 1462, 1650, 1704, 1714, 1730, 1733, 1738, 1740, 1742, 1743, 1750, 1752, 1753, 1754, 1757, 1759, 1763, 1764, 1766, 1767, 1768, 1770, 1771, 1772, 1775, 1776, 1779, 1781, 1782, 1786, 1794, 1798, 1799, 1800, 1801, 1802, 1808, 1809, 1810, 1817, 1824, 1828, 1829, 1832, 1833, 1835, 1837, 1838, 1841, 1842, 1844], "earli": [2, 1231, 1490, 1499, 1704, 1757, 1781, 1783, 1817, 1824, 1837, 1838], "earlier": [170, 1738, 1759, 1770], "earliest": [1738, 1824], "eas": [1730, 1781], "easi": [1737, 1740, 1752, 1757, 1764, 1767, 1770, 1778, 1786, 1797, 1817, 1824, 1838], "easier": [1102, 1221, 1704, 1736, 1738, 1755, 1767, 1798, 1799, 1810, 1819, 1828, 1833, 1838, 1844], "easiest": [2, 1738, 1755], "easili": [2, 1751, 1753, 1755, 1759, 1767, 1804, 1810, 1824, 1828, 1836, 1844], "easiset": 1844, "eb": [104, 374, 395], "ecc": [586, 1206, 1704, 1711, 1743], "ecd": [377, 1841], "ecd_residu": 1841, "ecd_spectrum": 1841, "echo": [1738, 1748, 1767, 1808], "ecosystem": [1786, 1787, 1824, 1832], "ecp": [8, 106, 1125, 1221, 1228, 1392, 1704, 1714, 1738, 1743, 1765, 1771, 1774, 1790, 1828, 1832, 1837, 1842, 1844], "ecp2": [1714, 1842], "ecp3": [1714, 1842], "ecp_shel": 8, "ecp_shell_on_cent": 8, "ecpint": [1738, 1765], "ecpint_dir": 1765, "ed": [1692, 1743, 1752, 1770, 1781], "edeprince3": 1738, "edf1": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "edf2": [295, 318, 319, 1695, 1698, 1700, 1703, 1758, 1766, 1800], "edfmp2": 1832, "edg": [0, 1750, 1781], "edii": [1231, 1550, 1615, 1704, 1714, 1838, 1842], "edim": 1837, "edit": [2, 1734, 1738, 1759, 1764, 1767, 1774, 1783, 1785, 1786, 1788, 1804, 1808, 1834, 1835], "editor": [1777, 1814, 1844], "edu": [2, 285, 296, 336, 1692, 1748, 1750, 1752, 1769, 1781], "edward": [1783, 1837], "eff": 1829, "effect": [8, 106, 111, 130, 247, 284, 295, 441, 471, 477, 478, 517, 574, 602, 611, 632, 633, 634, 639, 652, 656, 677, 694, 746, 810, 827, 1070, 1076, 1088, 1096, 1199, 1200, 1201, 1202, 1206, 1208, 1210, 1216, 1219, 1229, 1407, 1412, 1413, 1414, 1519, 1615, 1678, 1704, 1738, 1740, 1742, 1748, 1753, 1757, 1759, 1762, 1766, 1770, 1771, 1781, 1788, 1790, 1794, 1798, 1801, 1802, 1804, 1810, 1821, 1829, 1832, 1836, 1837, 1839], "effici": [106, 356, 471, 635, 652, 726, 1200, 1206, 1208, 1229, 1230, 1231, 1431, 1432, 1443, 1663, 1704, 1734, 1738, 1739, 1753, 1755, 1756, 1757, 1759, 1763, 1767, 1774, 1781, 1798, 1802, 1810, 1817, 1821, 1824, 1831, 1833, 1837, 1838, 1841], "effort": [1757, 1763, 1767, 1771, 1822, 1838], "efp": [103, 295, 318, 319, 400, 1011, 1012, 1014, 1015, 1016, 1017, 1019, 1020, 1022, 1704, 1705, 1709, 1722, 1738, 1766, 1767, 1776, 1780, 1781, 1785, 1800, 1809, 1832, 1838], "efp_disp": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "efp_disp_damp": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "efp_elst": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "efp_elst_damp": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "efp_exch": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "efp_ind": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "efp_ind_damp": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "efp_pol": [1017, 1216, 1704], "efp_pol_damp": [1018, 1216, 1704], "efp_qm_elst": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "efp_qm_ind": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "efpfrag": 1785, "efzc": 150, "eg": [284, 1740], "egidi": 1734, "eh": [106, 267, 377, 386, 390, 399, 1752, 1756, 1759, 1761, 1774, 1776, 1828, 1844], "ehlert": 1734, "ehrlich": 1734, "ei": 1799, "eigen": [1735, 1738], "eigendecomposit": [1714, 1838, 1842], "eigenfunct": [1757, 1838], "eigenpair": 342, "eigenproblem": [0, 1841], "eigensolv": 1841, "eigenvalu": [0, 63, 115, 150, 277, 297, 329, 342, 347, 356, 603, 609, 640, 656, 681, 756, 799, 811, 1206, 1208, 1210, 1230, 1231, 1462, 1506, 1602, 1690, 1704, 1755, 1756, 1776, 1798, 1810, 1829, 1837, 1838, 1841], "eigenvector": [342, 356, 389, 603, 635, 638, 652, 667, 681, 830, 1206, 1210, 1226, 1231, 1362, 1556, 1649, 1669, 1704, 1708, 1757, 1776, 1785, 1810, 1829, 1838, 1841], "eight": [1692, 1752, 1838], "eigvalu": 100, "eigvector": 100, "einstein": [1669, 1753, 1776], "einsum": [185, 1738], "either": [2, 75, 92, 100, 106, 148, 208, 209, 210, 318, 319, 350, 371, 569, 577, 593, 660, 666, 706, 781, 845, 889, 1156, 1206, 1209, 1210, 1221, 1226, 1228, 1229, 1231, 1339, 1368, 1384, 1433, 1655, 1704, 1714, 1730, 1735, 1738, 1748, 1749, 1752, 1754, 1757, 1764, 1767, 1774, 1781, 1785, 1788, 1795, 1797, 1800, 1801, 1802, 1803, 1808, 1809, 1810, 1817, 1828, 1833, 1837, 1838, 1841, 1842, 1844], "ek": 1737, "ekt": [1225, 1295, 1704], "ekt_ea": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ekt_ip": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "elabor": [279, 701, 1206, 1704, 1832, 1833], "elbl": [106, 1768], "elea": [106, 1768], "elec": 1843, "electon": 1776, "electostat": 1837, "electr": [71, 89, 103, 402, 539, 604, 669, 674, 709, 711, 712, 776, 1197, 1203, 1206, 1209, 1231, 1657, 1704, 1706, 1714, 1742, 1754, 1770, 1776, 1799, 1817, 1841, 1842], "electric_const": 1706, "electric_field": [89, 103], "electric_field_valu": 103, "electricfieldint": [1817, 1827], "electron": [0, 2, 8, 13, 26, 69, 76, 84, 90, 94, 103, 112, 128, 144, 150, 268, 284, 285, 286, 294, 295, 297, 298, 300, 301, 302, 306, 307, 317, 318, 319, 336, 337, 345, 347, 348, 365, 368, 377, 386, 390, 422, 476, 531, 559, 608, 613, 619, 625, 669, 671, 677, 679, 693, 695, 727, 745, 782, 785, 789, 790, 796, 797, 798, 835, 858, 859, 860, 875, 877, 878, 879, 890, 895, 942, 1125, 1156, 1167, 1198, 1200, 1202, 1204, 1206, 1208, 1210, 1211, 1213, 1221, 1225, 1230, 1258, 1261, 1263, 1278, 1459, 1461, 1690, 1704, 1706, 1711, 1714, 1730, 1734, 1738, 1739, 1740, 1742, 1750, 1753, 1755, 1756, 1757, 1760, 1762, 1766, 1767, 1768, 1770, 1772, 1776, 1777, 1781, 1785, 1786, 1789, 1790, 1791, 1792, 1798, 1800, 1803, 1805, 1809, 1810, 1823, 1824, 1828, 1829, 1833, 1835, 1836, 1837, 1838, 1839, 1842, 1843, 1844], "electron_charge_to_mass_quoti": 1706, "electron_deuteron_mag_mom_ratio": 1706, "electron_deuteron_mass_ratio": 1706, "electron_g_factor": 1706, "electron_gyromag_ratio": 1706, "electron_gyromag_ratio_over_2_pi": 1706, "electron_helion_mass_ratio": 1706, "electron_mag_mom": 1706, "electron_mag_mom_anomali": 1706, "electron_mag_mom_to_bohr_magneton_ratio": 1706, "electron_mag_mom_to_nuclear_magneton_ratio": 1706, "electron_mass": 1706, "electron_mass_energy_equival": 1706, "electron_mass_energy_equivalent_in_mev": 1706, "electron_mass_in_u": 1706, "electron_molar_mass": 1706, "electron_muon_mag_mom_ratio": 1706, "electron_muon_mass_ratio": 1706, "electron_neutron_mag_mom_ratio": 1706, "electron_neutron_mass_ratio": 1706, "electron_proton_mag_mom_ratio": 1706, "electron_proton_mass_ratio": 1706, "electron_schem": 1750, "electron_tau_mass_ratio": 1706, "electron_to_alpha_particle_mass_ratio": 1706, "electron_to_shielded_helion_mag_mom_ratio": 1706, "electron_to_shielded_proton_mag_mom_ratio": 1706, "electron_triton_mass_ratio": 1706, "electron_volt": 1706, "electron_volt_atomic_mass_unit_relationship": 1706, "electron_volt_hartree_relationship": 1706, "electron_volt_hertz_relationship": 1706, "electron_volt_inverse_meter_relationship": 1706, "electron_volt_joule_relationship": 1706, "electron_volt_kelvin_relationship": 1706, "electron_volt_kilogram_relationship": 1706, "electrophil": 1750, "electrostat": [72, 76, 89, 103, 111, 150, 1014, 1015, 1019, 1216, 1230, 1464, 1692, 1704, 1714, 1730, 1733, 1750, 1752, 1770, 1776, 1791, 1799, 1803, 1828, 1837, 1842, 1844], "electrostatic_potential_valu": 103, "electrostaticint": [1817, 1827], "eleg": 1844, "elem": [106, 1768], "element": [0, 2, 13, 64, 88, 100, 106, 137, 148, 295, 300, 301, 302, 318, 319, 329, 388, 400, 509, 550, 575, 615, 627, 667, 684, 836, 874, 1126, 1201, 1203, 1206, 1210, 1221, 1225, 1230, 1279, 1445, 1704, 1730, 1733, 1740, 1742, 1753, 1754, 1756, 1757, 1759, 1763, 1766, 1768, 1770, 1772, 1774, 1777, 1782, 1794, 1798, 1800, 1802, 1803, 1810, 1817, 1823, 1829, 1833, 1835, 1837, 1838, 1843, 1844], "elementari": [1706, 1755, 1777], "elementary_charg": 1706, "elementary_charge_over_h": 1706, "elev": 323, "elez": [106, 1768], "elf": [1112, 1221, 1704, 1750], "elfa": [1112, 1221, 1704, 1750], "elfb": [1112, 1221, 1704, 1750], "elif": 1809, "elimin": [73, 628, 794, 833, 885, 1206, 1210, 1704, 1817, 1838], "ell_": 1733, "elong": 1817, "els": [86, 106, 200, 875, 934, 1025, 1026, 1027, 1210, 1213, 1217, 1231, 1578, 1704, 1759, 1763, 1772, 1774, 1775, 1787, 1788, 1791, 1809], "elsewher": [1736, 1767, 1815], "elst": [76, 346, 1678, 1679, 1689, 1714, 1770, 1776, 1837, 1842], "elst10": [346, 1230, 1445, 1679, 1689, 1704, 1776, 1828, 1837, 1844], "elst12": [1689, 1776, 1837], "elst13": [1689, 1776, 1837], "elucid": [1757, 1838], "em": [1231, 1534, 1633, 1704], "emb": 1775, "embarrass": [1777, 1786, 1831], "embarrassingli": [1752, 1824, 1840], "embed": [73, 1152, 1221, 1228, 1687, 1704, 1738, 1752, 1770, 1776, 1780, 1781, 1794, 1817, 1824], "embedding_charg": 1794, "embellish": 1832, "embpot": [1231, 1589, 1704], "emerg": 1824, "emiss": 1776, "eml": 1710, "emona": 1837, "emonb": 1837, "emphas": [282, 332, 1781, 1838], "emphasi": 1757, "empir": [267, 394, 1757, 1774, 1780, 1802, 1837], "empirical_disp": 1770, "empirical_dispers": [1757, 1759, 1827], "empirical_dispersion_resourc": [267, 1759], "empiricaldispers": [1759, 1827], "emploi": [0, 106, 284, 662, 835, 863, 1206, 1210, 1230, 1444, 1704, 1740, 1743, 1752, 1754, 1781, 1801, 1802, 1836, 1837, 1838, 1841], "empti": [8, 100, 148, 171, 267, 331, 1108, 1111, 1221, 1704, 1714, 1738, 1743, 1750, 1759, 1774, 1797, 1808, 1842], "emsl": [1730, 1785], "emul": [342, 356], "en": [1738, 1748, 1821], "enabl": [1, 18, 84, 1095, 1105, 1219, 1221, 1228, 1230, 1231, 1385, 1386, 1468, 1498, 1615, 1704, 1717, 1738, 1746, 1748, 1749, 1754, 1759, 1762, 1765, 1771, 1772, 1775, 1782, 1783, 1785, 1798, 1803, 1817, 1822, 1824, 1837, 1838, 1839], "enable_": [1785, 1788], "enable_adcc": [1, 1738], "enable_ambit": 1738, "enable_brianqc": [1735, 1738], "enable_bs": 1738, "enable_ccsort": 1738, "enable_cct3": 1738, "enable_chemps2": [1738, 1746], "enable_cpp": [1738, 1749], "enable_ddx": [1738, 1754], "enable_dkh": [1738, 1762], "enable_ecpint": [1738, 1765], "enable_efp": [106, 1768], "enable_einsum": 1738, "enable_gauxc": [1738, 1838], "enable_gdma": [1738, 1775], "enable_gpu_dfcc": 1738, "enable_libefp": [1738, 1782], "enable_mdi": 1738, "enable_pastur": 1738, "enable_pcmsolv": [1738, 1803], "enable_psi4fockci": 1738, "enable_qm": [106, 1768], "enable_simint": [1738, 1839], "enable_snsmp2": 1738, "enable_transqt2": 1738, "enable_v2rdm_casscf": 1738, "enantiom": [1714, 1842], "encapsul": [1757, 1838], "enclos": 1743, "encod": [106, 1740, 1764, 1782, 1808], "encompass": 1802, "encount": [0, 656, 726, 1206, 1208, 1704, 1730, 1733, 1755, 1756, 1810, 1833, 1838], "encourag": [697, 1206, 1704, 1748, 1770, 1786], "end": [0, 2, 5, 137, 700, 844, 849, 934, 1025, 1026, 1027, 1206, 1210, 1213, 1217, 1231, 1490, 1555, 1578, 1649, 1704, 1736, 1738, 1740, 1743, 1748, 1750, 1752, 1757, 1767, 1772, 1776, 1781, 1785, 1788, 1791, 1794, 1801, 1810, 1824, 1828, 1832, 1833, 1834, 1836, 1838, 1841, 1843, 1844], "endif": 1738, "energet": [0, 1770, 1836, 1838], "energi": [0, 2, 11, 26, 73, 76, 84, 95, 106, 140, 150, 161, 167, 190, 262, 265, 267, 268, 276, 284, 286, 287, 291, 294, 296, 297, 298, 300, 301, 302, 307, 312, 314, 317, 318, 319, 337, 338, 341, 345, 346, 347, 348, 356, 365, 368, 369, 377, 378, 386, 390, 413, 439, 446, 453, 473, 484, 499, 562, 568, 574, 581, 586, 597, 599, 601, 608, 610, 615, 617, 626, 635, 641, 657, 658, 660, 665, 667, 681, 692, 698, 707, 726, 727, 737, 738, 741, 753, 758, 801, 818, 833, 835, 841, 850, 856, 862, 876, 921, 922, 924, 941, 971, 985, 986, 989, 1006, 1012, 1014, 1015, 1016, 1017, 1019, 1020, 1079, 1089, 1090, 1091, 1121, 1125, 1175, 1178, 1198, 1199, 1200, 1204, 1205, 1206, 1208, 1210, 1213, 1214, 1215, 1216, 1217, 1219, 1221, 1222, 1224, 1225, 1226, 1229, 1230, 1231, 1233, 1236, 1241, 1244, 1254, 1255, 1256, 1257, 1259, 1260, 1277, 1293, 1350, 1410, 1441, 1444, 1552, 1605, 1619, 1658, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1704, 1706, 1711, 1713, 1714, 1715, 1716, 1721, 1723, 1726, 1727, 1730, 1734, 1735, 1738, 1739, 1740, 1741, 1742, 1743, 1746, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1767, 1768, 1769, 1770, 1771, 1772, 1774, 1776, 1777, 1779, 1781, 1782, 1785, 1789, 1791, 1792, 1794, 1795, 1796, 1798, 1799, 1800, 1802, 1803, 1805, 1806, 1808, 1809, 1823, 1824, 1828, 1829, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1840, 1841, 1842, 1843, 1844], "energy1": [1714, 1842], "energy2": [1714, 1842], "energy_": 150, "energy_body_dict": 1794, "energy_level_shift": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "eneronli": [615, 635, 1206, 1704], "eneyn": 1833, "enforc": [1755, 1786, 1801, 1802, 1817, 1832, 1837, 1841], "engag": [1748, 1788], "engel": 1734, "engin": [267, 312, 318, 319, 329, 342, 356, 1759, 1800, 1802], "engrad": [1714, 1842], "enhanc": [583, 1206, 1704, 1757, 1777, 1804, 1810, 1838], "enlighten": 1740, "enorm": [1757, 1781], "enough": [574, 1206, 1230, 1480, 1704, 1752, 1755, 1763, 1767, 1824, 1828, 1832, 1837, 1838, 1844], "ensu": 1833, "ensur": [2, 329, 575, 1125, 1206, 1221, 1226, 1306, 1704, 1735, 1738, 1755, 1767, 1769, 1770, 1771, 1775, 1792, 1799, 1801, 1804, 1817, 1821, 1832, 1837, 1838, 1841], "ensure_bt_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "entail": 1763, "enter": [284, 569, 593, 660, 1206, 1704, 1738, 1740, 1743, 1755, 1763, 1770, 1788, 1824, 1828], "enthalphi": 1843, "enthalpi": [1691, 1776, 1828, 1843, 1844], "entir": [8, 86, 446, 484, 811, 833, 837, 1199, 1200, 1210, 1231, 1490, 1704, 1742, 1743, 1753, 1755, 1763, 1767, 1770, 1781, 1782, 1785, 1802, 1823, 1824, 1832, 1833, 1837, 1838], "entireti": 1743, "entiti": 1808, "entri": [11, 73, 86, 106, 150, 170, 183, 184, 263, 328, 344, 357, 384, 385, 574, 609, 628, 1206, 1704, 1714, 1743, 1770, 1794, 1799, 1801, 1810, 1833, 1842], "entropi": [1828, 1843, 1844], "enuc": [298, 348], "enum": [265, 1740, 1772, 1794], "enumer": [384, 1743, 1776], "env": [1738, 1748, 1764, 1788], "enviro": 1808, "environ": [2, 357, 661, 1206, 1224, 1240, 1704, 1730, 1734, 1736, 1737, 1743, 1748, 1750, 1752, 1755, 1756, 1757, 1759, 1764, 1774, 1777, 1780, 1782, 1788, 1808, 1818, 1828], "environment": 1767, "envis": 1738, "envoron": 1735, "enyl": 1833, "eom": [295, 318, 319, 342, 381, 382, 471, 473, 474, 475, 476, 491, 495, 496, 498, 499, 500, 508, 605, 606, 608, 610, 613, 1200, 1201, 1206, 1224, 1236, 1704, 1714, 1742, 1766, 1781, 1800, 1826, 1842], "eom_cc2": [506, 1200, 1704], "eom_cc3": [503, 506, 1200, 1704], "eom_ccsd": [506, 1200, 1704], "eom_guess": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "eom_refer": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "eomcc": [607, 608, 1206, 1704], "eome": [605, 613, 1206, 1704], "eomea": [605, 613, 1206, 1704], "eomip": [605, 613, 1206, 1704], "ep": [1225, 1261, 1262, 1704], "ep2": [26, 295, 892, 897, 1211, 1704, 1766, 1781], "ep2_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ep2_maxit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ep2_num_ea": [0, 1, 2, 897, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ep2_num_ip": [0, 1, 2, 897, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ep2_orbit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ep_add": 1738, "ep_ea_pol": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ep_ip_pol": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ep_maxit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "epic": 1838, "epjd": 1781, "eponym": 1740, "epsilon": [298, 348, 1756, 1838], "epsilon_": [368, 369, 377, 1757, 1763, 1771], "epsilon_a": [150, 1756, 1763], "epsilon_a_subset": 150, "epsilon_b": [150, 1756, 1763], "epsilon_b_subset": 150, "epsilon_i": 1756, "epsilon_j": 1756, "eq": [1135, 1221, 1226, 1357, 1358, 1359, 1360, 1692, 1704, 1752, 1776, 1810, 1837], "eqn": 1761, "eqn_descript": [266, 270, 276], "equal": [2, 84, 139, 267, 368, 369, 383, 635, 652, 664, 794, 842, 1206, 1210, 1704, 1740, 1743, 1759, 1761, 1776, 1817, 1828, 1837, 1838, 1844], "equal_nan": 2, "equal_phas": 2, "equat": [0, 76, 84, 162, 164, 284, 295, 318, 319, 335, 381, 382, 447, 455, 457, 509, 529, 548, 552, 582, 583, 584, 585, 594, 595, 607, 639, 645, 646, 647, 658, 684, 736, 741, 746, 747, 750, 913, 929, 946, 1103, 1181, 1199, 1200, 1201, 1202, 1203, 1206, 1208, 1213, 1221, 1222, 1225, 1230, 1281, 1435, 1441, 1704, 1714, 1740, 1741, 1742, 1753, 1756, 1763, 1766, 1771, 1776, 1798, 1800, 1808, 1810, 1826, 1836, 1837, 1838, 1841, 1842], "equilibrium": [780, 1209, 1692, 1704, 1752, 1753, 1781, 1803], "equiv": 1763, "equival": [2, 283, 284, 333, 383, 574, 608, 617, 632, 696, 874, 1206, 1210, 1229, 1431, 1432, 1704, 1706, 1714, 1730, 1740, 1748, 1750, 1755, 1757, 1760, 1767, 1771, 1776, 1810, 1832, 1833, 1836, 1838, 1841, 1842], "eras": [1692, 1752, 1808], "erd": 81, "erd_coef": 81, "erf": [89, 103, 1196, 1223, 1704, 1714, 1757, 1842], "erf_complement_eri": 89, "erf_eri": 89, "erfc": [103, 1196, 1223, 1704, 1817], "eri": [89, 92, 103, 143, 144, 298, 310, 348, 361, 810, 915, 916, 1072, 1096, 1210, 1213, 1219, 1231, 1486, 1572, 1704, 1714, 1749, 1754, 1756, 1771, 1790, 1798, 1803, 1817, 1827, 1842], "eri2": [310, 361], "eri3": [310, 361], "eri_": 1817, "eric": [356, 1734], "erisiev": 1817, "erkal": 1838, "ernzerhof": [295, 318, 319, 1695, 1697, 1698, 1699, 1703, 1758, 1766, 1800], "error": [2, 5, 11, 106, 150, 192, 193, 195, 197, 200, 203, 204, 265, 266, 267, 268, 269, 270, 271, 272, 273, 276, 277, 278, 279, 280, 285, 287, 321, 336, 338, 383, 594, 656, 734, 735, 736, 747, 814, 815, 845, 876, 903, 904, 1176, 1206, 1208, 1210, 1212, 1222, 1225, 1226, 1229, 1230, 1231, 1245, 1246, 1247, 1250, 1251, 1253, 1254, 1255, 1265, 1272, 1273, 1274, 1275, 1367, 1408, 1421, 1422, 1444, 1491, 1547, 1548, 1549, 1568, 1571, 1616, 1617, 1670, 1692, 1704, 1708, 1714, 1740, 1742, 1743, 1746, 1752, 1755, 1757, 1759, 1763, 1764, 1767, 1768, 1774, 1776, 1781, 1782, 1785, 1786, 1792, 1794, 1797, 1798, 1802, 1808, 1809, 1810, 1828, 1837, 1838, 1842, 1844], "error_correct": [265, 1740, 1794], "errorcorrectionprotocol": [265, 1740, 1794], "escap": 1764, "escf": 1832, "escsmp2": 1832, "esp": [70, 1112, 1221, 1685, 1704, 1714, 1726, 1750, 1770, 1776, 1791, 1799, 1842], "esp_at_nuclei": [111, 150, 1799], "especi": [0, 2, 106, 726, 882, 1208, 1210, 1230, 1455, 1704, 1738, 1742, 1743, 1753, 1755, 1770, 1788, 1798, 1817, 1821, 1824, 1837, 1838], "esppropcalc": 1827, "essenti": [610, 1206, 1692, 1704, 1738, 1750, 1752, 1755, 1757, 1759, 1764, 1770, 1773, 1774, 1783, 1784, 1801, 1810, 1817, 1832, 1833, 1834, 1838, 1841], "essl": 1738, "est": [346, 1689, 1776, 1837], "establish": [1764, 1788], "estate_prop": [608, 1206, 1704], "estim": [808, 930, 949, 958, 1210, 1213, 1225, 1226, 1266, 1290, 1327, 1704, 1742, 1763, 1798, 1837, 1838], "et": [1, 786, 885, 1210, 1225, 1271, 1692, 1704, 1714, 1734, 1752, 1754, 1763, 1802, 1805, 1806, 1837, 1841, 1842], "etc": [2, 11, 76, 92, 106, 268, 284, 295, 300, 301, 302, 314, 318, 319, 381, 382, 389, 457, 581, 599, 603, 641, 667, 669, 691, 700, 813, 819, 900, 948, 992, 1126, 1130, 1158, 1170, 1199, 1206, 1210, 1212, 1213, 1215, 1221, 1224, 1225, 1231, 1235, 1248, 1507, 1704, 1708, 1714, 1733, 1738, 1740, 1742, 1743, 1746, 1748, 1752, 1754, 1755, 1757, 1763, 1764, 1766, 1767, 1770, 1772, 1776, 1779, 1780, 1781, 1782, 1788, 1791, 1792, 1794, 1799, 1800, 1801, 1802, 1804, 1808, 1809, 1810, 1820, 1821, 1825, 1826, 1828, 1829, 1832, 1833, 1837, 1842], "ethan": [1710, 1728, 1833], "ethanol": 1754, "ethen": [295, 1692, 1714, 1752, 1766, 1798, 1828, 1833, 1842, 1844], "ethin": [1692, 1714, 1752, 1842, 1844], "ethylen": [1714, 1828, 1842, 1844], "ethyn": [1714, 1828, 1833, 1842], "euclidean": 149, "eugen": [1771, 1782], "euler": 1782, "eur": 1781, "ev": [377, 550, 1203, 1704, 1706, 1742, 1841], "eval": 115, "evalu": [265, 277, 291, 317, 329, 341, 342, 356, 365, 568, 597, 604, 608, 615, 616, 666, 679, 707, 887, 1031, 1089, 1090, 1091, 1114, 1206, 1210, 1218, 1219, 1221, 1230, 1231, 1444, 1454, 1459, 1460, 1461, 1481, 1515, 1517, 1619, 1704, 1714, 1740, 1750, 1753, 1755, 1756, 1757, 1760, 1763, 1771, 1777, 1781, 1790, 1794, 1798, 1802, 1817, 1828, 1837, 1838, 1842, 1844], "evangelista": [1734, 1750, 1781, 1786, 1829, 1836], "evangelisti": [835, 874, 1210, 1704], "even": [106, 295, 318, 319, 342, 350, 356, 440, 570, 590, 614, 665, 707, 1199, 1206, 1224, 1226, 1230, 1231, 1238, 1312, 1464, 1465, 1466, 1565, 1606, 1704, 1738, 1742, 1755, 1756, 1757, 1763, 1764, 1766, 1767, 1768, 1771, 1782, 1785, 1786, 1788, 1800, 1802, 1828, 1832, 1833, 1838, 1844], "evenli": 1761, "event": [1742, 1747], "eventu": [2, 786, 1210, 1704, 1743, 1757, 1838], "ever": [1738, 1772, 1800, 1808, 1828, 1844], "everi": [2, 100, 111, 284, 359, 370, 390, 611, 700, 813, 1125, 1206, 1210, 1221, 1226, 1231, 1323, 1327, 1565, 1568, 1704, 1714, 1735, 1737, 1738, 1740, 1743, 1747, 1764, 1767, 1771, 1781, 1788, 1802, 1808, 1823, 1837, 1838, 1842, 1843], "everyon": 1804, "everyth": [84, 342, 356, 661, 1206, 1224, 1240, 1704, 1738, 1767, 1785, 1786, 1809, 1828, 1844], "evid": 1757, "evp": 356, "ewald": [1231, 1509, 1511, 1704, 1817], "ex": [318, 319, 1224, 1235, 1704, 1748, 1785, 1788, 1799, 1800, 1837], "ex_allow": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ex_level": [0, 1, 2, 819, 821, 859, 860, 875, 890, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ex_lvl": [794, 1210, 1704], "exact": [2, 100, 138, 608, 707, 835, 874, 1206, 1210, 1225, 1231, 1283, 1294, 1510, 1512, 1704, 1706, 1734, 1753, 1757, 1781, 1817, 1833, 1836, 1837, 1838], "exactli": [2, 284, 833, 1210, 1704, 1714, 1730, 1740, 1753, 1754, 1759, 1763, 1782, 1794, 1809, 1833, 1837, 1838, 1842], "examin": [1726, 1738, 1743, 1770, 1781, 1837], "exampl": [0, 1, 2, 11, 92, 100, 106, 148, 150, 262, 275, 278, 284, 288, 289, 291, 295, 296, 297, 300, 301, 302, 303, 306, 307, 314, 317, 318, 319, 326, 327, 331, 339, 340, 341, 346, 347, 365, 374, 376, 381, 382, 384, 386, 395, 397, 569, 574, 593, 601, 609, 616, 628, 660, 664, 671, 1126, 1206, 1221, 1704, 1714, 1723, 1726, 1730, 1735, 1738, 1740, 1741, 1742, 1743, 1746, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1781, 1782, 1783, 1784, 1785, 1788, 1789, 1790, 1791, 1792, 1794, 1795, 1796, 1797, 1799, 1800, 1801, 1802, 1803, 1808, 1810, 1817, 1823, 1824, 1826, 1828, 1832, 1833, 1834, 1835, 1838, 1839, 1841, 1842, 1844], "example_psi4rc_fil": 1767, "exc": [0, 1742], "exce": [859, 860, 875, 1095, 1210, 1219, 1231, 1535, 1704, 1767, 1771, 1794], "exceed": [318, 319, 755, 1208, 1704, 1800, 1802, 1838], "exceedingli": 1757, "excel": [1756, 1767, 1808, 1823, 1837], "except": [2, 84, 87, 106, 266, 268, 269, 270, 271, 272, 273, 276, 277, 278, 279, 280, 284, 318, 319, 393, 608, 611, 632, 633, 634, 641, 652, 656, 664, 665, 1125, 1206, 1221, 1704, 1714, 1730, 1738, 1740, 1742, 1743, 1746, 1755, 1756, 1757, 1764, 1770, 1771, 1776, 1795, 1796, 1800, 1801, 1809, 1821, 1827, 1828, 1832, 1837, 1838, 1842, 1844], "excess": [0, 568, 1206, 1704, 1797, 1837], "exch": [76, 346, 1230, 1231, 1444, 1454, 1469, 1470, 1475, 1526, 1678, 1679, 1689, 1704, 1714, 1770, 1776, 1837, 1842], "exch10": [1230, 1445, 1453, 1679, 1689, 1704, 1776, 1837], "exch11": [1689, 1776, 1837], "exch12": [1689, 1776, 1837], "exch_scale_alpha": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "exchang": [76, 92, 138, 295, 318, 319, 1016, 1041, 1042, 1046, 1064, 1216, 1218, 1230, 1231, 1441, 1448, 1449, 1450, 1453, 1464, 1470, 1512, 1663, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1714, 1730, 1733, 1734, 1743, 1757, 1758, 1763, 1766, 1770, 1776, 1781, 1790, 1800, 1817, 1828, 1842, 1844], "exchscal": 346, "excit": [0, 1, 84, 162, 295, 356, 368, 369, 377, 410, 418, 473, 474, 476, 488, 495, 498, 499, 520, 525, 526, 544, 549, 568, 608, 609, 610, 612, 613, 641, 659, 662, 665, 679, 692, 791, 794, 795, 800, 819, 820, 828, 859, 860, 868, 890, 992, 1071, 1127, 1164, 1197, 1198, 1200, 1202, 1203, 1206, 1210, 1215, 1219, 1221, 1224, 1229, 1231, 1235, 1236, 1419, 1430, 1579, 1581, 1650, 1655, 1668, 1690, 1704, 1714, 1730, 1733, 1743, 1746, 1755, 1757, 1763, 1766, 1771, 1776, 1781, 1785, 1790, 1795, 1798, 1803, 1805, 1810, 1828, 1829, 1833, 1841, 1842, 1844], "excitation_rang": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "excitedst": 0, "exclam": 1730, "exclud": [2, 106, 827, 1071, 1210, 1219, 1704, 1738, 1771, 1829], "exclus": 1837, "exec": [370, 1786, 1834], "execut": [0, 2, 87, 106, 267, 283, 333, 374, 395, 616, 1206, 1224, 1231, 1241, 1626, 1704, 1714, 1715, 1736, 1743, 1746, 1747, 1748, 1750, 1753, 1756, 1759, 1764, 1767, 1768, 1774, 1775, 1776, 1777, 1778, 1782, 1786, 1788, 1792, 1808, 1824, 1828, 1832, 1838, 1842], "exelist": 1788, "exercis": [1715, 1716], "exhaust": 106, "exhibit": [1753, 1757, 1763, 1789], "exist": [2, 86, 106, 150, 255, 292, 295, 343, 1737, 1738, 1740, 1742, 1743, 1748, 1757, 1764, 1766, 1767, 1768, 1770, 1788, 1808, 1817, 1823, 1824, 1828, 1833, 1836, 1837, 1838, 1844], "exit": [188, 235, 236, 328, 357, 1748, 1750, 1838], "exot": [476, 1200, 1704, 1714, 1842], "exp": [81, 1810], "expand": [100, 476, 1200, 1704, 1714, 1738, 1780, 1798, 1841, 1842], "expand_cbs_method": [1768, 1777], "expans": [0, 342, 356, 583, 607, 811, 835, 1097, 1099, 1206, 1210, 1220, 1228, 1395, 1704, 1742, 1755, 1768, 1775, 1781, 1789, 1794, 1829, 1837, 1841], "expect": [2, 103, 106, 285, 286, 287, 329, 336, 337, 338, 377, 383, 608, 610, 1206, 1226, 1304, 1352, 1704, 1713, 1714, 1738, 1743, 1753, 1754, 1757, 1767, 1770, 1776, 1779, 1786, 1799, 1801, 1802, 1810, 1828, 1837, 1838, 1842, 1844], "expedit": 1824, "expens": [0, 295, 704, 874, 1206, 1210, 1704, 1742, 1753, 1755, 1766, 1769, 1770, 1789, 1792, 1793, 1824, 1838], "experi": [1751, 1781], "experienc": [1767, 1771, 1786], "experiment": [150, 265, 576, 578, 604, 624, 693, 793, 799, 801, 827, 1125, 1126, 1206, 1210, 1221, 1704, 1740, 1757, 1771, 1794, 1837], "expert": [2, 84, 106, 114, 150, 295, 318, 319, 430, 1226, 1300, 1532, 1704, 1738, 1743, 1744, 1745, 1754, 1757, 1766, 1767, 1785, 1800, 1801, 1810, 1832, 1838], "expertis": 1804, "expir": 279, "explain": [1753, 1767, 1770, 1815], "explan": [640, 1206, 1704, 1748, 1767, 1828, 1844], "explanatori": [574, 1206, 1704], "explicit": [281, 304, 718, 1207, 1704, 1714, 1738, 1740, 1743, 1748, 1749, 1759, 1767, 1814, 1819, 1832, 1841, 1842], "explicit_hamiltonian": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "explicitli": [8, 150, 291, 314, 341, 586, 611, 625, 676, 684, 685, 689, 691, 874, 897, 946, 1157, 1206, 1210, 1211, 1213, 1221, 1224, 1225, 1235, 1281, 1704, 1714, 1738, 1739, 1742, 1743, 1750, 1754, 1756, 1757, 1767, 1770, 1771, 1776, 1781, 1788, 1791, 1798, 1801, 1803, 1810, 1833, 1837, 1838, 1841, 1842], "exploit": [573, 702, 1206, 1704, 1749, 1754, 1763, 1781, 1803, 1838], "explor": [1757, 1828], "explos": 1756, "expon": [2, 8, 19, 77, 81, 103, 285, 336, 374, 395, 1101, 1220, 1704, 1714, 1743, 1775, 1810, 1837, 1842], "exponenti": [1740, 1742, 1757, 1789, 1798], "export": [86, 106, 803, 1210, 1704, 1730, 1735, 1738, 1748, 1750, 1764, 1767, 1772, 1786, 1823, 1824, 1833], "export_": [1785, 1823], "expos": [1818, 1824], "express": [0, 2, 106, 285, 287, 336, 338, 368, 369, 380, 801, 1099, 1210, 1220, 1704, 1740, 1743, 1753, 1757, 1763, 1764, 1768, 1775, 1776, 1779, 1781, 1798, 1837], "ext": [1714, 1770, 1842], "ext_force_bend": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ext_force_cartesian": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ext_force_dihedr": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ext_force_dist": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ext_force_oofp": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ext_will_vari": 1738, "extend": [5, 106, 295, 697, 786, 925, 1206, 1210, 1213, 1225, 1231, 1259, 1260, 1535, 1704, 1743, 1757, 1759, 1766, 1768, 1774, 1779, 1781, 1817, 1836, 1838], "extens": [8, 532, 540, 555, 1202, 1203, 1704, 1714, 1730, 1738, 1742, 1743, 1753, 1755, 1757, 1759, 1761, 1767, 1768, 1770, 1771, 1777, 1781, 1782, 1832, 1833, 1838, 1842, 1844], "extent": [150, 1032, 1115, 1218, 1221, 1704, 1750, 1757, 1799, 1831, 1838], "extern": [0, 1, 2, 73, 84, 150, 205, 247, 267, 275, 390, 586, 642, 668, 679, 709, 711, 712, 793, 1024, 1124, 1206, 1210, 1217, 1221, 1225, 1226, 1268, 1270, 1307, 1308, 1309, 1310, 1311, 1583, 1598, 1660, 1679, 1704, 1714, 1730, 1733, 1735, 1738, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1790, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1839, 1840, 1841, 1842, 1843, 1844], "extern1": [1714, 1838, 1842], "extern2": [275, 1714, 1842], "extern3": [1714, 1842], "extern4": [1714, 1842], "external_": 1785, "external_cpscf_perturb": 84, "external_pot": 150, "external_potenti": [84, 275, 1838], "external_potential_symmetri": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "externalpotenti": [150, 274, 275, 1231, 1553, 1704, 1827], "externalproject_add": 1785, "extinct": [368, 369], "extra": [100, 106, 148, 150, 262, 263, 267, 293, 313, 318, 319, 331, 364, 367, 727, 1208, 1226, 1299, 1704, 1738, 1743, 1748, 1759, 1770, 1786, 1787, 1797, 1800, 1802, 1817], "extra_infil": 1788, "extract": [0, 1, 74, 355, 378, 386, 401, 1197, 1704, 1743, 1759, 1764, 1809, 1837, 1838, 1841, 1844], "extract_subset": [106, 1833, 1837], "extrapol": [284, 295, 318, 319, 321, 438, 515, 538, 584, 688, 734, 735, 736, 812, 813, 814, 815, 839, 840, 841, 846, 919, 1173, 1175, 1176, 1199, 1202, 1203, 1206, 1208, 1210, 1213, 1222, 1225, 1229, 1231, 1250, 1251, 1252, 1279, 1408, 1409, 1430, 1546, 1547, 1548, 1557, 1704, 1711, 1714, 1741, 1743, 1753, 1766, 1768, 1779, 1781, 1785, 1798, 1800, 1831, 1832, 1838, 1842], "extrem": [672, 1206, 1704, 1754, 1756, 1757, 1770, 1781, 1798, 1838], "extrpol": 321, "exval": [111, 1799], "ey": 106, "eyval": [111, 1799], "ez": 1799, "ezval": [111, 1799], "f": [0, 76, 84, 110, 284, 389, 1038, 1039, 1042, 1043, 1044, 1045, 1046, 1064, 1218, 1229, 1427, 1694, 1704, 1706, 1707, 1714, 1730, 1731, 1732, 1733, 1734, 1738, 1739, 1740, 1741, 1742, 1743, 1750, 1756, 1757, 1761, 1764, 1771, 1776, 1777, 1780, 1781, 1783, 1786, 1788, 1790, 1794, 1798, 1802, 1821, 1832, 1836, 1837, 1838, 1841, 1842], "f12": [89, 103, 1694, 1707, 1731, 1732], "f12_cgtg": 103, "f12_double_commut": 89, "f12_squar": 89, "f12g12": [89, 103], "f2": [1714, 1842], "f7": 1738, "f_": [1756, 1757, 1759, 1763, 1837, 1838], "f_a": 1837, "f_b": 1837, "f_cut": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "f_formchk": [2, 285, 296, 336, 1769], "f_p": 1753, "fa": [150, 1770], "fa_subset": 150, "face": [359, 1817], "facil": 1824, "facilit": [1738, 1824, 1833], "facor": 329, "fact": [329, 368, 369, 1757, 1810, 1817, 1838], "facto": [1757, 1767], "factor": [94, 95, 100, 103, 106, 140, 324, 329, 603, 681, 714, 772, 943, 1051, 1067, 1068, 1081, 1082, 1093, 1132, 1206, 1207, 1209, 1213, 1218, 1219, 1221, 1225, 1226, 1228, 1230, 1231, 1232, 1271, 1299, 1387, 1388, 1469, 1470, 1519, 1618, 1666, 1704, 1706, 1738, 1750, 1754, 1756, 1757, 1771, 1801, 1810, 1828, 1837, 1838, 1843, 1844], "factori": [16, 103, 115, 1817], "faegri": 1781, "fail": [2, 266, 270, 276, 277, 278, 318, 319, 1231, 1554, 1704, 1714, 1738, 1743, 1786, 1788, 1800, 1802, 1835, 1838, 1842], "fail_on_maxit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "failur": [2, 126, 342, 356, 383, 1231, 1490, 1704, 1746, 1757, 1838], "fair": 1804, "fairli": [247, 1755, 1757, 1789, 1828, 1838, 1844], "fake": 1788, "fall": [2, 594, 606, 645, 1206, 1704, 1730, 1746, 1762, 1765, 1773, 1775, 1782, 1783, 1784, 1786, 1803, 1809, 1838, 1839], "fallen": 1755, "fals": [2, 8, 13, 61, 84, 89, 96, 100, 103, 106, 148, 150, 182, 235, 236, 250, 251, 252, 259, 263, 265, 267, 273, 282, 283, 284, 288, 289, 296, 308, 314, 323, 332, 333, 339, 340, 342, 350, 370, 374, 383, 389, 395, 416, 417, 424, 425, 426, 427, 429, 440, 441, 448, 453, 457, 458, 459, 460, 462, 463, 468, 471, 477, 478, 488, 493, 494, 498, 501, 503, 509, 510, 517, 530, 532, 534, 536, 540, 541, 544, 555, 562, 576, 579, 597, 598, 602, 604, 605, 625, 626, 639, 648, 653, 657, 658, 672, 678, 679, 680, 682, 692, 694, 695, 699, 718, 742, 743, 745, 749, 753, 765, 786, 787, 788, 792, 801, 802, 803, 807, 817, 821, 822, 823, 831, 838, 839, 859, 860, 861, 863, 865, 866, 867, 872, 875, 882, 883, 885, 886, 887, 888, 909, 913, 915, 917, 921, 922, 925, 934, 940, 941, 942, 952, 956, 986, 990, 995, 996, 998, 999, 1022, 1025, 1026, 1027, 1035, 1036, 1037, 1040, 1041, 1044, 1059, 1061, 1064, 1069, 1071, 1073, 1076, 1078, 1083, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1096, 1105, 1117, 1124, 1125, 1145, 1151, 1152, 1171, 1172, 1173, 1179, 1182, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1206, 1207, 1208, 1209, 1210, 1212, 1213, 1215, 1216, 1217, 1218, 1219, 1221, 1222, 1225, 1226, 1228, 1229, 1230, 1231, 1244, 1254, 1255, 1258, 1259, 1260, 1261, 1262, 1264, 1268, 1270, 1276, 1277, 1278, 1300, 1306, 1312, 1315, 1316, 1317, 1327, 1334, 1337, 1355, 1356, 1361, 1367, 1369, 1370, 1372, 1373, 1374, 1378, 1381, 1385, 1386, 1390, 1392, 1407, 1411, 1414, 1415, 1419, 1421, 1428, 1430, 1435, 1436, 1441, 1447, 1448, 1449, 1450, 1452, 1453, 1454, 1464, 1465, 1466, 1483, 1485, 1500, 1541, 1553, 1558, 1564, 1565, 1566, 1578, 1583, 1585, 1587, 1591, 1593, 1594, 1596, 1612, 1613, 1614, 1623, 1636, 1637, 1643, 1647, 1656, 1663, 1704, 1735, 1740, 1742, 1743, 1746, 1749, 1750, 1753, 1754, 1755, 1756, 1757, 1759, 1767, 1768, 1769, 1770, 1771, 1772, 1786, 1788, 1791, 1794, 1795, 1796, 1797, 1798, 1803, 1817, 1828, 1837, 1838, 1841], "falsi": 1757, "falter": 1738, "famili": [400, 1730, 1738, 1771, 1774], "familiar": [1737, 1771, 1817, 1844], "fanci": 1740, "fannfann": [1692, 1752], "faonfann": [1692, 1752], "faonfaon": [1692, 1752], "faoofann": [1692, 1752], "faoofaon": [1692, 1752], "faoofaoo": [1692, 1752], "faq": [1767, 1777, 1819], "far": [0, 2, 297, 347, 576, 764, 1206, 1209, 1704, 1743, 1754, 1757, 1763, 1770, 1783, 1824, 1828, 1838], "faradai": 1706, "faraday_const": 1706, "faraday_constant_for_conventional_electric_curr": 1706, "farm": [1752, 1824], "fashion": [1752, 1760, 1782, 1792, 1806], "fast": [762, 1209, 1704, 1738, 1754, 1755, 1767, 1810, 1838], "fastdf": [1231, 1505, 1509, 1511, 1704], "faster": [590, 623, 765, 1095, 1206, 1209, 1219, 1704, 1736, 1753, 1754, 1757, 1759, 1763, 1767, 1771, 1774, 1789, 1798, 1810, 1828, 1837, 1838, 1844], "fastest": [1708, 1743], "fault": 1742, "faulti": 106, "faver": [1692, 1752], "favg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "favg_ccsd_t": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "favg_start": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "favor": [281, 304, 1231, 1589, 1704, 1753, 1755, 1810, 1833], "favorit": [1692, 1752], "fb": [150, 1770], "fb_subset": 150, "fc": [295, 318, 319, 614, 1206, 1695, 1696, 1698, 1699, 1700, 1703, 1704, 1711, 1714, 1758, 1766, 1800, 1809, 1842], "fcae": [268, 1809], "fcfo": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "fcharg": 106, "fchk": [2, 74, 285, 303, 336, 1775, 1777, 1780, 1823], "fchkwriter": 1827, "fci": [0, 1, 2, 150, 284, 295, 314, 381, 382, 822, 1673, 1704, 1714, 1725, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "fci_str": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "fcidump": [2, 187, 286, 298, 337, 348, 1714, 1842], "fcidump_from_fil": [294, 345], "fcmfinal": [679, 1206, 1704], "fcmint": [706, 1206, 1704], "fco": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "fctl": [267, 1690, 1776, 1795], "fctldash": [267, 1759], "fd": [1713, 1714, 1718, 1724, 1772, 1803, 1842], "fd_irrep": [616, 1206, 1704], "fd_project": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "fdc202e": 1786, "fdd": [75, 1230, 1476, 1477, 1478, 1704, 1837], "fdds_dispers": 1827, "fdisp": 76, "fe": [1707, 1731], "featur": [0, 1, 2, 106, 284, 351, 370, 381, 382, 657, 1126, 1206, 1221, 1231, 1520, 1704, 1730, 1737, 1738, 1740, 1743, 1746, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1757, 1762, 1765, 1767, 1771, 1772, 1775, 1777, 1781, 1782, 1788, 1799, 1803, 1808, 1819, 1824, 1826, 1832, 1837, 1838, 1839, 1840], "feb": [1694, 1707, 1731, 1732, 1733], "februari": [1782, 1837], "feedback": 1825, "feedstock": 1788, "feel": 1828, "felst": 76, "fermann": [1781, 1783], "fermi": [614, 669, 1206, 1704, 1706], "fermi_coupling_const": 1706, "fetch": [1, 75, 1746, 1749, 1754, 1762, 1765, 1773, 1775, 1782, 1783, 1784, 1786, 1788, 1803, 1833, 1839], "few": [0, 2, 342, 605, 1206, 1692, 1704, 1738, 1742, 1743, 1748, 1752, 1756, 1757, 1759, 1761, 1764, 1774, 1785, 1795, 1798, 1808, 1809, 1810, 1815, 1824, 1828, 1833, 1835, 1837, 1838, 1841, 1843, 1844], "fewer": [1771, 1794], "fexch": 76, "feynman": 1798, "ffer": [1734, 1781], "fh": [1714, 1842], "fi": [1714, 1776, 1838, 1842], "fiddl": 1810, "field": [1, 2, 70, 71, 73, 89, 103, 106, 111, 150, 265, 275, 284, 285, 287, 295, 296, 318, 319, 336, 338, 381, 382, 383, 386, 388, 550, 571, 572, 574, 614, 617, 622, 669, 674, 690, 693, 707, 709, 711, 712, 763, 764, 776, 1040, 1124, 1203, 1206, 1209, 1210, 1218, 1221, 1228, 1231, 1386, 1388, 1394, 1586, 1673, 1690, 1704, 1706, 1708, 1714, 1734, 1740, 1742, 1753, 1754, 1755, 1766, 1768, 1769, 1770, 1772, 1776, 1777, 1781, 1788, 1790, 1794, 1799, 1800, 1804, 1817, 1826, 1829, 1835, 1838, 1842], "figur": [1755, 1788, 1828, 1844], "file": [0, 8, 16, 21, 64, 74, 75, 76, 86, 87, 88, 100, 106, 115, 148, 150, 168, 172, 187, 189, 202, 205, 221, 227, 228, 229, 230, 234, 252, 265, 267, 271, 282, 285, 286, 287, 288, 289, 291, 295, 296, 297, 298, 303, 306, 307, 314, 318, 319, 332, 336, 337, 338, 339, 340, 341, 347, 348, 350, 351, 354, 374, 380, 393, 395, 399, 400, 575, 577, 592, 614, 620, 621, 628, 638, 641, 668, 680, 682, 706, 716, 720, 804, 830, 836, 867, 934, 954, 1021, 1025, 1026, 1027, 1035, 1036, 1037, 1043, 1046, 1052, 1097, 1104, 1108, 1109, 1111, 1118, 1130, 1145, 1153, 1170, 1186, 1206, 1207, 1213, 1216, 1217, 1218, 1220, 1221, 1222, 1225, 1226, 1227, 1228, 1230, 1231, 1268, 1270, 1356, 1377, 1393, 1463, 1578, 1583, 1584, 1704, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1733, 1735, 1736, 1740, 1743, 1747, 1748, 1749, 1752, 1754, 1757, 1759, 1761, 1763, 1764, 1766, 1768, 1771, 1772, 1775, 1776, 1777, 1778, 1780, 1781, 1782, 1785, 1786, 1788, 1790, 1791, 1792, 1794, 1795, 1796, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1810, 1815, 1819, 1823, 1828, 1831, 1833, 1834, 1835, 1836, 1837, 1838, 1840, 1842], "file1": 1767, "file2": 1767, "filebas": 1738, "filen": 1833, "filenam": [8, 74, 100, 104, 148, 150, 288, 289, 295, 296, 303, 314, 323, 339, 340, 354, 392, 934, 1025, 1026, 1027, 1170, 1213, 1217, 1221, 1231, 1578, 1704, 1733, 1761, 1766, 1767, 1768, 1769, 1772, 1775, 1788, 1791, 1801, 1835], "fileno": [86, 87, 100, 354], "filenumb": [150, 1767], "filepath": [323, 1043, 1046, 1052, 1218, 1704], "filesystem": [21, 1738, 1750, 1832], "fill": [64, 183, 184, 1126, 1221, 1704, 1743, 1764, 1788, 1794, 1810, 1817], "fillin": [1231, 1628, 1704], "filter": [2, 304, 380, 481, 520, 544, 823, 824, 825, 827, 1200, 1202, 1203, 1210, 1704, 1714, 1738, 1768, 1794, 1817, 1842], "filter_guess": [0, 1, 2, 824, 825, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "filter_guess_det1": [0, 1, 2, 823, 826, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "filter_guess_det2": [0, 1, 2, 823, 826, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "filter_guess_sign": [0, 1, 2, 823, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "filter_nonvib": 386, "filter_zero_det": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "final": [2, 84, 92, 106, 147, 150, 267, 285, 314, 336, 386, 495, 550, 1200, 1203, 1226, 1230, 1231, 1362, 1463, 1490, 1493, 1495, 1704, 1714, 1723, 1730, 1740, 1742, 1743, 1747, 1748, 1757, 1763, 1764, 1767, 1776, 1779, 1782, 1787, 1791, 1794, 1798, 1801, 1802, 1804, 1817, 1828, 1832, 1834, 1836, 1837, 1838, 1842, 1844], "finalize_energi": 84, "find": [2, 76, 106, 296, 299, 349, 356, 609, 635, 652, 833, 871, 881, 1181, 1206, 1210, 1222, 1231, 1649, 1704, 1730, 1736, 1743, 1748, 1750, 1755, 1757, 1764, 1767, 1769, 1782, 1783, 1785, 1787, 1788, 1801, 1802, 1814, 1822, 1837, 1838], "find_highest_point_group": 106, "find_occup": 84, "find_point_group": 106, "findabl": 1767, "findif": [400, 616, 619, 707, 1206, 1704, 1705, 1743, 1776], "findifrec": [1772, 1794], "findpython": 1738, "fine": [1706, 1738, 1748, 1754, 1756, 1786, 1788, 1808, 1817, 1821], "fine_structure_const": 1706, "finish": [76, 170, 295, 1738, 1757, 1766, 1767, 1770], "finit": [265, 267, 300, 301, 302, 306, 307, 318, 319, 614, 615, 617, 618, 619, 666, 679, 690, 701, 1023, 1024, 1028, 1150, 1206, 1217, 1221, 1704, 1713, 1714, 1724, 1740, 1742, 1743, 1756, 1757, 1768, 1772, 1794, 1796, 1798, 1800, 1802, 1803, 1809, 1824, 1833, 1834, 1838, 1840, 1842, 1843], "finitediffer": [1768, 1772], "finitedifferencecomput": [1768, 1772, 1794], "fink": [1734, 1736, 1767, 1798], "firework": 1788, "fireworks_slide_v182": 1788, "first": [2, 3, 5, 8, 90, 103, 106, 115, 137, 150, 259, 265, 279, 284, 286, 295, 300, 301, 302, 309, 314, 318, 319, 337, 360, 381, 382, 384, 386, 390, 434, 571, 575, 599, 608, 609, 615, 616, 662, 669, 679, 685, 687, 749, 824, 992, 1011, 1119, 1125, 1190, 1199, 1206, 1208, 1210, 1215, 1216, 1221, 1222, 1226, 1230, 1231, 1361, 1464, 1582, 1692, 1704, 1706, 1713, 1714, 1722, 1723, 1730, 1738, 1740, 1742, 1743, 1746, 1750, 1752, 1753, 1756, 1757, 1761, 1763, 1764, 1766, 1767, 1768, 1771, 1772, 1774, 1775, 1776, 1781, 1782, 1785, 1786, 1787, 1790, 1791, 1792, 1794, 1795, 1796, 1798, 1800, 1801, 1802, 1810, 1817, 1826, 1828, 1832, 1833, 1835, 1838, 1841, 1842, 1844], "first10": [1692, 1752], "first3": [1692, 1752], "first5": [1692, 1752], "first_ord": [669, 1206, 1704], "first_radiation_const": 1706, "first_radiation_constant_for_spectral_radi": 1706, "first_rs_shell_block": 1817, "firstli": [1752, 1799], "fisapt": [400, 1051, 1230, 1475, 1704, 1705, 1709, 1714, 1770, 1827, 1837, 1842], "fisapt0": [295, 1766, 1770], "fisapt_charge_complet": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "fisapt_cube_densmat": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "fisapt_cube_linkibo": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "fisapt_cube_linkiho": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "fisapt_do_fsapt": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "fisapt_do_fsapt_disp": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "fisapt_do_plot": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "fisapt_exch_parperp": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "fisapt_fsapt_exch_scal": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "fisapt_fsapt_filepath": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "fisapt_fsapt_ind_respons": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "fisapt_fsapt_ind_scal": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "fisapt_fssapt_filepath": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "fisapt_link_assign": [0, 1, 2, 1048, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "fisapt_link_ortho": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "fisapt_link_select": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "fisapt_manual_link": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "fisapt_mem_safety_factor": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "fisapt_plot_filepath": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "fischer": [1226, 1342, 1704, 1734, 1802], "fischer_lik": [1226, 1338, 1704], "fit": [11, 26, 61, 84, 92, 103, 150, 179, 255, 284, 295, 318, 319, 377, 381, 382, 733, 810, 892, 899, 963, 1076, 1120, 1204, 1208, 1210, 1211, 1212, 1213, 1214, 1219, 1221, 1230, 1231, 1445, 1446, 1491, 1500, 1501, 1502, 1505, 1506, 1509, 1510, 1674, 1675, 1704, 1707, 1708, 1714, 1730, 1731, 1735, 1738, 1739, 1740, 1742, 1743, 1744, 1745, 1750, 1759, 1761, 1763, 1764, 1766, 1767, 1768, 1770, 1777, 1781, 1785, 1790, 1798, 1800, 1806, 1808, 1817, 1823, 1824, 1826, 1828, 1829, 1832, 1837, 1842, 1844], "fitrol": 8, "fittedslatercorrelationfactor": 1827, "fittingmetr": 1827, "five": [1692, 1752, 1753, 1802], "fix": [2, 106, 267, 792, 793, 1210, 1226, 1230, 1231, 1339, 1469, 1470, 1663, 1704, 1714, 1736, 1737, 1753, 1755, 1759, 1767, 1768, 1780, 1787, 1802, 1803, 1833, 1837, 1842], "fix_com": [106, 1768], "fix_orient": [106, 1768], "fix_symmetri": [106, 1768], "fixed_": [1226, 1360, 1704], "fixed_bend": [1226, 1357, 1704], "fixed_coord": 1802, "fixed_dihedr": [1226, 1358, 1704], "fixed_dist": [1226, 1359, 1704], "fixeds": [106, 139, 150], "fl": [295, 318, 319, 1694, 1695, 1698, 1699, 1703, 1707, 1731, 1732, 1733, 1758, 1766, 1800], "flabel": 106, "flag": [2, 273, 295, 658, 1071, 1206, 1219, 1704, 1738, 1766, 1767, 1771, 1785, 1788, 1801, 1838], "flaki": [882, 1210, 1704], "flat": [363, 367, 968, 1214, 1231, 1532, 1704, 1802, 1817], "flavor": [265, 1714, 1740, 1757, 1772, 1794, 1838, 1842], "flaw": 1743, "fledg": [1748, 1833], "fletcher": [1225, 1284, 1704], "fletcher_reev": [948, 1213, 1225, 1284, 1704], "flexibl": [267, 577, 671, 1206, 1226, 1312, 1704, 1730, 1743, 1748, 1752, 1757, 1759, 1785, 1824, 1832, 1833, 1837, 1838], "flexibla": 1738, "flexible_g_converg": [0, 1, 2, 1324, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "flexibli": 1738, "flin": [929, 1213, 1704], "flip": [0, 13, 295, 692, 885, 1206, 1210, 1704, 1743, 1766, 1777, 1780, 1790, 1838], "float": [2, 6, 8, 12, 13, 14, 22, 23, 25, 26, 27, 31, 33, 34, 35, 39, 43, 44, 45, 48, 49, 50, 51, 52, 53, 57, 59, 68, 73, 75, 76, 77, 78, 80, 81, 84, 89, 90, 91, 92, 96, 100, 103, 106, 111, 114, 115, 128, 130, 133, 138, 139, 145, 147, 148, 149, 150, 154, 155, 156, 157, 158, 159, 160, 162, 165, 167, 181, 183, 184, 185, 186, 187, 237, 238, 239, 240, 246, 248, 254, 255, 262, 263, 267, 276, 284, 285, 287, 294, 295, 300, 301, 302, 318, 319, 322, 324, 325, 329, 335, 336, 338, 342, 345, 356, 363, 367, 368, 369, 374, 377, 383, 385, 386, 388, 390, 395, 1740, 1743, 1750, 1752, 1759, 1761, 1766, 1768, 1771, 1772, 1774, 1794, 1800, 1832, 1844], "flocal": 76, "flop": 1757, "floppi": 1802, "florida": [1692, 1752], "flow": 1824, "flpath": 354, "fluctuat": 1837, "fluoromethan": 1728, "flush": 189, "flux": 1706, "fly": [430, 627, 836, 882, 935, 1199, 1206, 1210, 1213, 1228, 1393, 1704, 1749, 1781, 1837, 1838], "fm": 1706, "fmass": 106, "fmm": [763, 764, 1209, 1228, 1394, 1395, 1704, 1754], "fn": [106, 1774], "fname": [187, 297, 298, 347, 348], "fno": [190, 284, 295, 1084, 1085, 1219, 1704, 1714, 1740, 1766, 1781, 1790, 1798, 1842], "fnocc": [400, 1078, 1158, 1221, 1704, 1705, 1709, 1714, 1739, 1777, 1790, 1809, 1842], "fnocc1": [1714, 1842], "fnocc2": [1714, 1842], "fnocc3": [1714, 1842], "fnocc4": [1714, 1842], "fnocc5": [1714, 1842], "fnocc6": [1714, 1842], "fnocc7": [1714, 1842], "fnocc_wfn": 1809, "focal": [1740, 1768], "fock": [18, 66, 84, 130, 150, 295, 300, 301, 302, 318, 319, 442, 483, 518, 542, 623, 664, 665, 667, 676, 738, 904, 972, 1171, 1172, 1179, 1180, 1199, 1200, 1202, 1203, 1206, 1208, 1212, 1214, 1222, 1225, 1229, 1231, 1296, 1411, 1566, 1567, 1568, 1663, 1690, 1695, 1697, 1698, 1700, 1703, 1704, 1734, 1735, 1740, 1743, 1744, 1745, 1749, 1753, 1754, 1755, 1756, 1757, 1758, 1763, 1766, 1769, 1770, 1771, 1772, 1776, 1777, 1778, 1780, 1790, 1798, 1800, 1803, 1810, 1817, 1821, 1823, 1824, 1832, 1836, 1837], "fockci": 1738, "focu": 2, "focus": [2, 1824], "foil": 1738, "fold": 1755, "folder": [2, 1738, 1747, 1757, 1770, 1788, 1823, 1833], "foldi": [1734, 1836], "follow": [0, 2, 11, 106, 111, 284, 288, 289, 314, 339, 340, 356, 368, 369, 468, 577, 603, 614, 635, 640, 641, 652, 680, 681, 829, 1200, 1206, 1226, 1231, 1354, 1361, 1363, 1485, 1555, 1556, 1575, 1649, 1692, 1704, 1714, 1730, 1735, 1737, 1738, 1740, 1741, 1742, 1743, 1747, 1748, 1749, 1752, 1753, 1754, 1755, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1767, 1770, 1771, 1774, 1775, 1781, 1782, 1785, 1788, 1789, 1791, 1792, 1797, 1798, 1799, 1801, 1802, 1803, 1805, 1808, 1809, 1810, 1817, 1823, 1828, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1840, 1841, 1842, 1844], "follow_root": [0, 1, 2, 829, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "follow_step_incr": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "follow_step_scal": [0, 1, 2, 1555, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "follow_vector": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "font": [1738, 1750], "fontsiz": 1750, "footnot": [1692, 1733, 1752, 1759, 1802, 1838], "fopenmp": 1738, "forc": [2, 8, 106, 307, 386, 562, 571, 572, 573, 574, 596, 615, 617, 618, 664, 665, 679, 697, 698, 707, 1101, 1182, 1204, 1206, 1220, 1222, 1226, 1230, 1231, 1307, 1308, 1309, 1310, 1311, 1338, 1342, 1351, 1365, 1480, 1507, 1606, 1623, 1704, 1706, 1714, 1734, 1735, 1738, 1743, 1746, 1752, 1755, 1757, 1759, 1762, 1765, 1772, 1773, 1775, 1781, 1782, 1783, 1784, 1788, 1798, 1802, 1803, 1810, 1817, 1828, 1833, 1837, 1838, 1839, 1842, 1844], "force_c1": 106, "force_comput": 119, "force_occpi": 150, "force_restart": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "force_standa": [665, 1206, 1704], "force_twocon": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "force_unit": 106, "forcexyz": 350, "forcibli": [1231, 1620, 1704], "foreach": 1767, "foremost": 1838, "forg": [1736, 1737, 1738, 1747, 1748, 1754, 1759, 1774, 1781, 1788], "forget": [1767, 1788], "forgiv": [2, 383], "forgo": 1737, "fork": [1736, 1738, 1767, 1784, 1786, 1788], "form": [2, 75, 84, 103, 106, 141, 265, 283, 284, 306, 307, 333, 354, 356, 370, 378, 392, 494, 574, 621, 708, 811, 829, 833, 838, 855, 997, 1200, 1206, 1210, 1215, 1231, 1524, 1526, 1704, 1714, 1726, 1738, 1740, 1743, 1746, 1752, 1754, 1755, 1756, 1757, 1759, 1764, 1767, 1772, 1776, 1782, 1785, 1788, 1789, 1797, 1799, 1800, 1802, 1810, 1829, 1832, 1835, 1837, 1838, 1841, 1842], "form_aux_matric": 75, "form_c": 84, "form_cfor": 130, "form_cholesky_invers": 78, "form_d": 84, "form_eig_invers": 78, "form_f": 84, "form_fdsmsdf": 84, "form_fitting_metr": 78, "form_full_invers": 78, "form_g": 84, "form_h": 84, "form_initial_c": 84, "form_initial_f": 84, "form_opdm": 13, "form_qr_invers": 78, "form_rotation_matrix": 133, "form_shalf": 84, "form_symmetry_inform": 106, "form_tpdm": 13, "form_unc_amplitud": 75, "form_v": 84, "formal": [106, 267, 874, 1210, 1704, 1738, 1755, 1756, 1759, 1771, 1838, 1841], "formaldehyd": 1833, "formalisim": 1829, "formamid": [1692, 1714, 1752, 1842], "formamidin": [1692, 1752], "format": [0, 8, 75, 100, 104, 106, 111, 150, 187, 267, 282, 285, 287, 296, 297, 314, 318, 319, 332, 336, 338, 347, 350, 380, 388, 389, 390, 592, 609, 614, 829, 995, 1027, 1206, 1210, 1215, 1217, 1226, 1230, 1304, 1436, 1704, 1708, 1711, 1714, 1730, 1738, 1743, 1746, 1756, 1757, 1764, 1767, 1768, 1769, 1772, 1775, 1777, 1782, 1785, 1786, 1791, 1794, 1799, 1800, 1802, 1814, 1822, 1823, 1824, 1828, 1832, 1833, 1837, 1838, 1841, 1842, 1843, 1844], "format_molecule_for_mol": 106, "formatt": 1747, "former": [2, 1714, 1738, 1753, 1757, 1764, 1785, 1810, 1837, 1841, 1842], "formerli": [267, 1738, 1746, 1748, 1759, 1768, 1794], "formic": [1692, 1711, 1714, 1752, 1842], "formul": [377, 665, 1206, 1704, 1755, 1781, 1829, 1837], "formula": [2, 295, 318, 319, 864, 889, 1013, 1015, 1018, 1210, 1216, 1226, 1307, 1308, 1309, 1310, 1311, 1704, 1714, 1740, 1756, 1759, 1766, 1800, 1802, 1837, 1838, 1842], "fort": [1224, 1233, 1235, 1236, 1237, 1238, 1239, 1241, 1704], "forth": 1838, "fortran": [1714, 1736, 1748, 1754, 1759, 1762, 1767, 1774, 1775, 1803, 1810, 1842], "fortun": [1738, 1770, 1828, 1844], "forum": [1717, 1738, 1757, 1781, 1816, 1838], "forward": [150, 192, 193, 203, 204, 1226, 1346, 1704, 1743, 1754, 1767], "foster": [973, 974, 1214, 1704, 1763], "found": [0, 2, 106, 285, 287, 336, 338, 811, 993, 1210, 1215, 1231, 1649, 1704, 1730, 1733, 1738, 1740, 1743, 1746, 1748, 1749, 1750, 1752, 1755, 1756, 1757, 1759, 1760, 1762, 1764, 1765, 1767, 1771, 1772, 1773, 1774, 1775, 1779, 1781, 1782, 1783, 1784, 1785, 1792, 1797, 1802, 1803, 1805, 1817, 1823, 1828, 1832, 1833, 1837, 1838, 1839, 1842, 1844], "found_": 1785, "found_libefp": 1785, "foundat": 1832, "four": [0, 2, 95, 286, 291, 337, 341, 430, 433, 466, 507, 514, 609, 627, 652, 727, 1199, 1200, 1201, 1202, 1206, 1208, 1225, 1230, 1242, 1455, 1704, 1714, 1726, 1742, 1743, 1748, 1750, 1753, 1759, 1767, 1776, 1782, 1801, 1802, 1829, 1832, 1835, 1837, 1838, 1842], "fourier": 1824, "fourth": [609, 616, 631, 677, 1206, 1229, 1413, 1704, 1730, 1753, 1771, 1799], "fpa": 1740, "fprintf": 1810, "fr": 388, "frac": [84, 368, 369, 377, 1182, 1222, 1231, 1557, 1704, 1714, 1742, 1753, 1756, 1757, 1759, 1763, 1768, 1771, 1776, 1798, 1829, 1836, 1837, 1838, 1841, 1842], "frac_dii": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "frac_load": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "frac_nuk": [1757, 1768, 1777], "frac_occ": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "frac_performed_": 84, "frac_renorm": [0, 1, 2, 84, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "frac_start": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "frac_travers": [1757, 1768, 1777], "frac_val": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "fractalcli": [265, 1740, 1772, 1794], "fraction": [957, 1110, 1213, 1221, 1225, 1289, 1559, 1561, 1610, 1704, 1714, 1750, 1790, 1838, 1842], "frag": [1226, 1336, 1704, 1782, 1785, 1802], "frag1": 1770, "frag2": 1770, "frag_ind": 106, "frag_mod": [0, 1, 2, 1341, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "frag_ref_atom": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "fraga": 1770, "fragb": 1770, "fraglib": 1782, "fragment": [76, 79, 106, 295, 350, 1013, 1015, 1018, 1034, 1035, 1048, 1125, 1216, 1218, 1221, 1230, 1313, 1317, 1341, 1442, 1678, 1704, 1711, 1714, 1722, 1726, 1738, 1742, 1743, 1749, 1766, 1767, 1768, 1770, 1771, 1776, 1780, 1781, 1785, 1790, 1794, 1828, 1832, 1835, 1837, 1842, 1844], "fragment_charg": [106, 1768], "fragment_multipl": [106, 1768], "fragment_separ": [106, 1768], "fragmenta": 1835, "fragmentb": 1835, "fragmentedmol": 1833, "fragmenttyp": 1827, "fragmol": 1768, "fragnam": 1782, "frame": [106, 1743], "framework": [1733, 1747, 1838], "francesco": [1750, 1829, 1836], "fransson": [1734, 1781], "franz": 1734, "frediani": 1803, "free": [11, 352, 677, 1206, 1685, 1691, 1704, 1714, 1750, 1756, 1757, 1771, 1776, 1781, 1788, 1799, 1810, 1828, 1836, 1837, 1842, 1843, 1844], "free_block": 1810, "freedom": [617, 1024, 1206, 1217, 1704, 1738, 1743, 1776, 1833], "freeli": [2, 1738, 1759, 1774, 1801], "freez": [76, 809, 1125, 1126, 1148, 1149, 1210, 1221, 1226, 1230, 1315, 1316, 1317, 1454, 1704, 1714, 1756, 1763, 1771, 1789, 1792, 1802, 1828, 1837, 1842, 1844], "freeze_all_dihedr": [0, 1, 2, 1371, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "freeze_cor": [0, 1, 2, 8, 76, 284, 1126, 1127, 1148, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1828, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "freeze_core_polici": [0, 1, 2, 1125, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "freeze_interfrag": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "freeze_intrafrag": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "freeze_list": 1802, "freq": [301, 302, 388, 1714, 1740, 1772, 1833, 1842, 1843, 1844], "freq1": [1714, 1842], "freq2": [1714, 1842], "freq_algorit": [624, 1206, 1704], "freq_func": [300, 301, 302, 1772], "frequenc": [150, 300, 307, 368, 369, 377, 386, 388, 389, 399, 539, 550, 573, 616, 669, 679, 701, 707, 921, 922, 1024, 1203, 1206, 1213, 1217, 1226, 1231, 1323, 1568, 1704, 1706, 1710, 1714, 1718, 1723, 1735, 1738, 1742, 1743, 1769, 1777, 1778, 1781, 1792, 1796, 1798, 1801, 1802, 1831, 1832, 1833, 1837, 1838, 1840, 1842, 1843], "frequency_scale_factor": 1801, "frequent": [1776, 1785, 1832], "fresh": [1747, 1808], "fridai": 1786, "friend": 1838, "friendli": [1781, 1816], "friesner": 1838, "frisch": [356, 1734], "frish": 1810, "from": [0, 1, 2, 5, 8, 20, 21, 64, 74, 75, 84, 86, 87, 92, 94, 100, 106, 115, 130, 132, 138, 148, 150, 158, 176, 217, 262, 263, 265, 267, 272, 277, 283, 284, 286, 291, 294, 295, 296, 297, 299, 303, 304, 310, 314, 317, 321, 329, 333, 337, 341, 342, 345, 346, 347, 349, 350, 355, 356, 361, 365, 367, 375, 376, 377, 378, 384, 386, 388, 390, 393, 394, 396, 397, 399, 413, 434, 457, 474, 476, 493, 494, 530, 539, 554, 573, 574, 581, 587, 592, 599, 601, 617, 623, 638, 650, 651, 654, 664, 665, 671, 676, 684, 685, 689, 691, 705, 707, 731, 783, 802, 830, 835, 862, 881, 891, 923, 954, 994, 1071, 1157, 1186, 1198, 1199, 1200, 1202, 1203, 1206, 1208, 1210, 1213, 1215, 1219, 1221, 1222, 1224, 1225, 1226, 1228, 1229, 1230, 1231, 1232, 1241, 1268, 1331, 1332, 1353, 1380, 1382, 1401, 1405, 1418, 1455, 1535, 1558, 1568, 1579, 1583, 1616, 1617, 1666, 1692, 1704, 1708, 1711, 1714, 1715, 1717, 1722, 1723, 1724, 1725, 1730, 1736, 1739, 1740, 1742, 1743, 1746, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1773, 1774, 1775, 1776, 1777, 1780, 1781, 1782, 1783, 1784, 1785, 1787, 1788, 1790, 1791, 1792, 1794, 1797, 1798, 1799, 1801, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1817, 1823, 1824, 1825, 1828, 1829, 1832, 1833, 1835, 1836, 1837, 1838, 1839, 1841, 1842, 1843, 1844], "from_arrai": [100, 106, 148, 267, 331, 1759, 1797], "from_dict": [106, 1726], "from_fil": [150, 1767], "from_list": [64, 100, 148, 1797], "from_schema": 106, "from_seri": [100, 148], "from_str": 106, "front": [1757, 1781, 1824, 1828, 1832, 1844], "frontier": [1714, 1750, 1842], "frontier_orbit": [1112, 1221, 1704, 1750], "frontmatt": 1788, "frozen": [0, 8, 84, 150, 268, 284, 295, 298, 348, 625, 1125, 1126, 1127, 1128, 1206, 1221, 1226, 1318, 1319, 1320, 1321, 1322, 1704, 1711, 1714, 1715, 1739, 1740, 1742, 1743, 1752, 1755, 1756, 1757, 1766, 1776, 1777, 1781, 1789, 1790, 1792, 1798, 1802, 1810, 1829, 1837, 1842], "frozen_bend": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "frozen_cartesian": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "frozen_dcc": 1810, "frozen_dihedr": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "frozen_dist": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "frozen_docc": [0, 1, 2, 1125, 1704, 1714, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "frozen_occ": 150, "frozen_oofp": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "frozen_uocc": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "frozen_vir": 150, "frozen_virt": [626, 1206, 1704], "frzcpi": 150, "frzvpi": 150, "fsapt": [1043, 1046, 1218, 1704, 1714, 1738, 1770, 1837, 1842], "fsapt0": 1837, "fsapt1": [1714, 1770, 1842], "fsapt2": [1714, 1842], "fsaptd": [1714, 1842], "fsymbol": 106, "ft97": [295, 318, 319, 1695, 1698, 1699, 1703, 1757, 1758, 1766, 1800], "ftild": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "ftrue_atomic_numb": 106, "fuel": [1714, 1842], "fukui": 1750, "fulfil": [1738, 1743, 1802], "full": [0, 2, 100, 106, 135, 138, 150, 288, 289, 295, 300, 301, 302, 318, 319, 322, 325, 339, 340, 354, 377, 477, 498, 573, 574, 619, 639, 655, 677, 698, 708, 729, 767, 786, 821, 881, 1200, 1206, 1208, 1209, 1210, 1226, 1229, 1231, 1232, 1323, 1372, 1405, 1485, 1499, 1556, 1568, 1666, 1673, 1695, 1696, 1697, 1700, 1704, 1711, 1714, 1725, 1729, 1735, 1738, 1742, 1743, 1744, 1745, 1746, 1748, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1764, 1766, 1767, 1770, 1771, 1772, 1776, 1777, 1781, 1785, 1788, 1789, 1790, 1794, 1800, 1802, 1809, 1819, 1832, 1833, 1838, 1841, 1842, 1843], "full_geometri": 106, "full_hess_everi": [0, 1, 2, 611, 1206, 1300, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "full_matrix": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "full_nam": 120, "full_path": 87, "full_pg_n": 106, "full_spac": 13, "fuller": [1709, 1738, 1776, 1796], "fulli": [2, 100, 106, 430, 1199, 1226, 1231, 1352, 1490, 1704, 1738, 1743, 1748, 1753, 1756, 1757, 1760, 1776, 1781, 1788, 1803, 1810, 1824, 1836, 1838], "fullquart": [570, 574, 1206, 1704], "func": [106, 267, 284, 300, 301, 302, 318, 319, 346, 1714, 1740, 1752, 1759, 1772, 1774, 1779, 1794, 1800, 1809, 1842], "func_cal": 1757, "funciton": [1230, 1471, 1704, 1837], "function": [0, 5, 8, 13, 20, 27, 29, 64, 73, 81, 82, 84, 87, 88, 90, 92, 96, 100, 101, 103, 105, 106, 110, 112, 114, 119, 138, 147, 148, 150, 173, 235, 236, 240, 246, 248, 252, 267, 268, 275, 278, 281, 283, 284, 285, 286, 287, 293, 295, 296, 298, 300, 301, 302, 303, 304, 306, 307, 312, 314, 315, 316, 318, 319, 322, 324, 325, 327, 329, 331, 333, 335, 336, 337, 338, 346, 348, 350, 351, 352, 356, 359, 368, 369, 370, 372, 373, 377, 378, 380, 381, 382, 391, 392, 393, 399, 400, 448, 488, 586, 597, 623, 628, 629, 630, 631, 635, 652, 658, 660, 678, 691, 761, 774, 891, 967, 978, 979, 999, 1108, 1131, 1157, 1170, 1199, 1200, 1206, 1208, 1209, 1210, 1214, 1215, 1221, 1226, 1231, 1368, 1487, 1503, 1504, 1521, 1524, 1526, 1532, 1535, 1621, 1671, 1690, 1698, 1703, 1704, 1710, 1713, 1714, 1730, 1734, 1738, 1740, 1742, 1746, 1748, 1750, 1752, 1753, 1754, 1755, 1756, 1759, 1760, 1763, 1764, 1766, 1767, 1768, 1769, 1771, 1774, 1775, 1776, 1777, 1780, 1781, 1783, 1784, 1786, 1790, 1791, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1808, 1809, 1810, 1817, 1819, 1823, 1824, 1826, 1828, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1840, 1842, 1843, 1844], "function_index": 81, "function_kwarg": 378, "function_to_cent": 8, "function_to_shel": 8, "functionl": 1757, "functionnam": 1740, "functions_local_to_glob": 9, "fundament": [1781, 1797, 1801], "furan": 0, "furor": 1804, "further": [2, 106, 284, 381, 382, 575, 671, 1206, 1692, 1704, 1730, 1738, 1740, 1743, 1748, 1752, 1756, 1757, 1760, 1772, 1780, 1781, 1788, 1798, 1800, 1809, 1810, 1817, 1826, 1833, 1838, 1841], "furthermor": [655, 1206, 1231, 1655, 1704, 1753, 1798, 1802, 1841], "futur": [2, 150, 283, 333, 603, 1206, 1231, 1589, 1704, 1736, 1737, 1757, 1759, 1767, 1774, 1781, 1785, 1788, 1809], "futurewarn": 279, "fw": [1734, 1836], "fwhm": [322, 325], "fx": 106, "fy": 106, "fz": 106, "fzc": [13, 98, 1714, 1842], "fzcv": [1714, 1842], "fzv": [13, 98], "g": [8, 74, 84, 106, 150, 226, 265, 266, 267, 268, 270, 276, 288, 289, 295, 296, 306, 339, 340, 354, 356, 374, 386, 393, 395, 433, 444, 466, 482, 507, 514, 575, 586, 668, 669, 680, 695, 823, 947, 1106, 1107, 1147, 1199, 1200, 1201, 1202, 1206, 1210, 1213, 1221, 1224, 1225, 1228, 1230, 1232, 1235, 1241, 1242, 1282, 1380, 1469, 1666, 1694, 1704, 1706, 1708, 1730, 1732, 1733, 1734, 1737, 1738, 1740, 1743, 1748, 1749, 1752, 1753, 1754, 1755, 1759, 1760, 1764, 1766, 1767, 1768, 1769, 1770, 1772, 1774, 1776, 1777, 1779, 1780, 1782, 1785, 1786, 1787, 1789, 1792, 1794, 1795, 1797, 1799, 1800, 1802, 1804, 1808, 1809, 1812, 1814, 1817, 1824, 1828, 1829, 1832, 1833, 1837, 1838, 1840, 1841, 1843, 1844], "g09": [2, 285, 296, 336, 1769], "g09ur": [2, 285, 296, 336, 1769], "g2": [295, 1714, 1766, 1771, 1842], "g4e0596": 1786, "g6100822": 1786, "g94": 1730, "g_": [377, 1753], "g_converg": [0, 1, 2, 632, 1206, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "g_user_scftyp": 1801, "g_user_wfn": 1801, "ga": [1125, 1221, 1692, 1704, 1706, 1707, 1714, 1731, 1752, 1771, 1837, 1842], "gain": [1230, 1455, 1704, 1756, 1757, 1770, 1781, 1837, 1838], "galv": [1734, 1781], "gam": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "gamess": 1782, "gamlam": [621, 641, 668, 1206, 1704], "gamma": [17, 322, 324, 325, 377, 384, 386, 627, 1206, 1704, 1772, 1841], "gamma_": [377, 1753, 1757], "gamma_1": 1753, "gamma_2": 1753, "gamma_p": 1753, "gamma_q": 1753, "gap": 1757, "garza": [1231, 1616, 1617, 1704], "gatech": [1748, 1781], "gather": [1738, 1757], "gau": [1226, 1324, 1704, 1802], "gau2grid": [1738, 1777, 1780], "gau2grid_dir": 1773, "gau2gridconfig": 1773, "gau2gridfor": 1780, "gau_loos": [1226, 1324, 1704, 1802], "gau_tight": [1226, 1324, 1704, 1802], "gau_verytight": [1226, 1324, 1704, 1802], "gaug": [0, 1, 2, 636, 1206, 1704, 1714, 1730, 1733, 1735, 1739, 1740, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "gauss": [295, 318, 319, 637, 655, 1206, 1704, 1734, 1744, 1745, 1766, 1777, 1780, 1781, 1792, 1800, 1836], "gaussian": [8, 81, 295, 296, 377, 628, 1206, 1704, 1708, 1730, 1734, 1750, 1766, 1769, 1771, 1773, 1775, 1781, 1783, 1810, 1817, 1827, 1838], "gaussian94": [1730, 1743], "gaussianshel": [8, 1817, 1827], "gaussiantyp": 1827, "gauxc": [18, 1231, 1625, 1626, 1629, 1633, 1634, 1636, 1637, 1704, 1738, 1838], "gauxc_dir": 1838, "gauxc_enable_gpu": 1838, "gb": [8, 374, 395, 650, 1206, 1704, 1730, 1742, 1743, 1748, 1750, 1757, 1764, 1767, 1770, 1810, 1821, 1828, 1832, 1838], "gcbee32b": 1786, "gcc": [1736, 1746, 1748, 1767, 1781, 1808], "gcc5": 1738, "gcc6": 1738, "gcc7": 1738, "gcc72": 1738, "gcc_5": 1738, "gcc_linux": 1738, "gccpfx": 1738, "gcov": 1822, "gcp": [106, 267, 295, 318, 319, 400, 1695, 1698, 1700, 1701, 1703, 1738, 1758, 1759, 1766, 1777, 1780, 1781, 1800, 1842], "gcp_engin": [267, 1759], "gcp_v202": 1759, "gdb": [1736, 1767, 1814], "gdma": [400, 1097, 1704, 1705, 1709, 1736, 1738, 1777, 1780, 1785, 1788, 1842], "gdma1": 1719, "gdma_dir": 1775, "gdma_interfac": 1775, "gdma_limit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "gdma_mangl": 1775, "gdma_multipole_unit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "gdma_origin": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "gdma_radiu": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "gdma_switch": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "gdmaconfig": 1775, "ge": [1707, 1731], "geersten": 1734, "gemm": [100, 1810], "gemv": 1810, "gen_davidson": [874, 1210, 1704], "genba": [8, 577, 628, 1206, 1704, 1743], "genbas_1": [628, 1206, 1704], "gener": [0, 1, 2, 16, 90, 100, 106, 148, 150, 163, 216, 247, 267, 279, 284, 291, 292, 294, 295, 296, 297, 303, 314, 330, 331, 335, 341, 343, 345, 347, 368, 369, 372, 377, 407, 470, 570, 573, 574, 575, 584, 586, 590, 603, 618, 619, 623, 628, 644, 669, 765, 786, 832, 886, 975, 1035, 1036, 1037, 1095, 1096, 1108, 1111, 1187, 1206, 1226, 1296, 1326, 1334, 1335, 1682, 1704, 1714, 1726, 1730, 1733, 1734, 1735, 1738, 1739, 1740, 1742, 1743, 1748, 1749, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1761, 1762, 1763, 1764, 1766, 1767, 1769, 1770, 1771, 1774, 1775, 1777, 1780, 1781, 1782, 1783, 1785, 1786, 1787, 1791, 1792, 1794, 1797, 1798, 1799, 1802, 1804, 1808, 1809, 1810, 1817, 1818, 1824, 1828, 1829, 1831, 1832, 1833, 1835, 1837, 1838, 1840, 1841, 1842], "general_invert": 100, "genfromtxt": 2, "geni": 1764, "genuin": 13, "geo": [1785, 1835], "geom": [106, 304, 386, 388, 1714, 1722, 1768, 1785, 1842], "geom1pi": 1833, "geom1psi": 1833, "geom2": 1833, "geom2pi": 1833, "geom2psi": 1833, "geom_maxit": [0, 1, 2, 318, 319, 633, 1206, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "geometr": [106, 318, 319, 673, 702, 1206, 1231, 1505, 1704, 1759, 1774, 1790, 1800], "geometri": [2, 83, 106, 265, 270, 287, 318, 319, 338, 350, 386, 388, 399, 457, 570, 586, 592, 611, 632, 633, 634, 635, 652, 656, 705, 921, 922, 1024, 1199, 1206, 1213, 1217, 1226, 1231, 1301, 1323, 1324, 1325, 1349, 1350, 1351, 1352, 1364, 1365, 1368, 1565, 1692, 1704, 1708, 1710, 1711, 1714, 1715, 1723, 1724, 1735, 1738, 1740, 1742, 1743, 1752, 1753, 1754, 1767, 1769, 1770, 1776, 1777, 1778, 1779, 1781, 1782, 1785, 1790, 1792, 1794, 1798, 1799, 1831, 1834, 1835, 1837, 1838, 1840, 1841, 1842], "geometric_keyword": 1802, "geometryunit": [106, 1827], "georgia": [1692, 1752], "gepol": 1803, "gerg": 1735, "get": [11, 64, 68, 73, 86, 87, 88, 98, 100, 106, 114, 137, 148, 150, 201, 220, 247, 300, 301, 302, 306, 307, 318, 319, 575, 793, 1206, 1210, 1704, 1714, 1722, 1736, 1737, 1740, 1743, 1748, 1757, 1764, 1767, 1770, 1772, 1777, 1781, 1785, 1788, 1795, 1798, 1800, 1801, 1808, 1809, 1810, 1817, 1818, 1820, 1821, 1822, 1828, 1833, 1838, 1840, 1841, 1842, 1844], "get_active_molecul": [378, 1837], "get_algorithm": 78, "get_amplitud": 11, "get_ao_cor": 27, "get_ao_s": 27, "get_arrai": 150, "get_array_vari": 1775, "get_basisset": 150, "get_block": [88, 100, 147, 148], "get_blocks12": 1817, "get_blocks34": 1817, "get_bool": 114, "get_cosx_grid": 18, "get_current_modul": 114, "get_default_namespac": 86, "get_default_path": 87, "get_dens": 150, "get_dimens": 13, "get_dipole_field_strength": 150, "get_doubl": 114, "get_dpd_id": 90, "get_energi": 84, "get_file_path": 87, "get_frag": 106, "get_fragment_charg": 106, "get_fragment_multipl": 106, "get_fragment_typ": 106, "get_frozen_core_energi": 90, "get_full_point_group": 106, "get_full_point_group_with_n": 106, "get_global_opt": [8, 1801, 1809, 1837], "get_gradi": 1743, "get_int": 114, "get_int_vector": 114, "get_keep_dpd_so_int": 90, "get_keep_ht_int": 90, "get_keep_iwl_so_int": 90, "get_local_opt": 1801, "get_memori": [27, 90, 374, 395], "get_method": 27, "get_metr": 78, "get_mix_data": 96, "get_mo_cor": 27, "get_np_xyzw": 147, "get_omega": 92, "get_omega_alpha": 92, "get_omega_beta": 92, "get_opdm": [13, 150, 314, 1791], "get_opt": [8, 195, 197, 1801, 1809], "get_orbit": 13, "get_pivot": 78, "get_point": 1810, "get_print": [90, 150], "get_psi_result": [1740, 1772, 1794], "get_psio": 90, "get_result": [265, 1740, 1772, 1794], "get_reverse_pivot": 78, "get_schwarz_cutoff": 27, "get_scratch_filenam": 150, "get_snlink_max_am": 18, "get_space_s": 27, "get_str": 114, "get_tei_already_presort": 90, "get_tensor": 27, "get_tensor_pqq": 75, "get_tensor_s": 27, "get_tensor_shap": 27, "get_tpdm": 13, "get_vari": [106, 150, 1738, 1743, 1832, 1834], "get_wcombin": 92, "get_x1": 94, "get_x2": 94, "get_x3": 94, "get_x4": 94, "get_z": 94, "getbasetemp": 1788, "getcharg": 73, "getconf": [1738, 1748], "getpid": [86, 354], "gev": 1706, "gfm": [1225, 1288, 1295, 1704], "gfortran": [1738, 1748, 1808], "gfortran_linux": 1738, "gfortran_osx": 1738, "gg": 1839, "gga": [138, 295, 318, 319, 400, 1695, 1696, 1697, 1698, 1700, 1701, 1702, 1703, 1714, 1739, 1757, 1766, 1781, 1800, 1838, 1842], "gga1": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "gga_c_pb": 1757, "gga_superfunc": [1714, 1842], "gga_x_pb": 1757, "gh": [1788, 1833], "gha": [1738, 1786, 1788], "ghost": [79, 106, 1061, 1218, 1692, 1704, 1711, 1714, 1721, 1724, 1743, 1752, 1776, 1802, 1828, 1832, 1837, 1842, 1844], "ghost_as_dummi": 106, "ghost_format": 106, "ghrn": 1788, "giampaolo": 1738, "giao": [669, 1206, 1704, 1708], "gib": 1819, "gibb": [1691, 1714, 1776, 1828, 1842, 1843, 1844], "gibi": 1821, "gibibyt": 1821, "giga": 1821, "gigant": [882, 1210, 1704], "gij": 1791, "gill": 1757, "git": [1736, 1737, 1748, 1767, 1777, 1781, 1788, 1805, 1806, 1814], "git_repositori": 1738, "git_tag": [1738, 1788], "github": [372, 561, 993, 1204, 1215, 1704, 1736, 1738, 1746, 1748, 1751, 1757, 1759, 1767, 1781, 1782, 1785, 1787, 1802, 1803, 1805, 1806, 1814, 1816, 1817, 1833, 1837, 1838], "gitlab": [1692, 1752, 1784], "give": [0, 70, 100, 148, 331, 377, 617, 671, 693, 701, 783, 784, 808, 823, 835, 1102, 1125, 1159, 1160, 1161, 1162, 1164, 1165, 1206, 1210, 1221, 1704, 1737, 1738, 1743, 1748, 1752, 1755, 1770, 1771, 1785, 1786, 1795, 1797, 1809, 1828, 1837, 1844], "given": [5, 8, 17, 64, 73, 81, 84, 86, 87, 100, 103, 106, 111, 112, 115, 134, 138, 148, 284, 295, 314, 326, 331, 550, 592, 609, 622, 650, 651, 660, 671, 672, 704, 827, 833, 859, 860, 884, 1203, 1206, 1210, 1704, 1714, 1730, 1738, 1740, 1742, 1755, 1759, 1763, 1766, 1771, 1775, 1776, 1781, 1791, 1797, 1801, 1809, 1810, 1817, 1821, 1824, 1828, 1829, 1833, 1836, 1837, 1838, 1842, 1844], "gk": 1757, "glanc": 1788, "glean": [1739, 1742, 1743, 1756, 1757, 1781, 1798, 1817], "glick": [1734, 1763, 1781], "global": [8, 86, 114, 138, 171, 176, 195, 196, 197, 200, 208, 210, 212, 227, 230, 235, 243, 255, 262, 263, 326, 327, 351, 370, 371, 376, 397, 400, 1704, 1705, 1714, 1752, 1757, 1764, 1767, 1777, 1799, 1809, 1812, 1828, 1832, 1837, 1842, 1844], "global_opt": 1801, "globalsonli": 370, "globular": 1763, "glossary_psivari": 1823, "glycin": [1714, 1833, 1842], "gm": [1692, 1752], "gmail": 1738, "gn": 1790, "gnu": [1738, 1764, 1781, 1808], "go": [804, 1047, 1210, 1218, 1230, 1231, 1441, 1612, 1704, 1737, 1738, 1740, 1743, 1748, 1755, 1785, 1788, 1801, 1804, 1810, 1824, 1828, 1837, 1844], "goal": [1804, 1808], "goddard": 1734, "goe": [283, 333, 366, 379, 1225, 1283, 1294, 1704, 1730, 1738, 1756, 1821, 1828, 1844], "goerigk": 1734, "gold": 1740, "gomp": 1738, "gonthier": [1734, 1781, 1786, 1837, 1838], "good": [0, 2, 86, 106, 374, 386, 395, 833, 1210, 1229, 1688, 1704, 1737, 1738, 1743, 1748, 1750, 1754, 1755, 1756, 1757, 1763, 1764, 1781, 1786, 1809, 1817, 1824, 1828, 1837, 1838, 1844], "gordan": 1837, "gordon": [1734, 1757, 1759, 1771, 1798], "gori": 1738, "got": [2, 1737, 1757, 1770, 1781, 1833, 1838], "goto": [1737, 1788], "gotobla": 1738, "gotten": 1738, "gov": 1734, "govern": [268, 433, 466, 507, 514, 1199, 1200, 1201, 1202, 1225, 1242, 1704, 1738, 1742, 1743, 1785, 1801, 1808, 1809, 1832, 1840], "gpl": 1781, "gpu": [1105, 1221, 1231, 1624, 1637, 1704, 1720, 1734, 1738, 1777, 1780, 1838], "gpu_dfcc": [400, 1738, 1842], "gpudfcc1": 1720, "gpudfcc2": 1720, "grab": [1748, 1788], "grac": [138, 1230, 1472, 1473, 1474, 1704, 1714, 1837, 1842], "grac_alpha": 138, "grac_beta": 138, "grac_shift": 138, "grad": [303, 845, 1025, 1210, 1217, 1704, 1708, 1711, 1713, 1714, 1715, 1722, 1743, 1769, 1775, 1842], "grad1": [1714, 1842], "grad2": [1714, 1842], "grad3": [1714, 1842], "grad4": [1714, 1842], "grad5": [1714, 1838, 1842], "gradient": [2, 61, 73, 100, 103, 106, 133, 147, 150, 241, 262, 265, 267, 268, 285, 296, 300, 301, 302, 303, 307, 312, 318, 319, 335, 336, 367, 378, 568, 571, 581, 586, 599, 601, 609, 610, 615, 618, 632, 665, 669, 679, 692, 698, 707, 743, 750, 845, 854, 857, 876, 930, 946, 949, 950, 958, 1011, 1025, 1174, 1198, 1201, 1202, 1205, 1206, 1208, 1210, 1213, 1216, 1217, 1222, 1225, 1231, 1266, 1271, 1281, 1285, 1286, 1290, 1497, 1522, 1523, 1524, 1525, 1526, 1648, 1674, 1685, 1690, 1704, 1706, 1708, 1711, 1714, 1715, 1718, 1721, 1722, 1725, 1735, 1738, 1739, 1740, 1742, 1743, 1746, 1754, 1755, 1756, 1757, 1759, 1769, 1771, 1772, 1774, 1775, 1776, 1777, 1779, 1781, 1785, 1789, 1790, 1794, 1796, 1798, 1802, 1803, 1804, 1809, 1817, 1823, 1828, 1831, 1832, 1837, 1838, 1840, 1842, 1844], "gradient_": 150, "gradient_body_dict": 1794, "gradient_on_charg": 73, "gradient_rm": 133, "gradient_writ": [0, 1, 2, 306, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "gradonli": [615, 1206, 1704], "gradual": 1759, "grafova": [1692, 1752], "grai": 1750, "grain": [1754, 1817], "gram": 1706, "grand": 1734, "graph": 1768, "graphic": [1734, 1838], "gravit": [1706, 1832], "graviti": 1706, "grd": 1743, "great": [605, 1206, 1704, 1767, 1788, 1808, 1822, 1824], "greater": [2, 285, 287, 336, 338, 577, 808, 852, 1206, 1210, 1704, 1753, 1761, 1763, 1767, 1785, 1796, 1798, 1802, 1817, 1828, 1838], "greatli": [1753, 1798, 1810, 1824, 1833, 1837, 1838, 1841], "green": [1738, 1748, 1750], "grep": [1743, 1785, 1786, 1788, 1802, 1828, 1844], "grid": [2, 18, 70, 94, 105, 110, 111, 138, 147, 291, 341, 637, 770, 967, 968, 969, 970, 1031, 1033, 1101, 1114, 1116, 1131, 1133, 1134, 1135, 1136, 1137, 1142, 1206, 1209, 1218, 1220, 1221, 1231, 1487, 1490, 1492, 1493, 1494, 1495, 1496, 1515, 1517, 1519, 1527, 1535, 1545, 1590, 1595, 1597, 1621, 1625, 1631, 1632, 1633, 1635, 1636, 1659, 1690, 1704, 1710, 1714, 1750, 1754, 1773, 1775, 1776, 1790, 1838, 1842], "grid_data": 110, "grid_esp": [111, 1799], "grid_field": [111, 1799], "grimm": [106, 267, 1225, 1256, 1704, 1714, 1715, 1734, 1738, 1756, 1757, 1767, 1777, 1780, 1781, 1837, 1842], "ground": [0, 314, 352, 679, 992, 1181, 1206, 1215, 1222, 1231, 1610, 1704, 1714, 1739, 1742, 1743, 1746, 1776, 1791, 1792, 1828, 1838, 1841, 1842, 1844], "group": [2, 17, 20, 91, 106, 120, 150, 265, 295, 390, 569, 574, 593, 616, 619, 660, 697, 698, 993, 1015, 1206, 1215, 1216, 1232, 1666, 1692, 1704, 1714, 1730, 1733, 1735, 1738, 1740, 1749, 1752, 1754, 1757, 1766, 1777, 1779, 1782, 1790, 1794, 1801, 1802, 1803, 1817, 1833, 1837, 1838, 1842, 1843], "groupbi": 389, "grow": 1833, "gtfock": [84, 721, 1166, 1207, 1221, 1231, 1609, 1704], "gtrsim": 1838, "guarante": [0, 84, 292, 343, 344, 609, 647, 1206, 1704, 1738, 1753, 1757, 1781, 1821, 1837], "guess": [0, 1, 2, 84, 329, 335, 342, 356, 393, 407, 448, 457, 474, 476, 496, 498, 499, 500, 603, 638, 648, 660, 672, 706, 724, 731, 739, 742, 749, 757, 823, 830, 833, 834, 851, 881, 884, 1197, 1199, 1200, 1206, 1207, 1208, 1226, 1229, 1338, 1342, 1418, 1558, 1565, 1603, 1604, 1605, 1609, 1611, 1640, 1651, 1694, 1704, 1708, 1714, 1729, 1730, 1732, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1790, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1828, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1839, 1840, 1841, 1842, 1843, 1844], "guess_ca": 84, "guess_cb": 84, "guess_mix": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "guess_persist": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "guess_r_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "guess_vector": [0, 1, 2, 833, 861, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "guessbasi": 1809, "guessbasisdf": 1809, "guest": 1781, "gui": [1738, 1748, 1791], "guid": [279, 318, 319, 1736, 1737, 1738, 1748, 1767, 1800, 1817], "guidanc": [1738, 1770, 1781, 1788], "guidelin": [1757, 1785, 1801, 1821], "gwh": [1231, 1563, 1704, 1757, 1838], "gxx": 1738, "gxx_linux": 1738, "gyromag": 1706, "gz": [1759, 1788], "gzip": 1750, "h": [2, 11, 13, 16, 88, 100, 106, 148, 150, 295, 307, 426, 443, 444, 479, 482, 519, 521, 543, 545, 628, 811, 835, 837, 842, 873, 1126, 1198, 1199, 1200, 1202, 1203, 1206, 1210, 1221, 1226, 1326, 1668, 1669, 1690, 1704, 1706, 1707, 1708, 1714, 1730, 1731, 1733, 1734, 1738, 1740, 1743, 1746, 1747, 1748, 1749, 1750, 1753, 1754, 1755, 1756, 1757, 1759, 1762, 1763, 1764, 1766, 1767, 1768, 1770, 1771, 1772, 1773, 1775, 1776, 1781, 1782, 1783, 1784, 1785, 1786, 1789, 1792, 1793, 1794, 1795, 1798, 1802, 1803, 1805, 1810, 1823, 1828, 1829, 1832, 1833, 1836, 1837, 1838, 1839, 1841, 1842, 1843, 1844], "h0": [830, 833, 834, 1210, 1704], "h0_block": [830, 833, 1210, 1704], "h0_block_coupl": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "h0_block_coupling_s": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "h0_blocksiz": [0, 1, 2, 874, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "h0_guess_siz": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "h0block": [874, 1210, 1704], "h0block_inv": [874, 1210, 1704], "h1": [329, 356, 1730, 1833], "h1x": 329, "h2": [295, 329, 356, 1692, 1714, 1752, 1766, 1802, 1832, 1833, 1842], "h2_energi": 1832, "h2o": [2, 284, 288, 289, 295, 300, 301, 302, 318, 319, 339, 340, 381, 382, 1692, 1712, 1714, 1716, 1718, 1720, 1723, 1727, 1730, 1738, 1740, 1750, 1752, 1756, 1757, 1759, 1763, 1766, 1767, 1771, 1772, 1782, 1792, 1794, 1800, 1802, 1826, 1828, 1832, 1838, 1842, 1844], "h2o2": [1714, 1841, 1842], "h2o_shap": [1692, 1752], "h2o_siz": [1692, 1752], "h2x": 329, "h3": [1729, 1802], "h3o": [317, 365, 1799], "h4": 106, "h_": [1757, 1836, 1838], "h_0": [873, 1210, 1704], "h_1": [873, 1210, 1704], "h_approx_diag": 133, "h_bond_connect": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "h_corr": 1843, "h_ene": 1833, "h_energi": 1832, "h_guess_everi": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "h_label": 1833, "h_p": 1753, "h_update_den_tol": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "h_yne": 1833, "ha": [0, 2, 8, 84, 106, 110, 150, 208, 209, 210, 212, 235, 236, 265, 266, 267, 270, 276, 279, 280, 282, 284, 329, 332, 342, 356, 377, 381, 382, 399, 471, 568, 569, 574, 593, 603, 611, 612, 614, 632, 633, 634, 642, 643, 647, 652, 655, 656, 675, 694, 697, 703, 884, 1095, 1200, 1206, 1210, 1219, 1231, 1626, 1629, 1634, 1655, 1704, 1714, 1733, 1735, 1736, 1737, 1738, 1739, 1740, 1742, 1743, 1746, 1748, 1749, 1750, 1751, 1753, 1755, 1756, 1757, 1759, 1762, 1764, 1765, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1792, 1794, 1798, 1801, 1802, 1803, 1804, 1806, 1807, 1808, 1809, 1810, 1816, 1817, 1824, 1826, 1828, 1829, 1832, 1833, 1837, 1838, 1839, 1841, 1842, 1844], "hacki": 247, "had": [399, 1738, 1788, 1801, 1838], "hadz": 1733, "haettig": [0, 1734], "hald": 1734, "half": [90, 103, 322, 325, 377, 884, 1210, 1704, 1708, 1738, 1750, 1810, 1828, 1841, 1844], "half_tran": 90, "halftran": 90, "halkier": 1740, "halt": 1743, "hamiltionian": [284, 1740], "hamiltonian": [0, 13, 84, 163, 298, 342, 348, 356, 474, 477, 638, 639, 660, 718, 805, 811, 833, 836, 874, 1163, 1200, 1201, 1206, 1207, 1210, 1221, 1229, 1231, 1407, 1412, 1413, 1414, 1587, 1589, 1704, 1730, 1742, 1755, 1757, 1762, 1777, 1781, 1785, 1790, 1798, 1829, 1837, 1838, 1841], "hamiltonian_solv": 329, "hamiltoniansolv": 1841, "hampel": [443, 479, 519, 543, 1199, 1200, 1202, 1203, 1704], "hand": [2, 297, 347, 356, 699, 1206, 1704, 1708, 1743, 1750, 1757, 1769, 1770, 1776, 1788, 1817, 1821, 1824, 1838, 1841], "handi": [2, 1734, 1754, 1755, 1772, 1834], "handl": [2, 8, 88, 106, 118, 265, 283, 333, 342, 356, 430, 568, 627, 837, 858, 935, 961, 1199, 1206, 1213, 1232, 1666, 1704, 1708, 1714, 1735, 1736, 1740, 1742, 1743, 1748, 1755, 1767, 1768, 1780, 1782, 1785, 1788, 1789, 1794, 1803, 1804, 1805, 1809, 1810, 1812, 1817, 1823, 1824, 1833, 1837, 1841, 1842, 1843], "handler": [1714, 1738, 1757, 1842], "handshak": 370, "handwritten": 1817, "hansen": 1734, "haphazard": 1738, "happen": [2, 609, 861, 1206, 1210, 1704, 1738, 1755, 1770, 1786, 1801, 1833, 1837], "happi": 1738, "haqz": 1733, "har": [106, 1759, 1783, 1832], "hard": [607, 1206, 1231, 1598, 1660, 1704, 1747, 1767, 1821], "hardwar": [1231, 1620, 1704, 1738, 1763, 1838], "hargu": 1734, "harmless": 1738, "harmon": [8, 81, 103, 214, 300, 301, 302, 384, 399, 615, 617, 669, 691, 707, 763, 764, 766, 1206, 1209, 1704, 1730, 1754, 1761, 1777, 1781, 1801, 1810, 1817, 1828, 1831, 1838, 1840, 1844], "harmonic_analysi": [150, 384, 399], "harte": 1837, "hartre": [284, 295, 300, 301, 302, 306, 307, 318, 319, 442, 518, 542, 632, 676, 1199, 1202, 1203, 1206, 1230, 1231, 1473, 1474, 1663, 1690, 1695, 1697, 1698, 1700, 1703, 1704, 1706, 1740, 1743, 1744, 1745, 1749, 1753, 1754, 1755, 1757, 1758, 1766, 1769, 1770, 1771, 1772, 1776, 1777, 1778, 1790, 1800, 1803, 1810, 1823, 1832, 1836, 1837, 1843], "hartree2aj": 1706, "hartree2ev": 1706, "hartree2j": 1706, "hartree2kcalmol": [1706, 1828, 1832], "hartree2kjmol": 1706, "hartree2mhz": 1706, "hartree2wavenumb": 1706, "hartree_atomic_mass_unit_relationship": 1706, "hartree_electron_volt_relationship": 1706, "hartree_energi": 1706, "hartree_energy_in_ev": 1706, "hartree_hertz_relationship": 1706, "hartree_inverse_meter_relationship": 1706, "hartree_joule_relationship": 1706, "hartree_kelvin_relationship": 1706, "hartree_kilogram_relationship": 1706, "harvest": [1714, 1842], "has_array_vari": 150, "has_chang": [235, 236, 326, 327, 370, 1777, 1809, 1812], "has_ecp": 8, "has_global_option_chang": 1801, "has_local_option_chang": 1801, "has_option_chang": 1801, "has_potential_vari": 150, "has_puream": [8, 1801], "has_scalar_vari": 150, "has_vari": [150, 207, 211], "has_zmatrix": 106, "haser": [1734, 1838], "hash": [106, 1730, 1786, 1788], "hasn": [2, 882, 1210, 1704, 1743, 1786, 1788], "hat": [917, 1213, 1704, 1738, 1742, 1757, 1763, 1771, 1798, 1829, 1836, 1838], "hattig": 1734, "hatz": 1733, "have": [2, 106, 150, 171, 220, 230, 262, 263, 279, 284, 342, 356, 370, 399, 430, 574, 605, 609, 641, 671, 681, 692, 823, 827, 948, 1070, 1076, 1088, 1096, 1124, 1126, 1199, 1206, 1210, 1213, 1219, 1221, 1225, 1231, 1248, 1615, 1620, 1704, 1730, 1733, 1735, 1736, 1737, 1738, 1740, 1743, 1746, 1747, 1748, 1753, 1755, 1756, 1757, 1759, 1761, 1763, 1764, 1767, 1770, 1771, 1775, 1776, 1780, 1781, 1782, 1785, 1786, 1788, 1789, 1797, 1798, 1802, 1804, 1808, 1809, 1810, 1813, 1817, 1821, 1824, 1825, 1828, 1829, 1832, 1833, 1835, 1837, 1838, 1839, 1840, 1844], "hazard": [471, 1200, 1704], "hb": [1692, 1752], "hb6": [1692, 1752], "hbar": [368, 369, 377, 474, 483, 501, 1200, 1704, 1742], "hbc6": 1832, "hbc60": [1692, 1752], "hbc6a": [1692, 1752], "hbc6arlx": [1692, 1752], "hc": 1706, "hcch": [1692, 1752], "hcl": [1714, 1842], "hcn": [1714, 1715, 1842], "hcore": [90, 298, 348], "hcth": [295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "hcth120": [295, 318, 319, 1695, 1697, 1698, 1699, 1703, 1758, 1766, 1800], "hcth147": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "hcth407": [295, 318, 319, 1695, 1697, 1698, 1699, 1703, 1758, 1766, 1800], "hcth407p": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "hcth93": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "hcthh": [295, 318, 319, 1695, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "hcthp14": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "hcthp76": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "hd": [804, 1210, 1704], "hd_avg": [0, 1, 2, 861, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "hd_exact": [835, 1210, 1704], "hd_kave": [835, 1210, 1704], "hd_otf": [0, 1, 2, 861, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "hd_vector": 13, "hdf5": [1738, 1746], "hdfgroup": 1738, "he": [697, 1126, 1206, 1221, 1692, 1704, 1707, 1714, 1728, 1731, 1733, 1738, 1752, 1757, 1782, 1794, 1806, 1833, 1837, 1838, 1842], "he2": [1714, 1833, 1842], "head": [1734, 1747, 1748, 1757, 1759, 1771, 1786, 1788, 1798, 1806], "header": [2, 76, 147, 296, 298, 348, 1230, 1463, 1704, 1738, 1768, 1769, 1785, 1786, 1788, 1804, 1808, 1818, 1834, 1837], "headlin": 1788, "heal": 1786, "heap": 1742, "hear": [1692, 1738, 1752], "heart": 1743, "heavi": [1051, 1218, 1694, 1704, 1707, 1730, 1731, 1732, 1733, 1742, 1756, 1757, 1770, 1823, 1824, 1828, 1838, 1844], "heavier": [1230, 1445, 1704, 1837], "heavili": [295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1757, 1758, 1766, 1800], "heff4": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "heff_print": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "hefti": 1748, "hehe": [1692, 1752], "heid": [1734, 1802], "height": [282, 323, 332, 1692, 1750, 1752, 1835], "heisenberg": 1837, "hekr": [1692, 1752], "held": [433, 466, 507, 514, 580, 641, 842, 1199, 1200, 1201, 1202, 1206, 1210, 1225, 1242, 1704, 1742, 1837], "helfem": 1838, "helgak": [284, 810, 1210, 1692, 1704, 1734, 1740, 1741, 1743, 1752, 1802, 1832], "helion": 1706, "helion_electron_mass_ratio": 1706, "helion_g_factor": 1706, "helion_mag_mom": 1706, "helion_mag_mom_to_bohr_magneton_ratio": 1706, "helion_mag_mom_to_nuclear_magneton_ratio": 1706, "helion_mass": 1706, "helion_mass_energy_equival": 1706, "helion_mass_energy_equivalent_in_mev": 1706, "helion_mass_in_u": 1706, "helion_molar_mass": 1706, "helion_proton_mass_ratio": 1706, "helium": [628, 1206, 1692, 1704, 1714, 1728, 1752, 1757, 1794, 1806, 1833, 1838, 1842], "hellmann": 1798, "hello": 1799, "helmholtz": 1838, "helmholz": 1838, "help": [0, 2, 284, 433, 466, 471, 507, 514, 657, 671, 729, 842, 906, 1124, 1199, 1200, 1201, 1202, 1206, 1208, 1210, 1212, 1221, 1225, 1229, 1231, 1242, 1405, 1499, 1704, 1738, 1740, 1742, 1743, 1747, 1748, 1750, 1755, 1757, 1767, 1770, 1777, 1781, 1786, 1789, 1801, 1802, 1818, 1828, 1838, 1844], "helper": [73, 283, 333, 366, 379, 393, 1714, 1740, 1797, 1823, 1828, 1832, 1842], "helpmanu": 1738, "henc": [660, 679, 1206, 1704, 1748, 1755, 1757, 1794, 1798, 1821, 1828, 1829, 1837, 1844], "hene": [1692, 1752], "herbst": [0, 1734, 1777, 1780, 1781], "herbst2020": [0, 1734], "here": [2, 84, 267, 284, 285, 329, 336, 370, 381, 382, 608, 669, 993, 1124, 1206, 1215, 1221, 1226, 1231, 1324, 1633, 1704, 1708, 1714, 1730, 1737, 1738, 1740, 1741, 1742, 1743, 1746, 1749, 1752, 1753, 1756, 1757, 1759, 1764, 1767, 1770, 1774, 1781, 1782, 1785, 1786, 1788, 1792, 1797, 1801, 1802, 1803, 1808, 1809, 1810, 1816, 1823, 1826, 1828, 1833, 1837, 1838, 1842, 1844], "hereaft": [1738, 1785, 1798, 1833], "hermit": [100, 637, 1206, 1704, 1841], "hermitan": 342, "hermitian": [329, 335, 356, 1753, 1841], "hermitivit": 100, "hern": 1734, "hertz": 1706, "hertz_atomic_mass_unit_relationship": 1706, "hertz_electron_volt_relationship": 1706, "hertz_hartree_relationship": 1706, "hertz_inverse_meter_relationship": 1706, "hertz_joule_relationship": 1706, "hertz_kelvin_relationship": 1706, "hertz_kilogram_relationship": 1706, "hess": [386, 387, 399, 1026, 1122, 1217, 1221, 1704, 1713, 1714, 1777, 1780, 1785, 1836, 1842], "hess1": [1714, 1842], "hess2": [1714, 1842], "hess3": [1714, 1842], "hess4": [1714, 1842], "hess5": [1714, 1842], "hess_typ": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "hess_upd": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "hess_update_limit": [0, 1, 2, 1331, 1332, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "hess_update_limit_max": [0, 1, 2, 1332, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "hess_update_limit_scal": [0, 1, 2, 1331, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "hess_update_use_last": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "hesselmann": [1230, 1469, 1470, 1704, 1734, 1837], "hessian": [84, 103, 128, 147, 150, 242, 265, 267, 268, 300, 301, 302, 318, 319, 335, 378, 384, 386, 387, 389, 399, 571, 596, 603, 611, 635, 640, 652, 656, 666, 681, 706, 745, 756, 843, 926, 944, 946, 1026, 1170, 1206, 1208, 1210, 1213, 1217, 1221, 1225, 1279, 1281, 1300, 1323, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1338, 1342, 1685, 1690, 1704, 1708, 1714, 1718, 1725, 1738, 1739, 1740, 1742, 1752, 1753, 1754, 1756, 1757, 1771, 1776, 1777, 1781, 1785, 1789, 1790, 1791, 1794, 1796, 1798, 1800, 1803, 1828, 1831, 1832, 1838, 1840, 1841, 1842, 1844], "hessian_": 150, "hessian_body_dict": 1794, "hessian_with": [318, 319, 1800], "hessian_writ": [0, 1, 2, 307, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "heurist": [0, 1757, 1759], "hexachlorocyclohexan": 1833, "hexadecapol": [1685, 1776], "hf": [2, 14, 76, 92, 106, 128, 130, 138, 145, 150, 241, 242, 262, 267, 284, 295, 300, 301, 302, 314, 317, 318, 319, 365, 381, 382, 394, 597, 658, 660, 664, 684, 926, 1045, 1206, 1213, 1218, 1467, 1670, 1679, 1689, 1690, 1692, 1695, 1697, 1698, 1700, 1702, 1703, 1704, 1707, 1710, 1711, 1714, 1718, 1724, 1730, 1731, 1735, 1738, 1739, 1740, 1743, 1744, 1745, 1752, 1757, 1758, 1759, 1763, 1766, 1767, 1768, 1770, 1772, 1774, 1776, 1777, 1781, 1790, 1791, 1798, 1799, 1800, 1802, 1826, 1827, 1828, 1836, 1837, 1841, 1842, 1844], "hf3c": [106, 295, 318, 319, 1695, 1698, 1700, 1703, 1718, 1758, 1766, 1774, 1800], "hf_guess": 1768, "hg": [1707, 1731], "hhff": 1768, "hi": 1804, "hidden": [1736, 1743, 1767, 1838], "hide": 1738, "hierarch": 1813, "hierarchi": 1767, "high": [2, 20, 265, 285, 287, 336, 338, 697, 1206, 1692, 1704, 1710, 1734, 1736, 1740, 1742, 1748, 1752, 1753, 1754, 1755, 1757, 1767, 1781, 1788, 1794, 1810, 1829, 1837, 1838], "high_mem": [951, 1213, 1704], "higher": [20, 265, 471, 596, 644, 795, 1153, 1200, 1206, 1210, 1221, 1226, 1228, 1230, 1305, 1380, 1455, 1480, 1704, 1738, 1739, 1740, 1742, 1749, 1754, 1756, 1776, 1781, 1790, 1794, 1799, 1802, 1809, 1810, 1817, 1829, 1832, 1838], "highest": [2, 106, 150, 285, 300, 301, 302, 336, 386, 489, 671, 696, 1126, 1200, 1206, 1221, 1704, 1740, 1750, 1755, 1761, 1772, 1783, 1809, 1833], "highest_1": [284, 1740, 1741, 1743], "highli": [726, 1208, 1704, 1714, 1734, 1753, 1754, 1755, 1757, 1763, 1781, 1810, 1829, 1837, 1838, 1842], "highlight": [0, 1736, 1767, 1814, 1817, 1828, 1838], "hik": 1730, "him": 1775, "hint": [1738, 1746, 1749, 1762, 1765, 1768, 1773, 1775, 1782, 1783, 1784, 1803, 1806, 1807, 1839], "hirata": [1734, 1755], "hirshfeld": 1799, "histori": [767, 1209, 1226, 1353, 1372, 1373, 1704, 1738, 1754, 1786, 1802, 1804], "hit": [1737, 1738, 1838], "hj": [295, 1695, 1697, 1698, 1700, 1701, 1757, 1758, 1766], "hlsearch": 1738, "hnc": [1714, 1842], "ho2": [1713, 1714, 1842], "hobza": [1692, 1752, 1832], "hod": [574, 1206, 1704], "hof": [1714, 1842], "hoffmann": 1734, "hoh": 1802, "hohenberg": [1734, 1757], "hohenstein": [1692, 1734, 1752, 1770, 1781, 1786, 1828, 1837, 1844], "hold": [106, 274, 275, 284, 321, 329, 388, 888, 1210, 1704, 1708, 1714, 1740, 1741, 1759, 1817, 1837, 1838, 1842, 1844], "hold_met": 27, "hole": [794, 795, 859, 860, 875, 890, 1210, 1704, 1755, 1757, 1805, 1829], "holger": 1760, "holst": 1734, "home": [323, 1748, 1767, 1788, 1828, 1832], "homebrew": [1736, 1750, 1767], "homo": [476, 671, 896, 1200, 1206, 1211, 1231, 1564, 1704, 1713, 1714, 1750, 1757, 1768, 1837, 1838, 1842], "homo_occ": 1768, "homogen": 325, "honestli": 1822, "hooh": [1714, 1802, 1842], "hook": [1777, 1808, 1814], "hopefulli": [1788, 1844], "host": [1738, 1767], "houck": [1734, 1805, 1806], "hover": 1788, "how": [2, 106, 138, 265, 321, 377, 389, 659, 700, 728, 786, 813, 835, 837, 846, 993, 1125, 1154, 1206, 1208, 1210, 1215, 1221, 1225, 1229, 1230, 1231, 1296, 1417, 1472, 1556, 1704, 1714, 1736, 1740, 1742, 1755, 1756, 1767, 1770, 1771, 1777, 1780, 1781, 1787, 1788, 1794, 1798, 1801, 1802, 1804, 1812, 1813, 1814, 1815, 1817, 1819, 1824, 1828, 1829, 1831, 1833, 1837, 1842, 1844], "howev": [0, 342, 575, 577, 609, 680, 706, 727, 827, 921, 922, 1206, 1208, 1210, 1213, 1704, 1730, 1738, 1739, 1742, 1748, 1753, 1755, 1756, 1757, 1770, 1771, 1789, 1797, 1798, 1799, 1802, 1817, 1824, 1829, 1832, 1833, 1837, 1838, 1841, 1843, 1844], "hp": [575, 1206, 1704], "hpbeint": [295, 318, 319, 1695, 1698, 1700, 1703, 1758, 1766, 1800], "hpp": 1765, "hse": 1757, "hse03": [295, 1695, 1697, 1698, 1700, 1701, 1758, 1766], "hse06": [295, 1695, 1697, 1698, 1700, 1701, 1758, 1766], "hsg": [1714, 1832, 1842], "hsg0": [1692, 1752], "hsga": [1692, 1752], "htbh": 1832, "htm": [2, 285, 296, 336, 1692, 1752, 1769], "html": [2, 287, 338, 373, 388, 391, 993, 1215, 1704, 1737, 1738, 1746, 1748, 1764, 1788, 1828], "http": [0, 2, 106, 285, 287, 296, 297, 308, 336, 338, 347, 372, 377, 388, 561, 993, 1204, 1215, 1692, 1704, 1714, 1717, 1734, 1735, 1737, 1738, 1740, 1743, 1746, 1748, 1750, 1751, 1752, 1759, 1761, 1764, 1768, 1769, 1774, 1776, 1781, 1782, 1784, 1785, 1786, 1788, 1791, 1792, 1805, 1806, 1821, 1822, 1828, 1833, 1837, 1839, 1842], "hu": 1792, "hub": 1788, "huckel": [1231, 1563, 1704, 1838], "huge": [811, 1210, 1704, 1755], "hugo": 1788, "hujo": [1734, 1759], "human": [266, 268, 269, 270, 276, 277, 278, 280], "hundredth": 1838, "hungari": [586, 1206, 1704], "hungarian": 106, "hurdl": 1838, "hurt": 1786, "hwen": [615, 1206, 1704], "hx": [295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "hx_function": 335, "hyb": [295, 318, 319, 1695, 1697, 1698, 1700, 1701, 1702, 1703, 1758, 1766, 1800], "hybrid": [295, 318, 319, 400, 957, 1213, 1225, 1230, 1231, 1289, 1468, 1513, 1690, 1695, 1697, 1698, 1701, 1702, 1703, 1704, 1714, 1718, 1734, 1739, 1757, 1766, 1770, 1776, 1781, 1797, 1798, 1800, 1834, 1837, 1838, 1842], "hybrid_superfunc": [1714, 1718, 1842], "hydrogen": [106, 628, 1206, 1692, 1704, 1714, 1730, 1752, 1770, 1781, 1785, 1802, 1828, 1833, 1842, 1844], "hydronium": [1714, 1842], "hydroxyl": [1710, 1714, 1770, 1842], "hylleraa": [1734, 1763], "hypercontract": 94, "hyperlink": [1764, 1801], "hyperpol": [669, 1206, 1704], "hyperpolariz": [669, 1206, 1704, 1706], "hyphen": 2, "hz": [550, 1203, 1704, 1706, 1742], "h\u00fcckel": [781, 1209, 1704, 1754], "i": [0, 1, 2, 5, 8, 11, 13, 15, 16, 17, 18, 61, 64, 81, 84, 86, 87, 91, 100, 103, 106, 110, 111, 115, 138, 139, 143, 144, 148, 150, 188, 195, 197, 200, 207, 208, 209, 210, 211, 213, 219, 235, 236, 241, 242, 247, 255, 265, 279, 282, 284, 285, 286, 287, 288, 289, 295, 296, 297, 300, 301, 302, 303, 308, 314, 318, 319, 322, 325, 326, 329, 331, 332, 335, 336, 337, 338, 339, 340, 342, 344, 347, 355, 356, 368, 369, 370, 373, 374, 377, 380, 383, 384, 390, 391, 393, 395, 399, 401, 404, 406, 407, 430, 432, 433, 434, 445, 466, 474, 476, 496, 507, 514, 539, 550, 568, 569, 570, 571, 572, 573, 574, 575, 577, 580, 582, 584, 586, 592, 593, 596, 597, 598, 599, 601, 603, 606, 608, 609, 614, 616, 621, 623, 627, 628, 632, 634, 635, 638, 639, 640, 641, 642, 644, 645, 647, 648, 650, 652, 655, 656, 658, 660, 661, 662, 664, 665, 666, 669, 670, 671, 672, 677, 678, 679, 680, 681, 683, 684, 685, 687, 688, 691, 694, 696, 697, 698, 699, 701, 702, 703, 704, 706, 707, 708, 726, 727, 729, 746, 752, 755, 764, 765, 772, 773, 778, 781, 786, 792, 794, 795, 799, 808, 811, 813, 819, 823, 829, 833, 836, 837, 838, 842, 852, 859, 860, 861, 874, 875, 876, 882, 884, 890, 893, 894, 901, 921, 922, 930, 934, 949, 958, 978, 980, 981, 982, 983, 985, 992, 1001, 1013, 1015, 1018, 1025, 1026, 1027, 1070, 1076, 1079, 1084, 1085, 1086, 1088, 1095, 1096, 1101, 1109, 1124, 1125, 1126, 1129, 1147, 1158, 1171, 1172, 1181, 1197, 1199, 1200, 1201, 1202, 1203, 1206, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1219, 1220, 1221, 1222, 1224, 1225, 1226, 1228, 1229, 1230, 1231, 1232, 1235, 1236, 1238, 1239, 1240, 1241, 1242, 1266, 1290, 1293, 1299, 1303, 1312, 1313, 1323, 1324, 1326, 1327, 1331, 1332, 1341, 1352, 1362, 1383, 1405, 1409, 1412, 1417, 1426, 1434, 1435, 1436, 1441, 1453, 1455, 1472, 1480, 1490, 1498, 1500, 1506, 1508, 1532, 1564, 1578, 1619, 1626, 1629, 1633, 1634, 1649, 1655, 1658, 1665, 1666, 1667, 1668, 1669, 1690, 1692, 1704, 1707, 1708, 1710, 1711, 1713, 1714, 1726, 1730, 1731, 1734, 1735, 1736, 1740, 1741, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1783, 1784, 1785, 1787, 1788, 1789, 1790, 1791, 1792, 1794, 1795, 1796, 1797, 1799, 1800, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1812, 1813, 1814, 1817, 1821, 1823, 1824, 1825, 1829, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "i3": [614, 1206, 1704], "i7": 1771, "i_": 1757, "ia": [961, 1213, 1229, 1417, 1704, 1708, 1756, 1763, 1838, 1841], "iajb": 1763, "iat": 1833, "ib": 1756, "ibm": [575, 1206, 1704], "ibo": [1036, 1055, 1056, 1057, 1058, 1059, 1061, 1063, 1218, 1704, 1770], "ibo2": 76, "ic": [1225, 1296, 1704, 1708, 1798], "icc": [1738, 1748], "ichino": [655, 1206, 1704], "icor": [0, 1, 2, 787, 884, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "icosohedr": 1757, "icpc": [1738, 1748], "icpx": 1738, "id": [86, 115, 150, 265, 1740, 1750, 1767, 1786, 1788, 1794, 1822, 1833], "idea": [1738, 1748, 1755, 1757, 1767, 1781, 1797, 1824], "ideal": [386, 1706, 1786, 1838], "idempot": [84, 106, 213, 1753, 1838], "ident": [100, 106, 591, 609, 649, 663, 811, 1093, 1206, 1210, 1219, 1704, 1711, 1714, 1733, 1752, 1755, 1756, 1757, 1759, 1770, 1771, 1785, 1797, 1809, 1838, 1842, 1844], "identif": [1756, 1808], "identifi": [2, 98, 115, 367, 1743, 1750, 1833, 1838], "idfmo": 30, "ie": [87, 1714, 1743, 1750, 1776, 1782, 1794, 1842], "iec": 1832, "iefpcm": 1803, "ifdef": 1785, "ifort": [1738, 1748], "ignacio": 1734, "ignor": [61, 342, 446, 484, 539, 702, 772, 773, 778, 781, 795, 1199, 1200, 1203, 1206, 1209, 1210, 1226, 1327, 1362, 1704, 1742, 1750, 1754, 1757, 1785, 1788, 1814, 1819, 1828, 1833], "iho": [1037, 1047, 1218, 1704, 1770], "ii": [794, 795, 859, 890, 1210, 1229, 1417, 1704, 1711, 1714, 1755, 1757, 1763, 1771, 1778, 1786, 1805, 1810, 1838, 1842], "iii": [532, 555, 782, 785, 789, 790, 796, 797, 859, 875, 877, 878, 1202, 1203, 1210, 1704, 1734, 1755, 1778, 1781, 1782, 1786, 1810], "iint_": [1757, 1838], "iirc": 1788, "ij": [377, 433, 466, 507, 514, 641, 1199, 1200, 1201, 1202, 1206, 1225, 1242, 1704, 1708, 1742, 1755, 1756, 1759, 1763, 1771, 1829, 1838], "ij_canon": [665, 1206, 1704], "ijk": 1755, "ijkl": [574, 1206, 1704], "ijqc": [1714, 1810, 1842], "ik": [1763, 1771], "ill": [1230, 1480, 1704, 1837], "illustr": [671, 1206, 1704, 1714, 1743, 1770, 1789, 1838, 1841, 1842], "im": 377, "imag": [87, 106, 386, 1738, 1750, 1761, 1764, 1770, 1772, 1785, 1787], "imageh": 1750, "imagemagick": 1750, "images": 1750, "imagew": 1750, "imagin": 1770, "imaginari": [385, 386, 388, 987, 1215, 1704, 1746, 1772], "imit": [1738, 1743, 1785], "immateri": 1748, "immedi": [1738, 1759, 1774, 1776, 1786, 1801], "immin": 1786, "imo": 30, "impact": [284, 1740, 1761], "imped": 1706, "implement": [0, 2, 268, 284, 329, 351, 356, 368, 369, 370, 381, 382, 430, 568, 574, 576, 603, 641, 676, 690, 692, 697, 1199, 1206, 1226, 1231, 1352, 1626, 1692, 1704, 1714, 1718, 1730, 1734, 1740, 1742, 1743, 1750, 1752, 1754, 1756, 1757, 1763, 1768, 1770, 1771, 1774, 1775, 1776, 1777, 1780, 1781, 1789, 1790, 1798, 1805, 1806, 1810, 1817, 1821, 1824, 1826, 1836, 1837, 1838, 1839, 1840, 1841, 1842], "impli": [1738, 1743, 1770, 1781, 1782, 1794, 1829, 1837, 1838], "implicit": [1738, 1743, 1757, 1781, 1803], "implicitli": [592, 1206, 1704, 1757, 1770], "implict": 1754, "import": [0, 2, 213, 272, 358, 380, 452, 487, 525, 549, 573, 609, 681, 802, 868, 869, 1199, 1200, 1202, 1203, 1206, 1210, 1230, 1445, 1704, 1714, 1730, 1738, 1742, 1747, 1750, 1752, 1753, 1754, 1755, 1757, 1759, 1767, 1768, 1785, 1787, 1788, 1790, 1797, 1801, 1808, 1812, 1817, 1824, 1828, 1832, 1834, 1836, 1837, 1838, 1841, 1842, 1843, 1844], "importantli": 1828, "importerror": 1828, "impos": [106, 1743, 1753, 1777, 1814, 1837], "imposs": [1799, 1821], "improperli": 170, "improv": [430, 470, 738, 1199, 1200, 1208, 1704, 1734, 1742, 1755, 1768, 1781, 1785, 1802, 1806, 1810, 1817, 1821, 1824, 1837, 1838], "inabl": 1757, "inaccur": 1757, "inact": [106, 150, 314, 1172, 1222, 1704, 1743, 1789, 1791, 1794, 1802], "inc": 352, "incept": 1757, "incfock": [0, 1, 2, 1568, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "incfock_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "incfock_full_fock_everi": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "incid": [550, 1203, 1704, 1742], "inclin": [697, 1206, 1704], "includ": [2, 106, 150, 159, 284, 285, 287, 295, 297, 314, 318, 319, 336, 338, 347, 367, 378, 388, 470, 476, 616, 636, 665, 667, 677, 699, 745, 795, 833, 978, 979, 980, 982, 983, 1012, 1014, 1016, 1017, 1019, 1020, 1112, 1126, 1200, 1206, 1208, 1210, 1214, 1216, 1221, 1224, 1229, 1231, 1235, 1403, 1404, 1406, 1413, 1420, 1658, 1673, 1704, 1730, 1733, 1735, 1738, 1740, 1742, 1743, 1746, 1748, 1750, 1752, 1753, 1755, 1756, 1757, 1762, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1773, 1775, 1776, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1794, 1800, 1802, 1803, 1808, 1809, 1810, 1817, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1841], "include_deprecated_kei": [150, 263], "include_perturb": 103, "include_pure_transform": 103, "inclus": [601, 662, 699, 1206, 1231, 1658, 1704, 1742, 1749, 1802, 1803, 1805, 1841], "incompat": [1231, 1626, 1634, 1704], "incomplet": [1786, 1837], "inconsist": [150, 1770], "inconveni": 1767, "incor": [961, 1213, 1231, 1620, 1626, 1704, 1838], "incorpor": [284, 1730, 1733, 1740, 1757, 1759, 1767, 1776, 1798, 1819], "incorrect": [314, 1757, 1791, 1838], "incorrectli": 1797, "increas": [0, 699, 1206, 1226, 1341, 1704, 1750, 1753, 1754, 1756, 1757, 1763, 1796, 1802, 1817, 1828, 1838, 1844], "incredibli": 1781, "increment": [18, 66, 100, 1231, 1555, 1566, 1567, 1568, 1704, 1714, 1768, 1788, 1802, 1838, 1842], "incur": [1743, 1757, 1770, 1817], "ind": [76, 1029, 1218, 1230, 1442, 1678, 1679, 1689, 1704, 1714, 1776, 1837, 1842], "ind20": [1679, 1689, 1776, 1837], "ind22": [1689, 1776, 1837], "ind30": [1689, 1714, 1776, 1837, 1842], "indab": 1770, "indba": 1770, "indc": [1714, 1842], "inde": [2, 1755, 1841], "indent": [1757, 1833, 1844], "indep": 1738, "independ": [106, 168, 170, 329, 370, 539, 721, 1203, 1207, 1704, 1714, 1738, 1742, 1753, 1757, 1759, 1768, 1770, 1774, 1785, 1788, 1795, 1802, 1808, 1824, 1838, 1840, 1842], "index": [3, 5, 11, 13, 15, 17, 75, 81, 84, 91, 95, 98, 106, 134, 140, 183, 184, 368, 369, 384, 430, 433, 466, 507, 514, 603, 635, 641, 652, 902, 954, 1096, 1199, 1200, 1201, 1202, 1206, 1212, 1213, 1219, 1225, 1230, 1242, 1455, 1481, 1704, 1708, 1726, 1738, 1742, 1750, 1752, 1753, 1756, 1763, 1764, 1768, 1771, 1775, 1776, 1777, 1786, 1788, 1794, 1795, 1802, 1810, 1832, 1837, 1838, 1844], "indic": [0, 8, 21, 106, 284, 295, 300, 301, 302, 318, 319, 335, 381, 382, 384, 433, 466, 507, 514, 627, 793, 795, 829, 1108, 1111, 1199, 1200, 1201, 1202, 1206, 1210, 1221, 1225, 1231, 1242, 1559, 1562, 1579, 1581, 1685, 1704, 1730, 1733, 1740, 1742, 1743, 1746, 1750, 1752, 1753, 1766, 1767, 1770, 1771, 1772, 1775, 1776, 1777, 1785, 1792, 1794, 1799, 1800, 1802, 1806, 1817, 1826, 1828, 1834, 1837, 1844], "indigo": [575, 1206, 1704], "indinavir": [1692, 1752], "indirect": [614, 669, 690, 1206, 1704], "indirectli": [1226, 1341, 1704], "individu": [2, 329, 601, 683, 1206, 1704, 1714, 1740, 1750, 1752, 1759, 1767, 1770, 1788, 1794, 1810, 1817, 1824, 1832, 1837, 1838, 1842, 1844], "induc": [1228, 1385, 1387, 1389, 1391, 1704, 1749], "induced_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "induct": [76, 103, 1045, 1218, 1230, 1441, 1449, 1450, 1465, 1466, 1704, 1714, 1734, 1770, 1776, 1781, 1837, 1842], "induction_oper": 103, "industri": 1757, "ineffect": [1743, 1832], "ineffici": [837, 1210, 1704, 1738, 1739, 1755, 1781], "inequ": 1838, "inerti": 1743, "inertia_tensor": 106, "inevit": [1802, 1824], "inf": [1679, 1689, 1714, 1776, 1842], "infer": [1755, 1838], "inferior": [284, 1740], "infil": 1788, "infiles_with_cont": 1788, "infin": 1837, "infinit": [377, 1843], "influenc": [106, 284, 1232, 1666, 1692, 1704, 1740, 1752, 1754, 1759, 1767, 1774, 1843], "info": [8, 106, 318, 319, 327, 342, 356, 370, 374, 395, 844, 1210, 1704, 1708, 1714, 1738, 1748, 1759, 1767, 1768, 1772, 1774, 1785, 1786, 1788, 1800, 1808, 1810, 1842], "inform": [1, 2, 8, 74, 81, 100, 104, 105, 106, 115, 120, 138, 148, 150, 262, 263, 296, 303, 310, 314, 331, 350, 351, 361, 370, 371, 394, 399, 498, 569, 593, 644, 667, 716, 720, 838, 1021, 1118, 1153, 1200, 1206, 1207, 1210, 1216, 1221, 1230, 1231, 1463, 1608, 1692, 1704, 1730, 1738, 1742, 1743, 1750, 1752, 1755, 1757, 1759, 1764, 1767, 1769, 1772, 1775, 1781, 1786, 1791, 1797, 1801, 1802, 1804, 1808, 1809, 1810, 1817, 1821, 1828, 1833, 1837, 1838, 1841, 1843, 1844], "infrar": [386, 707, 1206, 1704], "infrastructur": [1714, 1726, 1737, 1823, 1841, 1842], "infrequ": 1764, "infti": [1042, 1218, 1704, 1740, 1757, 1837], "ing": [1735, 1738], "inherit": [150, 329, 1768], "inherit_loglevel": 1768, "inhomegen": 322, "inhomogen": 1757, "ini": 2, "init": [64, 84, 88, 148, 1808, 1810], "init_arrai": 1810, "init_io_fil": 12, "init_with_xyz": 1833, "initi": [27, 64, 68, 84, 90, 92, 106, 138, 147, 267, 308, 328, 342, 356, 457, 471, 589, 635, 638, 648, 652, 660, 706, 834, 851, 870, 1199, 1200, 1206, 1210, 1226, 1231, 1323, 1343, 1361, 1494, 1496, 1563, 1615, 1616, 1617, 1704, 1714, 1737, 1738, 1742, 1748, 1752, 1753, 1759, 1763, 1776, 1781, 1787, 1790, 1794, 1798, 1802, 1808, 1817, 1819, 1821, 1828, 1832, 1833, 1837, 1841, 1842, 1844], "initialize_gtfock_jk": 84, "initialize_jk": 84, "initialized_diis_manager_": 84, "initio": [1, 1734, 1753, 1756, 1777, 1781, 1786, 1790, 1838], "inlin": [2, 1764], "innard": [1824, 1827], "inner": [625, 1206, 1704, 1794], "innermost": 1838, "inop": [444, 482, 1199, 1200, 1704], "inplac": [1738, 1767], "inpsight": 1827, "input": [0, 26, 70, 92, 106, 150, 216, 265, 280, 285, 286, 287, 295, 318, 319, 336, 337, 338, 350, 351, 359, 375, 376, 378, 380, 383, 384, 390, 396, 397, 400, 474, 570, 577, 592, 609, 614, 621, 642, 643, 650, 651, 660, 669, 671, 696, 705, 823, 897, 1000, 1043, 1046, 1052, 1109, 1125, 1126, 1130, 1200, 1206, 1210, 1211, 1215, 1218, 1221, 1227, 1230, 1377, 1472, 1704, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1735, 1738, 1740, 1742, 1743, 1746, 1749, 1750, 1752, 1754, 1759, 1761, 1763, 1764, 1766, 1767, 1768, 1770, 1771, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1785, 1788, 1789, 1790, 1792, 1794, 1798, 1799, 1800, 1801, 1802, 1803, 1808, 1810, 1824, 1829, 1831, 1833, 1834, 1836, 1837, 1840], "input_str": 330, "input_units_to_au": [106, 1768], "inputdat": 1788, "inputdatloc": 1788, "inputpars": 1768, "inputv": [374, 395], "inquiri": 1781, "insensit": [150, 151, 174, 175, 176, 207, 211, 212, 238, 244, 254, 255, 262, 367, 374, 376, 377, 395, 397, 1743, 1752, 1795, 1796, 1810, 1828], "insert": [5, 106, 111, 1753, 1767, 1786, 1801, 1828, 1833], "insid": [0, 106, 760, 768, 1209, 1704, 1754, 1756, 1770, 1781, 1828], "insight": [1763, 1770, 1828, 1844], "insist": 2, "inspect": [1743, 1788, 1802], "instabl": [681, 1206, 1231, 1638, 1639, 1640, 1641, 1642, 1649, 1704, 1734, 1757, 1798, 1838], "instal": [2, 561, 1204, 1704, 1714, 1715, 1730, 1747, 1750, 1757, 1777, 1780, 1781, 1785, 1788, 1808, 1814, 1828, 1838, 1842, 1844], "installationtyp": 1748, "instanc": [8, 18, 64, 68, 87, 100, 106, 147, 148, 150, 267, 350, 378, 1714, 1743, 1759, 1764, 1767, 1779, 1810, 1828, 1832, 1833, 1838, 1842], "instanti": [106, 1774, 1794], "instead": [2, 100, 106, 150, 192, 193, 203, 204, 274, 300, 301, 302, 318, 319, 375, 396, 577, 611, 632, 633, 634, 652, 656, 672, 691, 946, 994, 1206, 1213, 1215, 1225, 1226, 1231, 1254, 1255, 1281, 1296, 1300, 1337, 1549, 1588, 1610, 1695, 1697, 1700, 1701, 1702, 1704, 1711, 1737, 1738, 1742, 1743, 1746, 1748, 1752, 1755, 1757, 1758, 1759, 1761, 1762, 1763, 1764, 1765, 1768, 1769, 1772, 1773, 1775, 1779, 1781, 1782, 1783, 1784, 1786, 1794, 1798, 1800, 1801, 1802, 1803, 1810, 1817, 1828, 1837, 1838, 1839, 1843, 1844], "instruct": [111, 1002, 1005, 1006, 1007, 1008, 1009, 1215, 1704, 1730, 1737, 1738, 1743, 1746, 1749, 1752, 1759, 1762, 1765, 1767, 1773, 1774, 1775, 1782, 1783, 1784, 1785, 1788, 1792, 1801, 1803, 1806, 1807, 1813, 1817, 1820, 1828, 1829, 1833, 1837, 1839, 1840, 1844], "insuffici": [2, 1714, 1753, 1757, 1837, 1842], "insul": 1757, "int": [2, 5, 7, 8, 9, 11, 12, 13, 14, 15, 16, 17, 18, 20, 21, 22, 23, 24, 25, 26, 27, 29, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 64, 75, 80, 81, 84, 85, 86, 87, 88, 89, 90, 91, 92, 96, 98, 100, 103, 105, 106, 110, 111, 112, 114, 115, 119, 120, 128, 130, 131, 133, 138, 139, 141, 143, 144, 145, 147, 148, 150, 154, 155, 156, 157, 158, 183, 184, 187, 198, 199, 225, 246, 248, 250, 251, 266, 270, 276, 277, 282, 285, 287, 288, 289, 299, 300, 301, 302, 305, 309, 310, 313, 321, 329, 332, 335, 336, 338, 339, 340, 342, 346, 349, 353, 354, 356, 360, 361, 364, 374, 376, 377, 380, 383, 384, 386, 389, 390, 395, 397, 399, 1224, 1237, 1704, 1708, 1734, 1740, 1759, 1763, 1767, 1768, 1772, 1774, 1785, 1794, 1801, 1810, 1821, 1832, 1837], "int_": 1757, "int_0": 1837, "int_ptr": 1817, "intco": 1708, "intcos_generate_exit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "intdump": [187, 294, 297, 345, 347], "integ": [0, 1, 2, 64, 88, 114, 246, 248, 268, 374, 389, 395, 404, 405, 406, 407, 412, 413, 419, 420, 431, 433, 435, 447, 452, 466, 469, 476, 485, 487, 489, 490, 502, 504, 505, 507, 514, 524, 525, 527, 528, 537, 548, 549, 558, 564, 569, 572, 578, 580, 582, 583, 585, 587, 588, 591, 593, 594, 595, 603, 606, 607, 611, 612, 614, 618, 620, 622, 632, 633, 634, 644, 645, 646, 649, 651, 654, 659, 660, 661, 663, 667, 681, 684, 685, 686, 687, 689, 690, 700, 704, 709, 710, 711, 712, 716, 720, 723, 724, 728, 734, 735, 741, 751, 755, 756, 757, 760, 763, 764, 766, 768, 770, 775, 776, 782, 785, 789, 790, 791, 793, 796, 797, 798, 800, 804, 805, 806, 808, 813, 814, 815, 816, 820, 826, 828, 832, 833, 834, 837, 840, 842, 846, 847, 848, 853, 862, 868, 869, 870, 871, 877, 878, 879, 881, 890, 894, 895, 896, 901, 906, 911, 912, 914, 918, 927, 931, 932, 950, 966, 969, 970, 974, 992, 993, 997, 1003, 1021, 1028, 1031, 1056, 1060, 1062, 1066, 1077, 1080, 1097, 1104, 1114, 1118, 1122, 1126, 1134, 1136, 1138, 1139, 1141, 1143, 1144, 1148, 1149, 1153, 1176, 1180, 1181, 1185, 1189, 1190, 1191, 1193, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1224, 1225, 1226, 1228, 1229, 1230, 1231, 1232, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1249, 1250, 1251, 1263, 1267, 1286, 1302, 1305, 1323, 1325, 1333, 1347, 1363, 1379, 1380, 1391, 1395, 1397, 1400, 1401, 1408, 1409, 1412, 1416, 1425, 1426, 1439, 1456, 1457, 1458, 1463, 1477, 1490, 1493, 1494, 1495, 1496, 1508, 1515, 1517, 1533, 1536, 1542, 1544, 1547, 1548, 1550, 1561, 1568, 1574, 1575, 1576, 1577, 1580, 1590, 1592, 1597, 1607, 1608, 1625, 1632, 1635, 1636, 1639, 1640, 1641, 1645, 1646, 1652, 1653, 1655, 1659, 1661, 1666, 1704, 1714, 1740, 1742, 1743, 1746, 1749, 1750, 1754, 1755, 1757, 1762, 1771, 1775, 1776, 1789, 1794, 1795, 1798, 1801, 1802, 1810, 1817, 1828, 1833, 1835, 1837, 1838, 1841, 1842, 1843, 1844], "integerword": [650, 1206, 1704], "integr": [1, 2, 4, 13, 65, 69, 71, 72, 76, 84, 89, 90, 93, 94, 98, 103, 107, 109, 110, 112, 115, 116, 121, 127, 141, 142, 143, 144, 150, 158, 166, 187, 286, 294, 295, 297, 298, 310, 329, 337, 345, 347, 348, 361, 430, 433, 466, 507, 514, 559, 568, 575, 590, 623, 637, 641, 643, 657, 660, 668, 682, 693, 708, 710, 727, 775, 776, 838, 858, 901, 927, 954, 961, 1096, 1129, 1167, 1199, 1200, 1201, 1202, 1204, 1206, 1208, 1209, 1210, 1212, 1213, 1219, 1221, 1223, 1225, 1230, 1231, 1242, 1436, 1455, 1459, 1461, 1464, 1465, 1466, 1476, 1477, 1481, 1489, 1508, 1510, 1542, 1543, 1544, 1590, 1597, 1626, 1627, 1629, 1634, 1659, 1704, 1708, 1714, 1727, 1734, 1736, 1739, 1742, 1743, 1747, 1753, 1756, 1757, 1763, 1765, 1766, 1767, 1771, 1776, 1777, 1780, 1783, 1787, 1789, 1790, 1798, 1808, 1809, 1814, 1818, 1819, 1832, 1836, 1837, 1839, 1841, 1842], "integral_cutoff": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "integral_packag": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "integralfactori": [103, 115, 1817, 1827], "integrals_erf": 103, "integrals_erfc": 103, "integraltransform": 1827, "integratorxx": [186, 1738], "intel": [1737, 1738, 1748, 1767, 1771, 1781, 1788, 1839], "intel64": 1738, "intend": [300, 301, 302, 318, 319, 329, 586, 1206, 1704, 1714, 1738, 1743, 1752, 1763, 1772, 1774, 1800, 1801, 1834, 1835, 1842], "intens": [386, 574, 673, 674, 679, 707, 1206, 1704, 1753, 1785, 1840, 1841], "intent": [1743, 1801], "intention": 329, "inter": [76, 147, 763, 1209, 1704, 1754], "interact": [73, 76, 177, 295, 381, 382, 574, 662, 764, 981, 985, 1048, 1206, 1209, 1210, 1214, 1218, 1230, 1673, 1689, 1692, 1704, 1714, 1730, 1733, 1734, 1742, 1743, 1746, 1750, 1752, 1754, 1757, 1759, 1761, 1763, 1766, 1770, 1776, 1777, 1778, 1779, 1782, 1786, 1790, 1794, 1798, 1801, 1802, 1805, 1806, 1809, 1826, 1829, 1831, 1832, 1833, 1835, 1836, 1837, 1838, 1842], "interatom": [106, 1226, 1303, 1341, 1704, 1759, 1776, 1802, 1828, 1844], "intercal": [300, 301, 302, 318, 319, 1714, 1752, 1772, 1777, 1781, 1796, 1800, 1831, 1840, 1842], "intercept": 2, "interchang": [106, 1738, 1755, 1759], "interconvers": [1714, 1842], "interest": [644, 1206, 1704, 1738, 1755, 1757, 1759, 1767, 1770, 1774, 1785, 1799, 1801, 1817, 1828, 1829, 1832, 1835, 1841, 1844], "interf": 1782, "interfac": [2, 106, 181, 284, 312, 577, 581, 586, 587, 592, 599, 601, 609, 611, 632, 633, 634, 650, 651, 652, 654, 656, 660, 676, 684, 685, 689, 691, 705, 1157, 1206, 1221, 1224, 1231, 1497, 1498, 1577, 1599, 1683, 1704, 1714, 1738, 1740, 1742, 1755, 1757, 1766, 1767, 1768, 1777, 1785, 1786, 1788, 1790, 1794, 1795, 1800, 1804, 1810, 1817, 1819, 1836, 1838, 1842], "interface_cfour": 1743, "interfacelib": 1738, "interfer": [1748, 1767, 1786], "interfrag": [1226, 1313, 1314, 1316, 1337, 1338, 1339, 1340, 1704, 1770, 1802], "interfrag_collinear_tol": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "interfrag_coord": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "interfrag_dist_inv": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "interfrag_hess": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "interfrag_mod": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "interfrag_step_limit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "interfrag_tight": [1226, 1324, 1704, 1802], "interfragment_connect": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "interior": [1230, 1483, 1704, 1837], "intermedi": [0, 75, 106, 400, 433, 463, 466, 503, 507, 514, 1199, 1200, 1201, 1202, 1225, 1230, 1231, 1242, 1463, 1489, 1627, 1704, 1714, 1730, 1733, 1742, 1755, 1767, 1771, 1777, 1781, 1794, 1837, 1838, 1842], "intermediari": [996, 1215, 1704, 1746], "intermediates_energi": 1794, "intermediates_gradi": 1794, "intermediates_hessian": 1794, "intermitt": 1786, "intermolecular": [1770, 1778, 1781, 1802, 1806, 1833, 1837], "intern": [14, 62, 84, 106, 128, 130, 138, 145, 147, 150, 267, 284, 314, 416, 592, 596, 632, 637, 656, 668, 683, 743, 1070, 1076, 1088, 1150, 1170, 1183, 1198, 1208, 1219, 1221, 1222, 1225, 1229, 1231, 1293, 1306, 1334, 1343, 1349, 1351, 1352, 1364, 1365, 1367, 1434, 1620, 1704, 1708, 1714, 1730, 1735, 1738, 1740, 1742, 1743, 1746, 1759, 1762, 1765, 1767, 1771, 1772, 1773, 1775, 1779, 1782, 1783, 1784, 1785, 1791, 1802, 1803, 1809, 1810, 1817, 1828, 1833, 1838, 1839, 1842, 1844], "internal_rot": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "internet": 1833, "interoper": [1769, 1781], "interp": 1738, "interpol": [1231, 1616, 1617, 1704, 1759], "interpret": [374, 395, 1738, 1743, 1767, 1776, 1786, 1788, 1790, 1794, 1799, 1824, 1828, 1831, 1832, 1833, 1835, 1838, 1844], "interprocedur": 1746, "interrupt": 1738, "interstrand": [1692, 1752], "interti": 106, "interv": 106, "interven": [1714, 1842], "intra": 1763, "intract": 1763, "intrafrag": [1226, 1342, 1704, 1802], "intrafrag_hess": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "intrafrag_step_limit": [0, 1, 2, 634, 1206, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "intrafrag_step_limit_max": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "intrafrag_step_limit_min": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "intramolecular": [106, 295, 1230, 1442, 1704, 1714, 1766, 1768, 1777, 1781, 1790, 1828, 1837, 1842, 1844], "intramonom": 1781, "intric": 1743, "intrins": [1770, 1802], "introduc": [1730, 1743, 1753, 1757, 1759, 1781, 1790, 1797, 1817, 1821, 1828, 1836, 1837, 1838, 1844], "introduct": [0, 1734, 1743, 1754, 1755, 1757, 1770, 1777, 1788, 1790, 1802, 1831], "ints_toler": [0, 1, 2, 187, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "intuit": 1833, "intvector": [36, 37, 38, 54, 78, 1827], "invari": [702, 1206, 1704, 1734, 1798, 1817, 1841], "invers": [100, 139, 811, 1055, 1210, 1218, 1704, 1706, 1754, 1755, 1776, 1810, 1838], "inverse_fine_structure_const": 1706, "inverse_meter_atomic_mass_unit_relationship": 1706, "inverse_meter_electron_volt_relationship": 1706, "inverse_meter_hartree_relationship": 1706, "inverse_meter_hertz_relationship": 1706, "inverse_meter_joule_relationship": 1706, "inverse_meter_kelvin_relationship": 1706, "inverse_meter_kilogram_relationship": 1706, "inverse_of_conductance_quantum": 1706, "invert": [100, 106, 874, 1210, 1704, 1838], "investig": [0, 1757, 1781, 1833], "invok": [570, 669, 677, 823, 1206, 1210, 1704, 1736, 1742, 1743, 1755, 1767, 1770, 1771, 1777, 1781, 1782, 1791, 1792, 1796, 1828, 1832, 1837, 1838, 1844], "involv": [342, 356, 568, 575, 608, 610, 657, 671, 792, 860, 1206, 1210, 1230, 1445, 1704, 1714, 1735, 1738, 1743, 1746, 1753, 1757, 1767, 1770, 1782, 1786, 1805, 1810, 1828, 1834, 1837, 1838, 1842, 1844], "io": [90, 100, 148, 900, 993, 1212, 1215, 1231, 1507, 1704, 1738, 1746, 1748, 1788, 1827, 1837, 1838], "iomanag": 1827, "iomp5": 1738, "ion": [1714, 1754, 1842], "ionari": 1757, "ioniz": [608, 613, 896, 925, 1206, 1211, 1213, 1225, 1262, 1264, 1704, 1757, 1781, 1805, 1837], "iota": 88, "ip": [1714, 1777, 1780, 1790, 1837, 1842], "ip_fit": [1757, 1768, 1777], "ip_pol": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ipea": [988, 1215, 1704, 1746], "ipi": [308, 1738, 1768], "ipi_brok": 1768, "ipibrok": [308, 1768, 1777], "ir": [1707, 1731], "ir_intens": 386, "irc": [1226, 1346, 1347, 1348, 1354, 1704, 1714, 1802, 1842], "irc_direct": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "irc_point": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "irc_step_s": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "iroot": 13, "irreconcil": 1786, "irreduc": [0, 91, 106, 386, 422, 495, 531, 569, 593, 609, 616, 660, 1125, 1198, 1200, 1202, 1206, 1221, 1704, 1742, 1771, 1772, 1797, 1837, 1838], "irreduciblerepresent": [17, 1827], "irrelev": 1808, "irrep": [1, 2, 11, 13, 15, 16, 17, 20, 64, 88, 91, 100, 115, 148, 150, 259, 277, 300, 301, 302, 331, 386, 399, 410, 419, 489, 490, 495, 527, 837, 855, 881, 887, 897, 993, 1065, 1102, 1123, 1127, 1128, 1159, 1160, 1161, 1162, 1164, 1165, 1168, 1177, 1189, 1192, 1197, 1198, 1200, 1202, 1210, 1211, 1215, 1219, 1221, 1222, 1229, 1231, 1433, 1641, 1642, 1655, 1704, 1714, 1742, 1743, 1746, 1750, 1755, 1772, 1776, 1780, 1789, 1795, 1801, 1810, 1828, 1829, 1838, 1841, 1842, 1844], "irrep_data": [100, 148, 331, 1797], "irrep_index": 15, "irrep_label": [106, 386], "irreped_mat": 1797, "irrepord": 1801, "irrespect": 1748, "is_c_hybrid": 138, "is_c_lrc": 138, "is_c_scs_hybrid": 138, "is_cartesian": 81, "is_don": 3, "is_gga": [80, 138], "is_invert": 78, "is_libxc_func": 138, "is_lrc": 80, "is_meta": [80, 138], "is_poisson": 78, "is_pur": 81, "is_vari": 106, "is_x_hybrid": 138, "is_x_lrc": 138, "isapt": [1049, 1218, 1704, 1714, 1842], "isapt1": [2, 1714, 1770, 1842], "isapt2": [1714, 1842], "isbn": 1734, "isclos": 2, "isfil": 1788, "ish": [1767, 1838], "isn": [2, 279, 1230, 1455, 1480, 1704, 1759, 1785, 1788, 1837], "iso": [103, 1750], "isocontour": [1110, 1221, 1704, 1750], "isol": 1801, "isosurfac": 1750, "isotop": [106, 1232, 1666, 1704, 1832, 1843], "isotope1": [1714, 1842], "isotope2": [1714, 1833, 1842, 1843], "isotopolog": [574, 1206, 1704, 1714, 1842], "isotopologu": 1833, "isotrop": [1228, 1390, 1704, 1749], "isotropic_pol": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "isovalu": 1750, "issu": [0, 247, 657, 1206, 1231, 1508, 1629, 1704, 1737, 1738, 1743, 1746, 1757, 1759, 1767, 1770, 1781, 1787, 1788, 1802, 1803, 1814, 1816, 1817, 1828, 1837, 1838, 1844], "istop": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "isym": [2, 286, 298, 337, 348], "item": [5, 106, 284, 327, 434, 1199, 1704, 1738, 1740, 1742, 1786, 1788, 1794, 1801, 1809, 1821], "iter": [0, 1, 5, 18, 64, 84, 89, 100, 266, 270, 276, 277, 295, 328, 329, 330, 335, 342, 344, 356, 357, 405, 431, 440, 447, 457, 485, 496, 498, 524, 530, 548, 583, 585, 594, 605, 606, 609, 645, 646, 665, 685, 687, 689, 700, 723, 729, 741, 744, 759, 760, 768, 805, 808, 811, 813, 816, 833, 835, 837, 839, 840, 848, 853, 870, 874, 883, 893, 894, 914, 932, 946, 950, 966, 971, 972, 974, 976, 1003, 1060, 1062, 1066, 1080, 1141, 1180, 1185, 1197, 1199, 1200, 1202, 1203, 1206, 1207, 1208, 1209, 1210, 1211, 1213, 1214, 1215, 1218, 1219, 1221, 1222, 1225, 1228, 1229, 1230, 1231, 1243, 1263, 1267, 1281, 1286, 1391, 1405, 1416, 1426, 1430, 1439, 1457, 1490, 1499, 1550, 1561, 1568, 1577, 1580, 1607, 1639, 1648, 1652, 1668, 1669, 1680, 1682, 1690, 1704, 1734, 1735, 1742, 1746, 1749, 1755, 1757, 1763, 1766, 1768, 1770, 1771, 1776, 1780, 1785, 1788, 1789, 1790, 1792, 1793, 1798, 1802, 1817, 1824, 1828, 1832, 1837, 1838, 1841, 1844], "iter_inv": [874, 1210, 1704], "iteration_": 84, "iteration_energi": 84, "ith": 81, "its": [0, 2, 8, 11, 100, 106, 284, 322, 325, 329, 399, 419, 489, 527, 656, 666, 698, 827, 1070, 1076, 1088, 1096, 1198, 1200, 1202, 1206, 1210, 1219, 1225, 1296, 1704, 1714, 1730, 1738, 1740, 1743, 1746, 1748, 1749, 1752, 1753, 1755, 1756, 1757, 1759, 1762, 1765, 1767, 1771, 1773, 1774, 1775, 1776, 1781, 1782, 1783, 1784, 1785, 1786, 1794, 1795, 1798, 1801, 1803, 1806, 1807, 1810, 1817, 1823, 1828, 1832, 1837, 1838, 1839, 1841, 1842], "itself": [2, 267, 370, 1714, 1737, 1738, 1748, 1750, 1754, 1759, 1768, 1781, 1785, 1788, 1801, 1808, 1810, 1829, 1833, 1837, 1838, 1842], "iupac": [390, 1232, 1665, 1667, 1704, 1833, 1843], "iv": [792, 794, 795, 796, 798, 860, 875, 877, 879, 1210, 1704, 1778, 1810], "iwth": 73, "ixyz2databas": [1752, 1835], "iz": 1734, "izsak": [1734, 1838], "j": [11, 76, 84, 92, 100, 303, 356, 377, 443, 444, 479, 482, 519, 521, 543, 545, 669, 885, 981, 985, 1199, 1200, 1202, 1203, 1206, 1210, 1214, 1225, 1230, 1256, 1469, 1692, 1704, 1706, 1708, 1714, 1715, 1730, 1734, 1738, 1742, 1748, 1752, 1755, 1756, 1757, 1759, 1762, 1763, 1767, 1771, 1776, 1777, 1780, 1781, 1783, 1786, 1792, 1810, 1837, 1838, 1842], "j_": 1757, "j_alg": 1838, "j_fc": [669, 1206, 1704], "j_sd": [669, 1206, 1704], "j_so": [669, 1206, 1704], "ja": 1756, "ja00480a005": 1734, "jacobi": [0, 725, 746, 1207, 1208, 1704, 1753], "jadz": 1733, "jaeger": 1734, "jaindx": [680, 1206, 1704], "jame": [1734, 1781, 1786, 1841], "jansen": [1734, 1781, 1837], "janssen": 1781, "januari": [1787, 1837], "jaqz": 1733, "jatz": 1733, "jb": [1708, 1756, 1763], "jcc": [1734, 1781], "jcp": [1225, 1229, 1271, 1427, 1692, 1704, 1714, 1740, 1752, 1842], "jctc": [295, 318, 319, 1692, 1695, 1698, 1700, 1702, 1703, 1734, 1752, 1758, 1766, 1781, 1800], "jeff": 1841, "jensen": [1707, 1730, 1731, 1734, 1755], "jerom": [1786, 1838], "jet": 1810, "jeziorski": [1734, 1781, 1828, 1829, 1837, 1844], "jfit": [1707, 1731], "jha": [1734, 1777, 1780], "ji": 1838, "jinja": 1788, "jitter": 387, "jj": [1757, 1763, 1838], "jk": [18, 66, 84, 102, 714, 1207, 1231, 1613, 1618, 1694, 1704, 1706, 1714, 1726, 1732, 1771, 1827, 1841, 1842], "jk_type": 92, "jkfit": [8, 92, 295, 376, 397, 810, 1210, 1230, 1231, 1445, 1502, 1694, 1704, 1707, 1714, 1730, 1731, 1732, 1733, 1756, 1757, 1766, 1770, 1771, 1828, 1837, 1838, 1842, 1844], "job": [2, 168, 284, 378, 516, 570, 656, 1088, 1202, 1206, 1219, 1225, 1270, 1704, 1738, 1740, 1743, 1752, 1757, 1759, 1771, 1772, 1774, 1777, 1785, 1795, 1802, 1833, 1837, 1840], "jobarc": [638, 680, 1206, 1704], "jobnam": 1767, "jobtyp": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "joda": [614, 1206, 1704], "joda_print": [644, 1206, 1704], "john": [1734, 1743], "johndo": [1737, 1786], "johnson": [1759, 1837], "join": 1743, "jone": 1757, "jong": 1734, "jorg": 1734, "jorgensen": [1740, 1755], "josephson": 1706, "josephson_const": 1706, "joul": 1706, "joule_atomic_mass_unit_relationship": 1706, "joule_electron_volt_relationship": 1706, "joule_hartree_relationship": 1706, "joule_hertz_relationship": 1706, "joule_inverse_meter_relationship": 1706, "joule_kelvin_relationship": 1706, "joule_kilogram_relationship": 1706, "journei": 1835, "jp045141": [1692, 1752], "jp066479k": [295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "jpca": [1692, 1734, 1752], "jpclett": [295, 318, 319, 1695, 1698, 1702, 1703, 1758, 1766, 1800], "jpeg": 1788, "jpg": 1788, "jroot": 13, "jsch": 1832, "json": [265, 367, 400, 1740, 1767, 1768, 1772, 1788, 1794, 1802, 1842], "json_data": [100, 148], "jsonschema": 1738, "jsyu": [2, 285, 296, 336, 1769], "jturnei": 1738, "judg": 1743, "jul": [1733, 1804], "juli": [1792, 1837], "jump": 279, "jun": [106, 284, 295, 1694, 1707, 1714, 1731, 1732, 1733, 1740, 1743, 1766, 1770, 1828, 1833, 1837, 1842, 1844], "june": 1746, "jupyt": [1738, 1828], "jurecka": [1692, 1752], "just": [0, 2, 106, 279, 393, 610, 656, 660, 993, 1206, 1215, 1704, 1708, 1714, 1730, 1737, 1738, 1740, 1743, 1746, 1748, 1756, 1757, 1768, 1771, 1779, 1782, 1785, 1786, 1801, 1808, 1810, 1815, 1817, 1828, 1842, 1843, 1844], "justin": [1757, 1762, 1768, 1783, 1791, 1792, 1838], "justm": 1748, "jz201170d": [295, 1695, 1697, 1698, 1700, 1701, 1702, 1758, 1766], "k": [2, 11, 76, 84, 92, 295, 318, 319, 342, 368, 369, 377, 386, 390, 394, 861, 1210, 1224, 1683, 1691, 1695, 1698, 1700, 1703, 1704, 1706, 1707, 1714, 1731, 1734, 1738, 1742, 1750, 1755, 1757, 1758, 1763, 1766, 1767, 1772, 1776, 1777, 1780, 1781, 1786, 1792, 1798, 1800, 1809, 1838, 1842, 1843], "k_": 1798, "k_a": 1837, "k_alg": 1838, "k_b": 1837, "ka": [641, 1206, 1704], "kabsch": 106, "kaliman": [1216, 1678, 1777, 1780], "kallai": [216, 217, 295, 586, 1206, 1704, 1734, 1740, 1755, 1766, 1792, 1793], "kappa": [1753, 1798], "kappa_": 1798, "kappa_invang": 1754, "kappa_invbohr": 1754, "kappa_p": 1753, "karlsruh": [1707, 1730, 1731], "karton": 1740, "kb": [650, 1206, 1704, 1706, 1832], "kcal": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1828, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "kcalmol2wavenumb": 1706, "keep": [0, 1, 2, 86, 106, 265, 295, 407, 408, 656, 1197, 1206, 1231, 1613, 1704, 1735, 1737, 1738, 1740, 1743, 1747, 1748, 1757, 1766, 1785, 1794, 1810, 1817, 1828, 1837, 1838, 1844], "keepal": 1748, "kei": [0, 2, 8, 21, 68, 86, 100, 106, 148, 150, 151, 174, 175, 176, 192, 195, 197, 200, 203, 207, 208, 209, 210, 211, 212, 219, 235, 236, 238, 244, 246, 247, 248, 249, 254, 255, 262, 263, 265, 267, 268, 277, 283, 323, 333, 346, 359, 366, 367, 371, 376, 377, 379, 383, 386, 397, 1738, 1740, 1754, 1757, 1759, 1761, 1772, 1788, 1794, 1823, 1824, 1828, 1838], "kelvin": [1232, 1667, 1704, 1706, 1754, 1843], "kelvin_atomic_mass_unit_relationship": 1706, "kelvin_electron_volt_relationship": 1706, "kelvin_hartree_relationship": 1706, "kelvin_hertz_relationship": 1706, "kelvin_inverse_meter_relationship": 1706, "kelvin_joule_relationship": 1706, "kelvin_kilogram_relationship": 1706, "kenneth": [1692, 1752], "kept": [823, 1210, 1226, 1356, 1704, 1753], "kernel": [1230, 1231, 1468, 1626, 1628, 1629, 1630, 1634, 1704, 1756, 1757, 1760, 1837, 1838], "kesharwani": 1734, "ket": [13, 1708, 1756], "keten": [1714, 1842], "key1": 27, "key2": 27, "keyerror": [150, 262], "keynot": 1788, "keyword": [0, 8, 86, 106, 195, 197, 200, 208, 209, 210, 219, 235, 236, 246, 248, 249, 265, 283, 284, 300, 301, 302, 303, 318, 319, 326, 327, 328, 333, 357, 371, 378, 381, 382, 392, 430, 539, 569, 574, 581, 582, 586, 587, 592, 593, 599, 603, 606, 608, 609, 610, 611, 614, 616, 619, 622, 625, 628, 629, 630, 631, 632, 633, 634, 637, 639, 640, 641, 643, 645, 648, 650, 651, 652, 654, 655, 656, 660, 662, 664, 665, 670, 671, 672, 676, 679, 684, 685, 689, 690, 691, 694, 695, 699, 705, 708, 709, 711, 712, 736, 823, 930, 949, 958, 1065, 1076, 1084, 1096, 1102, 1125, 1157, 1199, 1203, 1206, 1208, 1210, 1213, 1219, 1221, 1225, 1226, 1231, 1266, 1290, 1360, 1497, 1498, 1577, 1599, 1619, 1711, 1714, 1730, 1733, 1738, 1739, 1740, 1743, 1752, 1753, 1756, 1757, 1759, 1763, 1764, 1768, 1775, 1777, 1779, 1780, 1781, 1782, 1787, 1790, 1791, 1792, 1794, 1795, 1796, 1800, 1801, 1805, 1808, 1809, 1814, 1821, 1826, 1828, 1829, 1831, 1834, 1838, 1840, 1842, 1844], "kg": [1706, 1832], "ki": 1735, "kib": 1832, "kicharski": 1734, "kilogram": 1706, "kilogram_atomic_mass_unit_relationship": 1706, "kilogram_electron_volt_relationship": 1706, "kilogram_hartree_relationship": 1706, "kilogram_hertz_relationship": 1706, "kilogram_inverse_meter_relationship": 1706, "kilogram_joule_relationship": 1706, "kilogram_kelvin_relationship": 1706, "kilojoul": 1706, "kind": [0, 2, 377, 662, 1206, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1828, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "kinet": [76, 89, 93, 103, 150, 295, 318, 319, 1669, 1690, 1695, 1697, 1698, 1700, 1702, 1703, 1757, 1758, 1766, 1776, 1781, 1800, 1817, 1836, 1838], "kinetic_grad": 103, "kineticint": [1817, 1827], "king": [1734, 1781, 1782, 1786, 1802, 1843], "kitandkapoodl": 1788, "kj": [1706, 1752, 1763, 1837], "kl": [641, 1206, 1704, 1708, 1763], "klamt": [1734, 1754], "klepei": 1734, "klitz": 1706, "klopper": 1740, "km": 386, "kmlyp": [295, 318, 319, 1695, 1698, 1700, 1703, 1758, 1766, 1800], "knew": 1738, "knob": [1738, 1783], "know": [2, 603, 664, 1124, 1206, 1221, 1704, 1738, 1750, 1757, 1786, 1801, 1817, 1824, 1828, 1833, 1838, 1843, 1844], "knowledg": [608, 1206, 1229, 1688, 1704, 1755], "known": [106, 265, 577, 1206, 1704, 1730, 1738, 1739, 1740, 1742, 1753, 1756, 1757, 1759, 1763, 1767, 1771, 1781, 1788, 1789, 1790, 1794, 1798, 1801, 1803, 1838], "koch": [1734, 1740], "kohn": [84, 150, 314, 1734, 1757, 1791, 1810, 1837, 1838], "kongst": 1734, "konrad": 1734, "koopman": [925, 1213, 1225, 1259, 1260, 1704, 1757, 1781], "korona": [1230, 1469, 1704, 1734, 1837], "korsel": 1781, "kpa": 1706, "kpd": 1788, "kr": [1707, 1714, 1731, 1733, 1842], "krau": [1734, 1740, 1750, 1781], "krieg": 1734, "krivdina": 1734, "krkr": [1692, 1752], "kroll": [1122, 1221, 1704, 1730, 1762, 1836], "kruse": [1734, 1760, 1781], "krylov": [1734, 1798, 1805], "krypton": [1692, 1752], "ksdt": [295, 318, 319, 1695, 1698, 1703, 1758, 1766, 1800], "kt2": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "kth": [861, 863, 1210, 1704, 1755], "kumar": [1734, 1781, 1786], "kurlancek": [1734, 1798], "kurlancheek": [1734, 1798], "kussmann": 1734, "kutzelnigg": [1734, 1781, 1836], "kw": 1711, "kwarg": [2, 5, 8, 13, 20, 27, 29, 64, 88, 90, 92, 96, 100, 101, 103, 106, 114, 119, 147, 148, 246, 248, 252, 275, 284, 291, 295, 300, 301, 302, 306, 307, 312, 317, 318, 319, 320, 341, 351, 352, 359, 365, 370, 381, 382, 393, 394, 398, 1714, 1740, 1743, 1750, 1768, 1772, 1779, 1794, 1799, 1809, 1834, 1842], "kwargs_low": [1809, 1834], "k\u00e1llai": 1755, "l": [2, 5, 94, 97, 295, 318, 319, 377, 1131, 1132, 1133, 1134, 1136, 1137, 1221, 1695, 1697, 1698, 1702, 1703, 1704, 1714, 1730, 1734, 1738, 1754, 1755, 1758, 1763, 1766, 1767, 1776, 1777, 1780, 1781, 1782, 1786, 1788, 1789, 1799, 1800, 1803, 1810, 1836, 1842], "l10": 1788, "l105": 1833, "l130": 1788, "l136": 1833, "l15": 1788, "l23": 372, "l41": 372, "l762": 1730, "l9": 1788, "l_m": 1775, "l_user_scftype_scf": 1801, "l_user_wfn": 1801, "l_user_wfn_scf": 1801, "la": [1707, 1731], "lab": [1738, 1759, 1783, 1804, 1835], "labb": 1734, "label": [2, 8, 21, 74, 98, 100, 103, 106, 257, 258, 283, 284, 285, 286, 287, 296, 298, 317, 333, 336, 337, 338, 348, 365, 383, 384, 386, 616, 1206, 1704, 1706, 1708, 1730, 1733, 1737, 1738, 1743, 1748, 1750, 1753, 1756, 1764, 1767, 1769, 1776, 1782, 1785, 1788, 1794, 1799, 1802, 1804, 1833, 1837], "labori": 1833, "lack": [1753, 1757, 1802, 1832], "lag": 279, "lagard\u00e8r": 1734, "lagrang": 1202, "lagrangian": [62, 150, 1708, 1798], "laid": 150, "laikov": 1757, "lambda": [164, 346, 377, 520, 529, 639, 647, 655, 913, 1202, 1206, 1213, 1225, 1230, 1244, 1476, 1671, 1704, 1739, 1742, 1757, 1776, 1781, 1798, 1838], "lambda_": [377, 1753], "lambda_1": [530, 1202, 1704], "lambda_2": [530, 1202, 1704, 1753], "lambda_3": 1753, "lan": [1714, 1842], "lanczo": [874, 1210, 1704], "lane": 1788, "langl": [411, 430, 433, 466, 507, 513, 514, 557, 568, 575, 641, 727, 787, 884, 917, 1198, 1199, 1200, 1201, 1202, 1204, 1206, 1208, 1210, 1213, 1225, 1242, 1704, 1714, 1742, 1756, 1757, 1763, 1771, 1798, 1829, 1836, 1838, 1842], "languag": [810, 1210, 1704, 1738, 1764, 1785, 1821, 1824, 1828, 1832, 1844], "lanl2dz": [1707, 1731], "lapack": [1714, 1736, 1737, 1746, 1767, 1782, 1785, 1812, 1814, 1842], "lapack_include_dir": 1738, "lapack_librari": 1738, "lapack_typ": 1738, "laplac": [95, 140, 1230, 1443, 1704, 1781, 1837], "laplacedenomin": 1827, "laqua": [1734, 1757, 1838], "larg": [0, 106, 327, 342, 356, 433, 466, 507, 514, 568, 574, 682, 703, 726, 1153, 1199, 1200, 1201, 1202, 1206, 1208, 1221, 1225, 1230, 1242, 1463, 1692, 1704, 1714, 1730, 1738, 1742, 1748, 1750, 1752, 1757, 1759, 1763, 1767, 1768, 1770, 1774, 1776, 1781, 1798, 1802, 1824, 1835, 1836, 1837, 1838, 1842, 1844], "larger": [577, 1206, 1226, 1231, 1331, 1332, 1490, 1704, 1730, 1738, 1740, 1753, 1755, 1757, 1770, 1785, 1790, 1802, 1821, 1838], "largest": [2, 285, 287, 321, 336, 338, 432, 601, 634, 659, 683, 698, 700, 1199, 1206, 1704, 1742, 1752, 1754, 1781, 1788, 1832, 1833], "last": [2, 5, 18, 66, 150, 276, 277, 284, 286, 295, 300, 301, 302, 312, 318, 319, 337, 342, 356, 381, 382, 430, 490, 628, 867, 1199, 1200, 1206, 1210, 1231, 1606, 1704, 1714, 1738, 1740, 1748, 1752, 1757, 1766, 1768, 1770, 1772, 1782, 1785, 1788, 1794, 1795, 1799, 1800, 1804, 1810, 1826, 1828, 1832, 1833, 1838, 1840, 1842, 1844], "lastli": 1838, "lasttest": [2, 1738], "late": [1746, 1757, 1828], "later": [0, 2, 87, 284, 370, 488, 637, 648, 671, 1148, 1149, 1200, 1206, 1221, 1231, 1613, 1704, 1708, 1730, 1738, 1740, 1757, 1781, 1785, 1786, 1798, 1804, 1808, 1835, 1838, 1844], "latest": [1736, 1737, 1738, 1748, 1764, 1781, 1786, 1788, 1817, 1837], "latex": [1764, 1801], "latter": [0, 2, 297, 347, 474, 573, 577, 626, 647, 697, 703, 1200, 1206, 1231, 1655, 1704, 1714, 1738, 1742, 1743, 1752, 1753, 1755, 1756, 1757, 1759, 1770, 1774, 1788, 1803, 1804, 1817, 1834, 1837, 1838, 1841, 1842], "lattic": 1706, "lattice_parameter_of_silicon": 1706, "launch": [1756, 1767], "law": [1706, 1734, 1743], "layer": [1768, 1794, 1810, 1817, 1823, 1824], "layout": [100, 135, 148, 1736, 1767, 1777, 1814, 1818, 1824, 1838], "lbl": 1772, "lc": [295, 1695, 1698, 1701, 1710, 1758, 1766], "lcao": 1781, "lcc2": [1669, 1776], "lccd": [284, 295, 318, 319, 381, 382, 1675, 1680, 1684, 1714, 1739, 1740, 1766, 1771, 1776, 1781, 1798, 1800, 1826, 1842], "lccsd": [284, 295, 1669, 1680, 1714, 1739, 1740, 1766, 1771, 1776, 1781, 1842], "ld_library_path": [1738, 1808], "lda": [1230, 1478, 1704, 1708, 1714, 1810, 1838, 1842], "lda0": [295, 318, 319, 1695, 1698, 1700, 1701, 1703, 1758, 1766, 1800], "ldot": [1775, 1838], "le": [1231, 1562, 1704, 1738], "lead": [681, 1206, 1704, 1742, 1753, 1757, 1759, 1763, 1767, 1770, 1781, 1797, 1798, 1802, 1810, 1817, 1837, 1838], "leak": 1821, "learn": [1786, 1808], "least": [0, 2, 106, 154, 155, 156, 157, 158, 159, 342, 356, 399, 434, 703, 839, 840, 841, 1199, 1206, 1210, 1704, 1714, 1738, 1739, 1742, 1747, 1750, 1756, 1761, 1785, 1788, 1792, 1838, 1839, 1842], "leat": 1738, "leav": [2, 106, 279, 1231, 1498, 1704, 1730, 1738, 1767, 1785, 1786, 1788, 1817], "lebedev": [770, 776, 1209, 1231, 1536, 1537, 1544, 1704, 1754, 1757], "lechner": 1734, "lectur": 1770, "led": 1757, "left": [100, 284, 356, 411, 430, 466, 513, 514, 557, 1198, 1199, 1200, 1202, 1204, 1669, 1704, 1708, 1740, 1741, 1742, 1753, 1757, 1760, 1776, 1801, 1804, 1829, 1837, 1838, 1841], "leftarrow": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "leftmost": 0, "legaci": 1770, "legacy_gradi": 1743, "legendr": [1230, 1477, 1704], "legit": [267, 1759], "legitim": [380, 1768, 1782], "lehtola": [1734, 1781, 1838], "leining": [835, 1210, 1704, 1714, 1755, 1781, 1789, 1842], "len": [329, 1668, 1669, 1690, 1776], "length": [100, 149, 150, 282, 332, 388, 402, 414, 539, 618, 620, 683, 819, 1197, 1198, 1203, 1206, 1210, 1231, 1586, 1657, 1704, 1706, 1714, 1742, 1750, 1761, 1776, 1828, 1832, 1833, 1841, 1842, 1844], "lengthi": 1824, "lengthier": 1840, "lennard": 1757, "lenth": 1781, "less": [2, 106, 285, 287, 295, 318, 319, 329, 336, 338, 582, 647, 684, 703, 710, 837, 874, 1085, 1206, 1210, 1219, 1226, 1303, 1341, 1704, 1738, 1742, 1743, 1744, 1745, 1752, 1755, 1756, 1757, 1766, 1767, 1771, 1776, 1785, 1789, 1794, 1798, 1800, 1801, 1802, 1810, 1824, 1835, 1837, 1838], "lesser": [1714, 1738, 1781, 1842], "lestrang": 1734, "lestrange2015": [1734, 1841], "let": [1, 92, 1746, 1749, 1754, 1756, 1757, 1762, 1765, 1767, 1770, 1773, 1775, 1782, 1783, 1784, 1785, 1786, 1788, 1797, 1798, 1803, 1824, 1828, 1839, 1844], "lett": [1714, 1734, 1740, 1842], "letter": [1709, 1730, 1776, 1810], "lettercas": [330, 355, 358], "lev": [1224, 1235, 1704, 1785], "level": [0, 2, 103, 106, 138, 147, 150, 260, 261, 267, 268, 269, 284, 308, 310, 335, 346, 352, 361, 370, 378, 383, 433, 466, 507, 514, 525, 537, 549, 558, 574, 581, 586, 612, 659, 738, 791, 794, 800, 820, 859, 860, 868, 890, 920, 928, 1119, 1153, 1184, 1199, 1200, 1201, 1202, 1203, 1204, 1206, 1208, 1210, 1213, 1221, 1222, 1224, 1225, 1226, 1230, 1231, 1235, 1241, 1242, 1305, 1479, 1570, 1571, 1653, 1692, 1704, 1714, 1730, 1736, 1738, 1739, 1740, 1742, 1743, 1748, 1752, 1755, 1757, 1759, 1761, 1764, 1767, 1768, 1770, 1774, 1776, 1781, 1785, 1787, 1788, 1794, 1796, 1798, 1799, 1802, 1805, 1806, 1809, 1812, 1814, 1817, 1828, 1832, 1837, 1838, 1841, 1842, 1844], "level_hint": [267, 1759], "level_shift": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "level_shift_cutoff": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "levenshtein": [299, 349], "leverag": [1828, 1841], "lgpl": [1738, 1781], "lgtm": 1822, "lhf": 1837, "li": [1692, 1707, 1731, 1733, 1734, 1752, 1802], "lia": [903, 1212, 1704], "liabl": 1767, "liako": [1734, 1763], "lib": [2, 1738, 1765, 1783, 1785, 1786, 1828], "lib64": 1738, "lib_name_without_lib": 1785, "libacml": 1738, "libacml_mp": 1738, "libaddon": 1738, "libbla": 1738, "libc": [1738, 1808], "libciomr": [811, 1210, 1704, 1755, 1810], "libderiv": [1738, 1839], "libdii": [1708, 1838], "libdisp": [267, 1759], "libdpd": [433, 434, 466, 507, 514, 537, 558, 1199, 1200, 1201, 1202, 1203, 1204, 1225, 1242, 1704, 1742], "libecpint": [1738, 1777, 1780, 1838], "libefp": [295, 400, 1216, 1678, 1736, 1738, 1766, 1777, 1780, 1781, 1785, 1786, 1842], "libefp2": 1782, "libefp_dir": 1782, "libefpconfig": 1782, "liber": 106, "libfock": [1738, 1757, 1817, 1823, 1838], "libfunct": 1757, "libgcc": 1748, "libint": [1736, 1738, 1777, 1780, 1785, 1788, 1839], "libint1": [1738, 1783], "libint2": [214, 310, 361, 1129, 1221, 1704, 1738, 1783, 1788, 1817], "libint2_dir": 1783, "libint_dev": 1737, "libiomp5": 1738, "libjk": 1725, "liblapack": 1738, "libm": 1738, "libmint": [158, 1154, 1221, 1704, 1714, 1726, 1738, 1743, 1768, 1783, 1785, 1810, 1817, 1823, 1838, 1839, 1842], "libmintsbasisset": 1730, "libmintsmolecul": 1768, "libmkl_cor": 1738, "libmkl_lapack95_lp64": 1738, "libmkl_rt": [1738, 1748], "libopt": [1777, 1809, 1812], "libpython": 1748, "libpython3": 1738, "libqt": [100, 1810], "librari": [2, 86, 226, 267, 372, 728, 1208, 1215, 1216, 1677, 1678, 1704, 1714, 1730, 1735, 1736, 1737, 1743, 1746, 1748, 1749, 1754, 1757, 1759, 1762, 1765, 1767, 1773, 1775, 1777, 1780, 1781, 1783, 1784, 1785, 1786, 1798, 1803, 1808, 1810, 1817, 1823, 1824, 1838, 1839, 1841, 1842], "libsapt_solv": 1837, "libscf_solv": [130, 1154, 1221, 1704, 1757, 1838, 1841], "libstdc": 1808, "libtensorlight": 1738, "libtran": 1708, "libxc": [96, 138, 1231, 1520, 1704, 1714, 1738, 1757, 1777, 1780, 1781, 1842], "libxc_dir": 1784, "libxc_funct": 1757, "libxcconfig": 1784, "libxcfunct": [138, 1827], "licenc": [1, 1749, 1754, 1773, 1780, 1782, 1783, 1784, 1803], "licens": [1735, 1738, 1743, 1748, 1777, 1788, 1792, 1806], "life": [2, 285, 296, 336, 1769], "lift": [1823, 1824], "light": [106, 282, 323, 332, 1706, 1772], "light_color": 323, "lightweight": [267, 1748, 1759, 1786, 1824], "like": [0, 2, 8, 100, 111, 150, 229, 262, 263, 318, 319, 329, 356, 359, 367, 372, 386, 665, 1018, 1206, 1216, 1225, 1254, 1255, 1704, 1708, 1714, 1730, 1735, 1737, 1738, 1740, 1742, 1743, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1762, 1763, 1764, 1767, 1768, 1770, 1771, 1776, 1779, 1785, 1786, 1788, 1792, 1795, 1796, 1798, 1800, 1801, 1802, 1803, 1808, 1809, 1810, 1817, 1821, 1823, 1824, 1828, 1832, 1833, 1837, 1838, 1840, 1842, 1843, 1844], "likewis": [1730, 1767, 1781, 1833], "lim_": 1757, "limit": [2, 296, 381, 382, 539, 680, 1097, 1203, 1206, 1220, 1226, 1330, 1331, 1332, 1704, 1738, 1742, 1743, 1757, 1769, 1774, 1775, 1782, 1790, 1794, 1799, 1802, 1810, 1817, 1824, 1826, 1828, 1829, 1837, 1838, 1844], "linalg": [334, 1841], "lindep_tol": 115, "lindh": [1226, 1342, 1704], "lindh_simpl": [1226, 1342, 1704], "line": [2, 282, 332, 377, 380, 614, 661, 1206, 1224, 1240, 1704, 1714, 1730, 1735, 1736, 1738, 1739, 1743, 1750, 1764, 1768, 1777, 1782, 1785, 1788, 1801, 1802, 1808, 1822, 1828, 1832, 1833, 1834, 1835, 1838, 1841, 1842, 1844], "linear": [0, 1, 2, 16, 106, 115, 295, 318, 319, 335, 377, 573, 616, 639, 645, 646, 647, 662, 777, 929, 946, 977, 1206, 1209, 1213, 1214, 1225, 1226, 1229, 1231, 1281, 1339, 1403, 1602, 1616, 1617, 1692, 1704, 1708, 1710, 1714, 1730, 1733, 1734, 1735, 1738, 1739, 1740, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1790, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1811, 1812, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1839, 1840, 1841, 1842, 1843, 1844], "linear_tol": 115, "linearli": [115, 1710, 1714, 1763, 1810, 1838, 1842], "lineq": [946, 1213, 1225, 1281, 1704], "lineq_solv": [0, 1, 2, 946, 1225, 1281, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "lineq_typ": [645, 1206, 1704], "linesearch": [1226, 1368, 1704, 1802], "lineshap": [322, 325, 377, 1827], "linger": 1788, "link": [268, 292, 310, 343, 361, 373, 391, 721, 1034, 1036, 1037, 1041, 1047, 1048, 1049, 1050, 1166, 1207, 1218, 1221, 1231, 1572, 1626, 1636, 1692, 1704, 1714, 1738, 1746, 1748, 1752, 1757, 1762, 1764, 1765, 1767, 1773, 1775, 1777, 1782, 1783, 1784, 1785, 1788, 1790, 1804, 1808, 1824, 1838, 1839, 1842], "link_ints_toler": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "linker": 1770, "linux": [1, 1736, 1737, 1746, 1748, 1749, 1754, 1759, 1762, 1765, 1767, 1773, 1774, 1775, 1781, 1782, 1783, 1784, 1788, 1803, 1806, 1807, 1808, 1839], "lipparini": [1734, 1754], "list": [0, 2, 5, 8, 9, 13, 16, 21, 26, 27, 64, 73, 75, 84, 89, 90, 92, 96, 98, 100, 103, 105, 106, 108, 110, 111, 112, 114, 128, 131, 138, 139, 143, 147, 148, 150, 196, 240, 246, 248, 267, 268, 284, 285, 286, 297, 298, 299, 310, 317, 318, 319, 322, 324, 325, 327, 328, 329, 331, 334, 335, 336, 337, 342, 344, 346, 347, 348, 349, 356, 361, 363, 365, 367, 377, 381, 382, 383, 384, 386, 388, 389, 392, 616, 641, 829, 855, 930, 949, 958, 1108, 1111, 1126, 1155, 1206, 1210, 1213, 1221, 1225, 1231, 1266, 1290, 1655, 1704, 1735, 1738, 1740, 1742, 1743, 1746, 1748, 1750, 1752, 1753, 1754, 1755, 1757, 1759, 1761, 1762, 1765, 1767, 1768, 1772, 1773, 1774, 1775, 1776, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1790, 1792, 1794, 1797, 1798, 1799, 1800, 1802, 1803, 1804, 1808, 1817, 1826, 1828, 1829, 1832, 1833, 1838, 1839, 1840, 1841, 1843], "list_of_arrai": 1797, "list_of_ion": 1754, "liter": [2, 285, 287, 336, 338, 374, 395, 1764, 1789, 1794], "literal_cfour": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "literatur": [2, 68, 267, 356, 662, 1206, 1704, 1718, 1752, 1754, 1757, 1759, 1770, 1802, 1837], "lithium": [1714, 1842], "littl": [1738, 1767, 1828, 1837, 1844], "liu": [811, 1210, 1704, 1755], "live": [1764, 1777, 1786, 1801, 1818, 1828], "ll": [1738, 1743, 1788, 1817, 1828, 1836, 1844], "llai": [1224, 1683, 1742, 1755, 1767, 1777, 1780, 1792], "lldb": [1736, 1767, 1814], "ller": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "llvm": [1738, 1788], "lm": [1692, 1752], "lmo": [978, 980, 981, 982, 983, 985, 1214, 1704, 1763], "lmp2": [1669, 1776], "ln": [322, 368, 369, 377, 1738], "lo": 1810, "load": [2, 100, 148, 150, 225, 900, 1212, 1231, 1507, 1628, 1704, 1738, 1748, 1767, 1770, 1782, 1788, 1808, 1828, 1832, 1833, 1837], "load_mpqc": 100, "loader": [358, 1738], "loc": [1000, 1215, 1704, 1746], "local": [0, 1, 2, 8, 10, 76, 114, 117, 195, 197, 200, 210, 295, 326, 351, 370, 371, 376, 397, 442, 443, 444, 445, 446, 479, 481, 482, 483, 484, 518, 519, 520, 521, 522, 523, 542, 543, 544, 545, 546, 547, 620, 664, 763, 965, 971, 972, 973, 974, 976, 994, 1000, 1054, 1056, 1060, 1206, 1209, 1214, 1215, 1218, 1231, 1573, 1574, 1629, 1704, 1714, 1730, 1733, 1735, 1736, 1737, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1790, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1828, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "local_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "local_cphf_cutoff": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "local_cutoff": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "local_do_singl": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "local_filter_singl": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "local_ibo_condit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "local_ibo_pow": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "local_ibo_star": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "local_ibo_stars_complet": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "local_ibo_use_star": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "local_maxit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "local_method": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "local_opt": 1801, "local_pairdef": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "local_precondition": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "local_use_ghost": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "local_weakp": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "localhost": 1788, "localiz": 1770, "locat": [88, 106, 148, 231, 267, 323, 324, 1714, 1715, 1730, 1735, 1738, 1743, 1746, 1748, 1749, 1750, 1761, 1762, 1764, 1765, 1767, 1770, 1773, 1775, 1776, 1782, 1783, 1784, 1787, 1788, 1803, 1806, 1807, 1808, 1809, 1814, 1823, 1835, 1838, 1839, 1840, 1842, 1844], "lock": [138, 648, 1206, 1229, 1415, 1704], "lock_occ": 1785, "lock_singlet": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "log": [2, 342, 356, 1736, 1748, 1767, 1768, 1786, 1788, 1794, 1802], "log_gaussian": [968, 1214, 1231, 1532, 1704], "log_slat": [968, 1214, 1231, 1532, 1704], "logarithm": [1231, 1531, 1704], "logfil": [767, 1209, 1704, 1754], "logger": 1768, "logic": [2, 62, 285, 336, 660, 1206, 1704, 1757, 1788, 1824], "loglevel": [1738, 1767, 1768], "logo": [1736, 1767], "lol": [1112, 1221, 1704, 1750], "lola": [1112, 1221, 1704, 1750], "lolb": [1112, 1221, 1704, 1750], "london": 1734, "lone": [284, 1740, 1788], "long": [2, 138, 389, 400, 1710, 1738, 1752, 1755, 1756, 1757, 1759, 1764, 1785, 1786, 1787, 1801, 1802, 1810, 1828, 1832, 1833, 1837, 1838], "longer": [592, 682, 1206, 1231, 1498, 1704, 1738, 1759, 1763, 1764, 1783, 1810, 1817, 1838], "longest": 2, "longtest": 2, "longtim": 1743, "look": [8, 299, 349, 603, 881, 1206, 1210, 1704, 1738, 1740, 1743, 1749, 1750, 1753, 1754, 1756, 1757, 1762, 1764, 1767, 1786, 1788, 1801, 1803, 1808, 1817, 1828, 1837, 1838, 1844], "look_at": 323, "lookup": [86, 1757], "loop": [1711, 1714, 1777, 1799, 1810, 1817, 1828, 1833, 1842, 1844], "loop_start": 1817, "loos": [975, 1214, 1704, 1833], "loosen": [1230, 1455, 1704, 1757, 1837], "looser": 2, "lorentzian": [322, 377, 1827], "lori": [106, 1740, 1743, 1746, 1752, 1759, 1765, 1773, 1774, 1782, 1783, 1784, 1802, 1804, 1807, 1839, 1843], "loriab": 1759, "loschmidt": 1706, "loschmidt_constant_27315_k_100_kpa": 1706, "loschmidt_constant_27315_k_101325_kpa": 1706, "lose": 106, "loss": [1753, 1798, 1838], "lost": 106, "lot": [2, 308, 1738, 1764, 1768, 1786, 1798, 1799, 1810, 1817, 1828, 1844], "low": [20, 265, 434, 467, 1095, 1199, 1200, 1219, 1704, 1714, 1738, 1740, 1742, 1757, 1763, 1767, 1771, 1788, 1794, 1812, 1814, 1829, 1838, 1842], "low_mem": [951, 1213, 1704], "lowdin": [1685, 1776], "lowdin_charg": [111, 1799], "lower": [20, 100, 284, 359, 574, 614, 640, 681, 887, 1206, 1210, 1224, 1226, 1241, 1345, 1692, 1704, 1714, 1726, 1738, 1740, 1742, 1752, 1754, 1755, 1757, 1763, 1771, 1785, 1802, 1809, 1810, 1833, 1834, 1838, 1841, 1842], "lower_bound": 1802, "lowercas": [359, 392, 1709, 1730, 1738, 1754, 1776, 1782, 1785, 1809, 1834, 1835], "lowernam": [1809, 1834], "lowertriangl": [100, 135], "lowest": [0, 300, 301, 302, 342, 603, 609, 660, 671, 672, 681, 833, 1125, 1206, 1210, 1221, 1226, 1231, 1363, 1658, 1704, 1714, 1750, 1755, 1771, 1772, 1795, 1829, 1833, 1837, 1838, 1841, 1842], "lpb": [769, 781, 1209, 1704, 1754], "lpol": [1694, 1707, 1731, 1732, 1733], "lr": [0, 495, 606, 610, 613, 1200, 1206, 1224, 1236, 1704, 1714, 1742, 1842], "lr1": [1714, 1842], "lr2": [1714, 1842], "lr3": [1714, 1842], "lrc": [295, 1695, 1698, 1700, 1701, 1710, 1714, 1739, 1757, 1758, 1766, 1781, 1842], "lru": [434, 467, 1199, 1200, 1704, 1742], "ls_thc_basis_toler": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ls_thc_comput": 1827, "ls_thc_df": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ls_thc_pruning_schem": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ls_thc_radial_point": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ls_thc_s_epsilon": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ls_thc_spherical_point": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ls_thc_weights_toler": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "lsda": [300, 301, 302, 1739, 1757, 1772, 1781], "lsda_cutoff": 80, "lsdaton": 1724, "lse": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "lse_collaps": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "lse_toler": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "lto": [1736, 1780], "lu": [100, 1714, 1734, 1754, 1810, 1842], "luckili": 1828, "lumo": [476, 671, 895, 1200, 1206, 1211, 1231, 1564, 1704, 1714, 1750, 1768, 1838, 1842], "lumo_occ": 1768, "luu": [1734, 1770], "lvc": [655, 1206, 1704], "lvl": 1785, "lvmo": 1750, "lx": 1810, "ly": [2, 1224, 1683, 1748, 1755, 1757, 1792, 1810, 1838], "lz": 1810, "m": [0, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1750, 1751, 1752, 1753, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "m05": [295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1757, 1758, 1766, 1800], "m06": [295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "m08": [295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "m11": [295, 318, 319, 1695, 1697, 1698, 1700, 1701, 1702, 1703, 1758, 1766, 1800], "m_": [692, 865, 884, 1206, 1210, 1224, 1229, 1238, 1239, 1401, 1704, 1750, 1755, 1829, 1833], "m_iabc": 1708, "m_lumo": [1112, 1221, 1704, 1750], "m_tdm": [1231, 1657, 1704, 1841], "ma": 1833, "mac": [1736, 1737, 1748, 1767, 1781, 1808], "machin": [575, 651, 1206, 1704, 1781, 1821, 1838], "machineri": [2, 106, 271, 1738, 1743, 1756, 1757, 1817, 1824], "maco": [1, 1746, 1748, 1749, 1754, 1759, 1762, 1765, 1773, 1774, 1775, 1781, 1782, 1783, 1784, 1803, 1806, 1807, 1839], "macosx": 1748, "macp": 1833, "macport": [1736, 1767], "macro": [741, 1208, 1704, 1757], "macroconfigur": [794, 1210, 1704], "macroiter": [84, 749, 1208, 1704, 1753, 1838], "macroscop": 377, "mad": [906, 1212, 1704, 1757], "madai": 1734, "made": [268, 359, 1730, 1737, 1743, 1748, 1753, 1756, 1757, 1763, 1778, 1785, 1801, 1802, 1808, 1824, 1832, 1834, 1835], "madmp2_sleep": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mag": [683, 1206, 1704, 1706], "mag_const": 1706, "mag_flux_quantum": 1706, "magma": [1231, 1629, 1704], "magnet": [636, 1206, 1231, 1657, 1704, 1776, 1841], "magnetiz": [454, 1199, 1704, 1706], "magneton": 1706, "magnitud": [275, 873, 1210, 1226, 1231, 1330, 1586, 1704, 1753, 1757, 1817, 1838], "mai": [0, 2, 8, 106, 122, 150, 262, 263, 318, 319, 329, 370, 383, 433, 457, 466, 471, 507, 514, 615, 660, 671, 786, 823, 827, 833, 882, 1125, 1130, 1199, 1200, 1201, 1202, 1206, 1210, 1221, 1225, 1230, 1231, 1242, 1435, 1436, 1445, 1508, 1694, 1704, 1707, 1730, 1731, 1732, 1733, 1736, 1737, 1739, 1742, 1743, 1746, 1748, 1752, 1753, 1755, 1756, 1757, 1761, 1763, 1767, 1770, 1771, 1774, 1775, 1776, 1780, 1781, 1782, 1785, 1786, 1788, 1789, 1794, 1795, 1798, 1799, 1800, 1801, 1802, 1804, 1808, 1810, 1817, 1828, 1829, 1832, 1835, 1837, 1838, 1839, 1843, 1844], "mail": 1804, "main": [2, 1733, 1737, 1738, 1740, 1748, 1756, 1763, 1775, 1786, 1788, 1804, 1808, 1827, 1828, 1838], "main_pag": 1738, "mainli": [1714, 1788, 1803, 1842], "maintain": [434, 1199, 1704, 1742, 1785, 1786, 1802, 1804, 1817, 1824], "mainten": [2, 1786, 1788], "mainz": 1743, "major": [279, 1742, 1763, 1768, 1781, 1810, 1832], "make": [0, 2, 88, 100, 148, 329, 837, 881, 884, 1102, 1126, 1170, 1210, 1221, 1228, 1231, 1390, 1575, 1704, 1714, 1730, 1735, 1738, 1740, 1742, 1743, 1747, 1748, 1749, 1752, 1753, 1754, 1755, 1756, 1759, 1762, 1764, 1767, 1770, 1771, 1772, 1774, 1779, 1781, 1782, 1785, 1786, 1788, 1789, 1791, 1801, 1802, 1803, 1808, 1817, 1821, 1823, 1824, 1828, 1832, 1835, 1838, 1842, 1844], "make_filenam": 8, "make_shar": [1814, 1817, 1819], "makeandnuk": 90, "makefil": [1735, 1759, 1764, 1774, 1808], "malmqvist": [1734, 1789], "manag": [265, 328, 357, 620, 1206, 1704, 1737, 1738, 1740, 1748, 1767, 1777, 1785, 1794, 1814, 1819, 1824], "manage_git": 1788, "managedmethoderror": [1809, 1827], "mandatori": [0, 781, 1209, 1704, 1754], "mangl": 371, "mani": [0, 2, 100, 148, 285, 287, 336, 338, 377, 389, 586, 659, 660, 1125, 1154, 1206, 1221, 1704, 1714, 1722, 1730, 1738, 1739, 1740, 1742, 1743, 1756, 1757, 1759, 1763, 1768, 1769, 1774, 1779, 1781, 1783, 1790, 1794, 1798, 1799, 1808, 1810, 1817, 1824, 1828, 1832, 1833, 1837, 1838, 1840, 1842, 1844], "manifest": [1757, 1841], "manifold": 0, "manipul": [100, 148, 265, 1738, 1740, 1743, 1759, 1790, 1794, 1799, 1801, 1808, 1824, 1833, 1838], "manner": [446, 484, 523, 547, 1199, 1200, 1202, 1203, 1704, 1730, 1743, 1757, 1789, 1838], "manr": [635, 652, 656, 1206, 1704], "manual": [2, 150, 295, 300, 301, 302, 303, 318, 319, 381, 382, 574, 637, 671, 743, 1049, 1050, 1206, 1208, 1218, 1698, 1703, 1704, 1710, 1713, 1714, 1735, 1738, 1743, 1744, 1745, 1755, 1756, 1757, 1766, 1770, 1771, 1772, 1775, 1781, 1788, 1792, 1793, 1799, 1800, 1801, 1802, 1808, 1814, 1815, 1826, 1828, 1833, 1837, 1838, 1842, 1844], "manuscript": 1763, "manybodi": [1768, 1794], "manybodycomput": [1768, 1794], "map": [11, 84, 106, 150, 176, 212, 255, 262, 263, 1226, 1229, 1346, 1431, 1432, 1434, 1704, 1738, 1743, 1777, 1833], "maqz": 1733, "mar": [1694, 1707, 1731, 1732, 1733, 1738], "march": [2, 1738, 1743], "mark": [2, 87, 635, 1206, 1704, 1739, 1742, 1743, 1756, 1757, 1781, 1785, 1798, 1819], "mark_file_for_retent": 87, "marker": [2, 106, 1738, 1743, 1833], "marqu": [1777, 1780, 1781], "marshal": [106, 1692, 1752], "mart": 1734, "martin": [1734, 1740, 1792], "martinez": [1734, 1750], "mask": 335, "mass": [106, 307, 386, 389, 390, 399, 618, 677, 707, 1206, 1704, 1706, 1714, 1738, 1768, 1772, 1782, 1799, 1828, 1833, 1842, 1844], "mass_numb": 106, "massiv": 1824, "master": [372, 1737, 1738, 1748, 1764, 1781, 1782, 1785, 1786, 1788, 1828, 1833, 1840], "masterluke87": 1738, "mat": [2, 363, 1714, 1797, 1842], "mat2arr": 1833, "mat_num_column_print": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "match": [2, 106, 267, 278, 299, 349, 380, 1231, 1633, 1636, 1704, 1711, 1713, 1714, 1738, 1752, 1757, 1759, 1768, 1785, 1786, 1788, 1795, 1796, 1809, 1817, 1833, 1838, 1842, 1843], "materi": 1837, "math": [1734, 1738, 1748, 1777, 1798, 1808], "math_root": 1738, "mathbb": [1757, 1838], "mathbf": [0, 377, 1750, 1763, 1776, 1837, 1841], "mathcal": [284, 1740, 1741], "mathemat": [1763, 1764, 1824, 1837], "mathjax": 1764, "mathlib": 1738, "mathopenmp": 1738, "mathrm": [322, 368, 369, 377, 1750, 1756, 1757, 1838], "matirx": 92, "matlab": [1757, 1810], "matplotlib": [0, 1761], "matric": [2, 16, 18, 75, 76, 84, 100, 103, 148, 160, 182, 217, 259, 356, 575, 664, 686, 828, 855, 1035, 1198, 1206, 1218, 1225, 1231, 1268, 1270, 1560, 1661, 1704, 1714, 1743, 1753, 1770, 1771, 1775, 1789, 1797, 1798, 1810, 1823, 1833, 1838, 1841, 1842], "matrix": [0, 1, 2, 7, 11, 13, 16, 21, 27, 30, 31, 32, 33, 34, 35, 36, 37, 38, 40, 41, 42, 44, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 68, 70, 73, 74, 75, 76, 78, 84, 90, 92, 94, 95, 97, 101, 103, 104, 105, 106, 108, 110, 111, 112, 115, 118, 119, 128, 130, 131, 133, 135, 137, 139, 140, 143, 147, 148, 150, 151, 152, 171, 174, 176, 182, 183, 184, 207, 212, 241, 242, 244, 255, 259, 262, 263, 267, 295, 306, 307, 314, 318, 319, 321, 329, 331, 335, 342, 350, 363, 408, 416, 417, 477, 509, 575, 592, 596, 609, 618, 623, 627, 637, 665, 667, 678, 679, 684, 697, 707, 743, 810, 811, 828, 836, 845, 852, 872, 874, 886, 888, 903, 904, 909, 910, 926, 972, 977, 994, 998, 1135, 1138, 1171, 1172, 1179, 1180, 1197, 1198, 1200, 1201, 1206, 1208, 1210, 1212, 1213, 1214, 1215, 1221, 1222, 1225, 1226, 1229, 1231, 1296, 1362, 1369, 1370, 1411, 1551, 1567, 1568, 1600, 1602, 1663, 1704, 1708, 1711, 1714, 1724, 1740, 1743, 1753, 1755, 1756, 1757, 1763, 1766, 1770, 1771, 1772, 1775, 1776, 1780, 1785, 1788, 1791, 1794, 1798, 1799, 1800, 1802, 1812, 1814, 1817, 1821, 1823, 1824, 1827, 1828, 1829, 1832, 1833, 1836, 1837, 1838, 1841, 1842, 1844], "matrix1": [1714, 1842], "matrix2": [1714, 1842], "matrix_irrep": 16, "matrixfactori": [16, 103, 1827], "matt": [835, 1210, 1704], "matter": [1714, 1743, 1788, 1801, 1833, 1842], "matthew": [1755, 1789], "matz": 1733, "max": [8, 64, 310, 361, 683, 722, 1206, 1207, 1230, 1231, 1439, 1444, 1504, 1576, 1638, 1704, 1733, 1743, 1794, 1802, 1828, 1837, 1838, 1841, 1844], "max_": [1226, 1324, 1704, 1802], "max_am": [8, 158], "max_am_eri": [1738, 1783], "max_attempt": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "max_ccd_diisvec": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "max_diis_vector": [14, 128, 130, 145], "max_dim": [154, 155, 156, 157], "max_disp_g_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "max_dist": [299, 349], "max_energy_g_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "max_force_g_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "max_funct": [7, 105], "max_function_per_shel": 8, "max_holes_i": [794, 1210, 1704], "max_i": [794, 1210, 1704], "max_it": 84, "max_mem_buf": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "max_mograd_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "max_nbodi": 1794, "max_nprimit": 8, "max_num_vec": [0, 2, 808, 861, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "max_parts_iv": [794, 1210, 1704], "max_point": [7, 105, 138], "max_radial_mo": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "max_ss_siz": [342, 356], "max_vec": 321, "max_width": [313, 364], "maxdepth": 1786, "maxim": [0, 313, 364, 575, 763, 764, 766, 768, 1206, 1209, 1704, 1743, 1752, 1754, 1832], "maximilian": 1749, "maximum": [1, 8, 18, 64, 100, 105, 106, 138, 299, 321, 322, 324, 325, 335, 342, 349, 356, 377, 404, 405, 431, 447, 485, 524, 548, 573, 580, 582, 583, 585, 595, 607, 633, 646, 684, 689, 723, 734, 741, 755, 782, 785, 789, 790, 796, 797, 798, 805, 811, 814, 842, 847, 852, 853, 877, 878, 879, 890, 893, 894, 911, 914, 930, 932, 933, 950, 966, 974, 1003, 1007, 1031, 1060, 1062, 1066, 1080, 1114, 1139, 1141, 1176, 1185, 1197, 1199, 1200, 1202, 1203, 1206, 1207, 1208, 1210, 1211, 1213, 1214, 1215, 1218, 1219, 1221, 1222, 1224, 1225, 1226, 1228, 1229, 1230, 1231, 1235, 1243, 1250, 1263, 1266, 1267, 1269, 1286, 1325, 1326, 1340, 1343, 1347, 1349, 1350, 1351, 1366, 1391, 1408, 1416, 1444, 1456, 1457, 1497, 1515, 1516, 1547, 1575, 1577, 1592, 1607, 1625, 1639, 1645, 1652, 1704, 1714, 1738, 1742, 1746, 1749, 1755, 1757, 1759, 1768, 1771, 1774, 1785, 1788, 1789, 1794, 1798, 1802, 1828, 1833, 1837, 1838, 1839, 1841, 1842, 1844], "maximum_block_s": 1817, "maxit": [0, 2, 335, 342, 356, 689, 1206, 1490, 1554, 1574, 1704, 1730, 1733, 1735, 1739, 1740, 1743, 1746, 1747, 1748, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "maxr": 6, "maxscheur": 1738, "mayer": [1685, 1776, 1794, 1799], "mayer_indic": [111, 1799], "mayhal": 1734, "mb": [374, 395, 650, 651, 1206, 1704, 1714, 1743, 1748, 1750, 1757, 1767, 1828, 1832, 1842, 1844], "mb3lyp": [295, 318, 319, 1695, 1698, 1700, 1703, 1758, 1766, 1800], "mb_comput": 1794, "mbe": 1794, "mbi": [352, 1140, 1141, 1142, 1143, 1144, 1221, 1685, 1704, 1714, 1776, 1799, 1842], "mbis_charg": [111, 1799], "mbis_d_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mbis_maxit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mbis_pruning_schem": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mbis_radial_point": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mbis_spherical_point": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mbis_volume_ratio": [111, 1799], "mbox": [1753, 1838], "mbpt": [665, 708, 1206, 1230, 1451, 1704, 1743, 1756, 1763, 1776, 1798, 1837], "mc": 1794, "mc_level_idx": 1794, "mc_level_lbl": 1794, "mcalexand": [1781, 1786], "mccammon": 1734, "mcgibbon": [1734, 1806], "mcmurchi": 1817, "mcscf": [295, 314, 400, 810, 849, 851, 853, 856, 857, 1102, 1127, 1128, 1164, 1165, 1187, 1221, 1673, 1704, 1705, 1709, 1714, 1755, 1766, 1776, 1777, 1790, 1791, 1810, 1829, 1838, 1842], "mcscf1": [1714, 1842], "mcscf2": [1714, 1842], "mcscf3": [1714, 1842], "mcscf_algorithm": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mcscf_ci_cleanup": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mcscf_diis_error_typ": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mcscf_diis_freq": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mcscf_diis_max_vec": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mcscf_diis_start": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mcscf_dpd_cleanup": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mcscf_e_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mcscf_guess": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mcscf_max_rot": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mcscf_maxit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mcscf_object": 13, "mcscf_r_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mcscf_rotat": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mcscf_so_start_": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mcscf_so_start_grad": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mcscf_type": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mctc": [267, 1738, 1759, 1774], "md": [1738, 1788], "mdi": [312, 1738], "mdi_librari": 1738, "mdyne": [386, 1772], "me": [1706, 1737, 1738, 1837], "mean": [2, 265, 285, 287, 329, 336, 338, 433, 466, 507, 514, 592, 601, 603, 611, 616, 638, 655, 665, 669, 671, 675, 681, 688, 693, 708, 813, 935, 992, 1199, 1200, 1201, 1202, 1206, 1210, 1213, 1215, 1225, 1226, 1231, 1242, 1296, 1323, 1563, 1568, 1704, 1738, 1740, 1742, 1743, 1746, 1748, 1752, 1753, 1755, 1756, 1757, 1759, 1768, 1770, 1776, 1785, 1788, 1794, 1798, 1801, 1802, 1809, 1810, 1828, 1829, 1837, 1838, 1844], "meaning": [1714, 1770, 1837, 1842, 1844], "meaningless": 1752, "meanso": [693, 1206, 1704], "meant": [2, 285, 336, 1226, 1371, 1704, 1788, 1844], "meanwhil": 1753, "measur": [2, 1174, 1222, 1704, 1743, 1750, 1776, 1838], "mebi": 1821, "mech": 390, "mechan": [106, 1711, 1714, 1730, 1767, 1776, 1782, 1786, 1817, 1824, 1833, 1842], "media": 1738, "mediat": 370, "medium": [1740, 1756, 1757, 1803, 1837], "meet": [1808, 1825], "mega": 1821, "meh": 1837, "mem": [374, 395], "mem_df": [1166, 1221, 1231, 1507, 1609, 1620, 1704, 1838], "member": [62, 63, 79, 82, 83, 122, 126, 135, 265, 293, 327, 833, 1210, 1692, 1704, 1740, 1743, 1752, 1772, 1794, 1817, 1823, 1832, 1833], "members_descript": [1692, 1752], "memdfjk": 1827, "meme": [1692, 1743, 1752], "memori": [0, 84, 92, 103, 171, 176, 198, 212, 230, 243, 250, 255, 262, 263, 305, 342, 353, 374, 395, 433, 434, 463, 466, 503, 507, 514, 650, 651, 714, 727, 765, 811, 837, 882, 888, 902, 1051, 1095, 1199, 1200, 1201, 1202, 1206, 1207, 1208, 1209, 1210, 1212, 1218, 1219, 1225, 1230, 1231, 1242, 1480, 1481, 1482, 1508, 1576, 1618, 1620, 1624, 1704, 1714, 1734, 1742, 1743, 1753, 1754, 1755, 1756, 1757, 1763, 1767, 1770, 1771, 1777, 1781, 1786, 1788, 1798, 1802, 1810, 1817, 1819, 1824, 1828, 1837, 1838, 1841, 1842, 1844], "memory_estim": 92, "mennucci": 1734, "mention": [0, 1738, 1755, 1757, 1767, 1771, 1785, 1833, 1837, 1841], "menu": [1738, 1748, 1788], "merg": [2, 1736, 1747, 1767, 1786, 1788, 1814, 1824], "merge_stdsuit": 1788, "merz": [1692, 1752], "mess": 1838, "messag": [2, 266, 268, 269, 270, 271, 276, 277, 278, 279, 280, 285, 287, 313, 336, 338, 364, 383, 656, 679, 1206, 1704, 1738, 1746, 1748, 1750, 1767, 1785, 1788, 1809, 1828, 1844], "messagepack": [1738, 1767], "messi": 1767, "met": [106, 1079, 1086, 1219, 1704, 1743, 1771, 1838, 1841], "meta": [295, 318, 319, 400, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1703, 1714, 1757, 1766, 1800, 1838, 1841, 1842], "meta_cutoff": 80, "metadata": [1738, 1740, 1786, 1788, 1794, 1817], "metal": [685, 1206, 1704, 1714, 1757, 1837, 1838, 1842], "metameta": [1740, 1772, 1794], "metapackag": 1748, "meter": 1706, "methan": [1232, 1666, 1692, 1704, 1714, 1743, 1752, 1842, 1843], "method": [1, 2, 3, 5, 6, 7, 8, 9, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 26, 27, 29, 30, 61, 62, 64, 66, 68, 70, 73, 74, 75, 76, 77, 78, 80, 81, 84, 86, 87, 88, 89, 90, 91, 92, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 108, 110, 111, 112, 114, 115, 118, 119, 120, 128, 130, 131, 132, 133, 137, 138, 139, 140, 141, 143, 144, 145, 147, 148, 149, 150, 183, 184, 265, 266, 267, 268, 275, 284, 292, 295, 296, 300, 301, 302, 312, 314, 315, 316, 318, 319, 321, 322, 323, 324, 325, 326, 327, 329, 342, 343, 352, 373, 378, 381, 382, 391, 444, 446, 474, 482, 484, 521, 523, 545, 547, 579, 584, 586, 615, 635, 647, 652, 655, 662, 665, 666, 730, 739, 742, 762, 792, 811, 833, 858, 874, 897, 946, 949, 959, 960, 975, 1070, 1078, 1158, 1199, 1200, 1202, 1203, 1206, 1208, 1209, 1211, 1213, 1214, 1219, 1221, 1224, 1225, 1230, 1231, 1236, 1254, 1255, 1279, 1281, 1283, 1285, 1291, 1292, 1294, 1443, 1569, 1615, 1643, 1695, 1698, 1699, 1700, 1701, 1703, 1704, 1711, 1714, 1718, 1730, 1733, 1734, 1738, 1739, 1740, 1742, 1743, 1744, 1745, 1751, 1752, 1754, 1755, 1756, 1757, 1758, 1759, 1763, 1764, 1766, 1767, 1768, 1769, 1770, 1772, 1774, 1776, 1777, 1779, 1780, 1782, 1785, 1789, 1791, 1793, 1794, 1795, 1799, 1800, 1802, 1806, 1810, 1817, 1818, 1819, 1824, 1826, 1828, 1829, 1832, 1833, 1836, 1837, 1839, 1841, 1842, 1844], "method_str": 1794, "method_typ": 268, "methodnam": 1809, "methodologi": 1770, "methoxi": 1833, "methyl": [1714, 1757, 1770, 1802, 1833, 1842], "methylen": [1714, 1828, 1842, 1844], "methyloxiran": [1714, 1841, 1842], "methylthiophen": 1802, "metric": [75, 103, 1055, 1056, 1058, 1061, 1218, 1231, 1509, 1511, 1704, 1757, 1802, 1838, 1841], "metric_inv": 75, "mev": 1706, "mew": 1734, "mezei": [117, 664, 1061, 1206, 1218, 1704], "mg": [947, 1126, 1213, 1221, 1225, 1282, 1704, 1707, 1731, 1762, 1798], "mgga": [138, 1714, 1842], "mgga_ms0": [295, 318, 319, 1695, 1698, 1702, 1703, 1758, 1766, 1800], "mgga_ms1": [295, 318, 319, 1695, 1698, 1702, 1703, 1758, 1766, 1800], "mgga_ms2": [295, 318, 319, 1695, 1698, 1702, 1703, 1758, 1766, 1800], "mgga_ms2h": [295, 318, 319, 1695, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "mgga_mv": [295, 318, 319, 1695, 1698, 1702, 1703, 1758, 1766, 1800], "mgga_mv2h": [295, 318, 319, 1695, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "mgga_mvsh": [295, 318, 319, 1695, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "mhz": 1706, "mib": [374, 395, 1786, 1821, 1832], "micael": 1784, "micavx512": 1839, "michael": [0, 1, 106, 1754], "micro": [741, 1208, 1704, 1838], "microiter": [1231, 1644, 1645, 1646, 1647, 1704, 1753, 1838], "microscop": [368, 369], "mid": 1790, "midbond": [1692, 1714, 1752, 1837, 1842], "midwai": 1838, "might": [0, 150, 284, 605, 627, 786, 1125, 1206, 1210, 1221, 1704, 1737, 1740, 1753, 1754, 1755, 1767, 1770, 1771, 1789, 1817, 1821, 1828, 1829, 1833, 1837, 1844], "mih": [1224, 1683, 1792], "mikhalev": [1734, 1777, 1780], "mildli": 1786, "mileston": 1788, "miller": [635, 652, 1206, 1704], "millibohr": [634, 1206, 1704], "mimic": 334, "min": [1226, 1231, 1354, 1503, 1704, 1738, 1802], "min_": 1763, "min_ccd_diisvec": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "min_tim": [154, 155, 156, 157, 158, 159], "min_width": [313, 364], "minao": [1063, 1218, 1704, 1707, 1731], "minao_basi": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mind": [1737, 1738, 1786, 1788, 1802, 1810, 1828, 1844], "mindepth": 1786, "minessota": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "mini": 1738, "miniconda": [1736, 1737, 1738, 1746, 1749, 1759, 1762, 1765, 1767, 1773, 1774, 1775, 1782, 1783, 1784, 1788, 1803, 1806, 1807, 1839], "miniconda2": 1748, "miniconda3": 1748, "minim": [150, 295, 313, 318, 319, 364, 510, 635, 652, 1201, 1206, 1695, 1698, 1700, 1703, 1704, 1714, 1734, 1737, 1738, 1743, 1748, 1752, 1754, 1756, 1758, 1760, 1762, 1763, 1766, 1767, 1776, 1790, 1798, 1800, 1802, 1828, 1829, 1837, 1842, 1844], "minima": [635, 652, 1206, 1231, 1538, 1704, 1790], "minimum": [282, 284, 332, 496, 635, 652, 735, 815, 841, 903, 904, 912, 1200, 1206, 1208, 1210, 1212, 1213, 1225, 1226, 1228, 1230, 1231, 1251, 1354, 1363, 1382, 1455, 1458, 1462, 1478, 1517, 1548, 1550, 1602, 1646, 1704, 1740, 1742, 1743, 1749, 1756, 1757, 1761, 1768, 1783, 1785, 1788, 1802, 1832, 1835, 1837, 1838], "minimz": 1817, "mininum": [415, 740, 905, 1053, 1198, 1208, 1212, 1218, 1224, 1234, 1704], "minix": [1694, 1707, 1731, 1732, 1774], "minnesota": [295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "minor": [279, 1770], "mint": [400, 1704, 1705, 1714, 1738, 1785, 1786, 1788, 1842], "mints1": [1714, 1833, 1842], "mints10": [1714, 1842], "mints12": [1714, 1842], "mints13": 1726, "mints14": 1726, "mints15": [1714, 1842], "mints2": [283, 333, 1714, 1726, 1730, 1842], "mints3": [100, 1714, 1842], "mints4": [1714, 1833, 1842], "mints5": [1711, 1714, 1743, 1842], "mints6": [1714, 1833, 1842], "mints8": [1714, 1842], "mints9": [283, 333, 1714, 1726, 1842], "mintshelp": [14, 128, 130, 145, 150, 295, 1714, 1766, 1801, 1809, 1827, 1842], "mintz": 1781, "minu": [1126, 1221, 1704, 1843], "minut": [2, 1736, 1764, 1767], "miracl": 1743, "mirror": [87, 106, 1788, 1833], "misc": [1692, 1752, 1780, 1787], "miscellan": [1767, 1777, 1819, 1827], "misformat": [374, 395], "misha": 1738, "misiewicz": [1734, 1781], "mismatch": 1821, "misquitta": [1734, 1837], "miss": [1730, 1738, 1770, 1771, 1817, 1829, 1833, 1837], "missing_enabled_return": [106, 1768], "missing_enabled_return_efp": [106, 1768], "missing_enabled_return_qm": [106, 1768], "missingmethoderror": 1827, "mitrushenkov": [811, 833, 1210, 1704, 1755], "mix": [0, 1, 2, 103, 284, 615, 729, 792, 860, 957, 1206, 1208, 1213, 1225, 1229, 1231, 1289, 1405, 1499, 1564, 1692, 1694, 1704, 1706, 1707, 1714, 1722, 1731, 1732, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "mixed4": [0, 1, 2, 875, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mixedcas": 1835, "mixtur": [380, 1730, 1768, 1798, 1817, 1833, 1838, 1844], "mk": [295, 653, 1206, 1229, 1398, 1704, 1714, 1766, 1777, 1790, 1842], "mkdir": [1735, 1767], "mkl": [1738, 1748, 1756, 1767, 1771], "mkl_num_thread": 1767, "mkl_root": 1738, "mklvar": 1738, "mm": [1228, 1378, 1382, 1704, 1749, 1776, 1790], "mn": [1707, 1731], "mn12": [295, 318, 319, 1695, 1697, 1698, 1700, 1701, 1702, 1703, 1758, 1766, 1800], "mn15": [295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "mo": [2, 99, 103, 115, 130, 150, 286, 314, 337, 430, 440, 457, 461, 497, 562, 566, 568, 601, 727, 926, 946, 947, 1145, 1175, 1186, 1199, 1200, 1204, 1205, 1206, 1208, 1213, 1221, 1222, 1225, 1270, 1279, 1281, 1282, 1704, 1706, 1707, 1708, 1714, 1731, 1742, 1763, 1781, 1785, 1791, 1798, 1808, 1810, 1829, 1838, 1841, 1842], "mo_diis_num_vec": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mo_elec_dip_deriv1": 103, "mo_erf_eri": 103, "mo_eri": 103, "mo_ext": [111, 150, 1799], "mo_f12": 103, "mo_f12_double_commut": 103, "mo_f12_squar": 103, "mo_f12g12": 103, "mo_maxit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mo_oei_deriv1": 103, "mo_oei_deriv2": 103, "mo_overlap_half_deriv1": 103, "mo_read": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mo_spin_eri": 103, "mo_step_max": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mo_tei_deriv1": 103, "mo_tei_deriv2": 103, "mo_transform": 103, "mo_writ": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mo_x_unit": 1706, "moabcd": [621, 680, 1206, 1704], "mode": [2, 153, 267, 282, 283, 292, 300, 301, 302, 332, 333, 343, 384, 386, 388, 399, 570, 590, 603, 611, 616, 632, 633, 634, 652, 656, 707, 1027, 1206, 1217, 1226, 1231, 1313, 1316, 1500, 1620, 1704, 1738, 1743, 1750, 1752, 1759, 1767, 1777, 1779, 1800, 1803, 1828, 1831, 1832, 1840, 1844], "model": [2, 265, 268, 284, 295, 322, 325, 532, 540, 555, 766, 769, 1202, 1203, 1209, 1226, 1227, 1228, 1338, 1342, 1672, 1686, 1687, 1695, 1697, 1698, 1700, 1701, 1704, 1714, 1734, 1738, 1740, 1742, 1743, 1752, 1755, 1757, 1758, 1759, 1764, 1766, 1767, 1768, 1772, 1776, 1780, 1781, 1782, 1790, 1794, 1802, 1804, 1808, 1824, 1827, 1842], "modelchem": 1794, "modern": [1231, 1629, 1704, 1734, 1757, 1817, 1821], "modest": [667, 1206, 1704, 1763, 1837], "modhuckel": [1231, 1563, 1704, 1838], "modif": [0, 2, 265, 329, 664, 1206, 1704, 1740, 1747, 1760, 1767, 1771, 1794, 1823, 1824, 1831, 1838], "modifi": [329, 351, 377, 539, 609, 761, 774, 1203, 1206, 1209, 1225, 1231, 1279, 1555, 1704, 1710, 1738, 1742, 1743, 1747, 1754, 1757, 1759, 1767, 1776, 1783, 1784, 1798, 1804, 1819, 1828, 1836, 1837, 1838, 1844], "moduel": 1767, "modul": [0, 1, 2, 11, 114, 150, 188, 195, 197, 200, 208, 209, 210, 213, 219, 220, 226, 227, 228, 235, 236, 246, 248, 249, 260, 261, 267, 268, 272, 295, 296, 326, 327, 350, 355, 358, 370, 372, 375, 380, 381, 382, 396, 400, 561, 586, 699, 1078, 1105, 1106, 1107, 1117, 1146, 1147, 1151, 1152, 1158, 1204, 1206, 1219, 1221, 1230, 1463, 1475, 1704, 1711, 1714, 1727, 1730, 1733, 1736, 1740, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1790, 1791, 1792, 1794, 1795, 1797, 1799, 1800, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1815, 1816, 1817, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1829, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "modular": 1819, "module__keyword": 371, "module_nam": [376, 397, 1767], "modulenotfounderror": [1736, 1767], "moduletyp": 358, "mofa": 130, "mofb": 130, "mofeff": 130, "mograd_damp": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mohlyp": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "mohlyp2": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "moieti": 1770, "moint": [621, 641, 668, 680, 682, 1206, 1704], "mointegr": 1808, "mol": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1828, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "mol1": [1692, 1752, 1833], "mol2": [106, 1833], "mol22": [1692, 1752], "molar": [368, 369, 1706], "molar_gas_const": 1706, "molar_mass_const": 1706, "molar_mass_of_carbon_12": 1706, "molar_planck_const": 1706, "molar_planck_constant_times_c": 1706, "molar_volume_of_ideal_gas_27315_k_100_kpa": 1706, "molar_volume_of_ideal_gas_27315_k_101325_kpa": 1706, "molar_volume_of_silicon": 1706, "molden": [2, 104, 150, 287, 338, 388, 424, 934, 995, 1027, 1145, 1170, 1198, 1213, 1215, 1217, 1221, 1231, 1578, 1704, 1746, 1777, 1780, 1823, 1832], "molden1": [1714, 1842], "molden2": [1714, 1842], "molden_format": [2, 287, 338, 388], "molden_normal_mod": [1027, 1217, 1704, 1772], "molden_with_virtu": [0, 1, 2, 150, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "molden_writ": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "moldenwrit": 1827, "moldomain": 1722, "molecul": [0, 2, 8, 29, 68, 73, 76, 100, 150, 191, 240, 243, 265, 267, 275, 281, 283, 284, 288, 289, 291, 293, 295, 296, 297, 300, 301, 302, 303, 304, 308, 312, 314, 315, 316, 317, 318, 319, 323, 333, 339, 340, 341, 347, 350, 351, 352, 356, 365, 378, 380, 381, 382, 387, 390, 399, 573, 587, 592, 616, 654, 660, 695, 705, 771, 781, 934, 1025, 1026, 1027, 1048, 1130, 1150, 1206, 1209, 1210, 1213, 1217, 1218, 1221, 1226, 1231, 1232, 1313, 1578, 1620, 1666, 1673, 1692, 1704, 1711, 1714, 1722, 1723, 1726, 1727, 1730, 1734, 1735, 1738, 1739, 1740, 1742, 1743, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1761, 1762, 1763, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1774, 1775, 1777, 1780, 1781, 1785, 1789, 1791, 1792, 1794, 1796, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1809, 1826, 1827, 1828, 1829, 1831, 1836, 1837, 1838, 1841, 1842, 1843, 1844], "molecular": [2, 103, 106, 150, 568, 575, 587, 601, 608, 619, 641, 664, 669, 705, 1206, 1223, 1229, 1230, 1231, 1400, 1437, 1594, 1630, 1704, 1734, 1735, 1738, 1749, 1750, 1752, 1753, 1754, 1757, 1759, 1763, 1767, 1768, 1770, 1776, 1781, 1782, 1783, 1785, 1789, 1790, 1794, 1795, 1798, 1799, 1802, 1803, 1810, 1823, 1824, 1828, 1833, 1835, 1837, 1838, 1841, 1844], "molecular_charg": [106, 1768], "molecular_mass": 390, "molecular_multipl": [106, 1768], "moleculargrid": [29, 1827], "molecule_nam": 205, "molinit": 1768, "molinst": 106, "moller": [957, 1213, 1225, 1289, 1704], "molpars": 1833, "molpro": [1226, 1324, 1704, 1717, 1802], "molrec": 106, "mols_align": 106, "molschema": 106, "molssi": [312, 372, 1738, 1833], "molstr": 106, "molutil": 106, "mom": [84, 1231, 1579, 1580, 1581, 1704, 1706, 1714, 1838, 1842], "mom_excited_": 84, "mom_occ": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mom_performed_": 84, "mom_start": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mom_vir": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "moment": [0, 103, 317, 365, 368, 369, 377, 608, 610, 615, 669, 817, 1078, 1139, 1206, 1210, 1219, 1221, 1228, 1231, 1380, 1384, 1385, 1387, 1389, 1391, 1657, 1704, 1714, 1724, 1743, 1749, 1753, 1755, 1757, 1763, 1764, 1770, 1771, 1776, 1798, 1799, 1817, 1838, 1841, 1842], "momenta": 1733, "momentum": [2, 4, 8, 81, 89, 103, 285, 310, 336, 361, 1157, 1221, 1704, 1710, 1714, 1730, 1736, 1754, 1767, 1783, 1810, 1817, 1842], "momom": 1711, "mon": 1708, "monitor": [1743, 1788, 1802], "monkhorst": [1734, 1829], "mono": [1752, 1782], "monoa": 1752, "monoa_wfn": 237, "monoatom": 1782, "monob": 1752, "monob_wfn": 237, "monom": [75, 804, 1210, 1230, 1437, 1473, 1474, 1704, 1711, 1714, 1752, 1770, 1776, 1790, 1794, 1806, 1828, 1835, 1842, 1844], "monomera": 1837, "monomerb": 1837, "montag": 1750, "month": [1730, 1733, 1804], "more": [0, 1, 2, 106, 138, 150, 195, 197, 284, 285, 295, 303, 314, 318, 319, 336, 476, 550, 569, 589, 593, 644, 666, 671, 726, 765, 794, 875, 1097, 1125, 1153, 1200, 1203, 1206, 1208, 1209, 1210, 1220, 1221, 1222, 1224, 1226, 1230, 1231, 1236, 1305, 1443, 1549, 1681, 1682, 1695, 1698, 1699, 1703, 1704, 1708, 1714, 1730, 1738, 1740, 1742, 1743, 1748, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1763, 1766, 1767, 1770, 1771, 1774, 1775, 1781, 1782, 1783, 1785, 1786, 1788, 1791, 1792, 1794, 1795, 1800, 1802, 1803, 1804, 1806, 1810, 1817, 1819, 1821, 1822, 1828, 1829, 1832, 1833, 1835, 1837, 1838, 1842, 1844], "moread": [638, 1206, 1704], "morel": [1734, 1750], "moreov": [573, 616, 647, 1206, 1704, 1759, 1798, 1810, 1817], "morph": [1230, 1476, 1704], "mors": [635, 652, 1206, 1704], "mospac": [90, 1827], "most": [0, 1, 2, 150, 159, 295, 314, 393, 601, 660, 697, 811, 1206, 1210, 1230, 1231, 1444, 1690, 1704, 1730, 1733, 1738, 1739, 1740, 1742, 1743, 1753, 1755, 1756, 1757, 1764, 1766, 1767, 1770, 1771, 1772, 1776, 1781, 1789, 1790, 1791, 1792, 1793, 1798, 1800, 1801, 1802, 1809, 1810, 1817, 1823, 1824, 1828, 1829, 1832, 1833, 1834, 1837, 1838, 1841, 1843, 1844], "mostli": [1692, 1714, 1738, 1752, 1757, 1785, 1842], "moszynski": [1734, 1781, 1828, 1837, 1844], "motif": 1770, "motion": [162, 295, 318, 319, 381, 382, 603, 1200, 1206, 1704, 1755, 1766, 1800, 1826], "motiv": [1757, 1817, 1824], "move": [106, 288, 289, 339, 340, 1736, 1737, 1738, 1748, 1767, 1786, 1808, 1823, 1835, 1838], "move_atom": 8, "move_to_com": 106, "movement": 1797, "mowrit": 1827, "moxi": 1841, "mp": [0, 284, 295, 318, 319, 381, 382, 862, 864, 996, 1210, 1215, 1695, 1696, 1698, 1700, 1704, 1714, 1739, 1740, 1743, 1744, 1745, 1746, 1758, 1766, 1771, 1776, 1781, 1800, 1826, 1842], "mp10": 1755, "mp2": [0, 2, 76, 95, 138, 178, 265, 284, 286, 294, 295, 296, 300, 301, 302, 303, 318, 319, 337, 345, 381, 382, 446, 448, 449, 450, 453, 459, 460, 484, 568, 694, 731, 792, 851, 899, 902, 917, 935, 936, 937, 938, 939, 963, 964, 966, 971, 972, 976, 1081, 1082, 1083, 1084, 1085, 1089, 1094, 1146, 1147, 1199, 1200, 1204, 1206, 1208, 1210, 1212, 1213, 1214, 1219, 1221, 1225, 1229, 1230, 1254, 1255, 1402, 1418, 1459, 1461, 1462, 1475, 1481, 1669, 1670, 1671, 1674, 1675, 1676, 1680, 1683, 1684, 1688, 1689, 1694, 1704, 1711, 1714, 1725, 1727, 1728, 1730, 1732, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1752, 1755, 1757, 1766, 1768, 1769, 1771, 1772, 1775, 1776, 1777, 1780, 1781, 1790, 1794, 1798, 1800, 1801, 1802, 1809, 1826, 1828, 1832, 1834, 1838, 1842, 1844], "mp2_amp_typ": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mp2_amps_print": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mp2_ccsd": [1229, 1417, 1704], "mp2_ccsd_method": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mp2_dft": 1757, "mp2_guess": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mp2_os_scal": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mp2_scale_o": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mp2_scale_ss": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mp2_sos_scal": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mp2_sos_scale2": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mp2_ss_scale": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mp2_type": [0, 1, 2, 381, 382, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mp2d": [267, 295, 1695, 1696, 1698, 1700, 1738, 1758, 1759, 1766], "mp2fit": [1756, 1838], "mp2mp2": [295, 1695, 1696, 1698, 1700, 1758, 1766], "mp2p5": [1714, 1842], "mp2p75_corl": 1743, "mp3": [0, 284, 295, 307, 318, 319, 1090, 1147, 1219, 1221, 1670, 1675, 1680, 1684, 1704, 1711, 1714, 1739, 1740, 1743, 1744, 1745, 1766, 1771, 1772, 1776, 1779, 1781, 1798, 1800, 1809, 1834, 1842], "mp4": [190, 284, 295, 318, 319, 664, 665, 1073, 1091, 1147, 1206, 1219, 1221, 1670, 1680, 1704, 1711, 1739, 1740, 1743, 1744, 1745, 1766, 1776, 1777, 1781, 1790, 1800], "mp5": [318, 319, 1800], "mp7": [295, 1766], "mp_type": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mpcc": 1738, "mpfr": 1738, "mpi": [1231, 1634, 1704], "mpl": 106, "mpn": [0, 1, 2, 295, 862, 1147, 1213, 1221, 1225, 1673, 1675, 1684, 1704, 1714, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "mpn_order_sav": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mpn_schmidt": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mpn_wigner": [0, 1, 2, 862, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mpqc": 100, "mpw1b95": [295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "mpw1k": [295, 318, 319, 1695, 1698, 1700, 1703, 1758, 1766, 1800], "mpw1lyp": [295, 318, 319, 1695, 1697, 1698, 1700, 1703, 1758, 1766, 1800], "mpw1pbe": [295, 318, 319, 1695, 1698, 1700, 1703, 1758, 1766, 1800], "mpw1pw": [295, 318, 319, 1695, 1697, 1698, 1700, 1703, 1758, 1766, 1800], "mpw3lyp": [295, 318, 319, 1695, 1698, 1700, 1703, 1758, 1766, 1800], "mpw3pw": [295, 318, 319, 1695, 1698, 1700, 1703, 1758, 1766, 1800], "mpwb1k": [295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "mpwlyp1m": [295, 318, 319, 1695, 1698, 1700, 1703, 1758, 1766, 1800], "mpwlyp1w": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "mpwpw": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "mr": [653, 1206, 1704, 1792], "mrcc": [216, 217, 295, 400, 586, 612, 642, 653, 1158, 1206, 1221, 1229, 1240, 1398, 1688, 1704, 1705, 1709, 1738, 1739, 1740, 1742, 1755, 1766, 1767, 1776, 1777, 1780, 1790, 1793, 1842], "mrcc_level": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mrcc_method": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mrcc_num_doublet_root": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mrcc_num_singlet_root": [0, 1, 2, 1239, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mrcc_num_triplet_root": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mrcc_omp_num_thread": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mrcc_restart": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mrccsd": [284, 1714, 1740, 1781, 1829, 1842], "mrccsdt": [284, 1229, 1403, 1704, 1740, 1781, 1792], "mrpt": [1688, 1776], "mrpt2": [1714, 1781, 1829, 1842], "ms0": [0, 1, 2, 833, 884, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ms2": [2, 286, 298, 337, 348], "msd": [943, 1213, 1225, 1279, 1704, 1798], "msg": [269, 271, 278, 280], "msgpack": 1738, "msie": 1757, "msvp": [1694, 1707, 1731, 1732, 1733, 1774], "mtd": [1685, 1714, 1776, 1809, 1842], "mtd_typd": 1809, "mtd_type": 1809, "mtdimer": 1802, "mtol": [106, 1768], "mtzvp": [1694, 1707, 1731, 1732, 1733, 1774], "mtzvpp": [1694, 1707, 1731, 1732, 1733, 1774], "mu": [377, 386, 1750, 1757, 1772, 1829, 1836, 1838, 1841], "mu_": 1841, "mu_1": 1829, "mu_2": 1829, "much": [2, 106, 138, 150, 279, 314, 386, 647, 1206, 1230, 1231, 1455, 1556, 1704, 1738, 1743, 1754, 1755, 1756, 1757, 1759, 1763, 1764, 1770, 1771, 1772, 1774, 1786, 1791, 1795, 1804, 1809, 1810, 1817, 1821, 1824, 1828, 1833, 1837, 1838, 1844], "mukherje": [295, 653, 1206, 1704, 1734, 1766, 1829], "muller": [1734, 1774], "mulliken": [106, 983, 1214, 1685, 1704, 1759, 1774, 1776, 1799], "mulliken_charg": [111, 1799], "mult": [106, 1743], "multi": [381, 382, 1210, 1226, 1313, 1673, 1704, 1714, 1755, 1767, 1776, 1777, 1785, 1790, 1794, 1826, 1829, 1833, 1838, 1842], "multiarch": [1748, 1788], "multiconfigur": [295, 1766, 1776, 1829], "multidimension": 1810, "multiexp": [1231, 1534, 1704], "multilevel": [1714, 1794, 1842], "multilin": [313, 364, 366, 379], "multipass": [575, 1206, 1704], "multipl": [2, 8, 100, 106, 182, 259, 327, 335, 390, 575, 620, 654, 837, 884, 997, 1206, 1210, 1215, 1229, 1401, 1704, 1714, 1730, 1738, 1739, 1743, 1746, 1748, 1750, 1756, 1767, 1768, 1770, 1779, 1781, 1782, 1785, 1790, 1794, 1797, 1799, 1801, 1805, 1809, 1810, 1817, 1828, 1829, 1832, 1835, 1838, 1842, 1844], "multiplet": 1837, "multipli": [13, 100, 259, 575, 835, 1202, 1206, 1210, 1704, 1801, 1828, 1844], "multipol": [89, 103, 107, 150, 255, 262, 263, 367, 762, 764, 1097, 1099, 1209, 1220, 1228, 1386, 1388, 1395, 1681, 1704, 1714, 1719, 1738, 1754, 1776, 1777, 1780, 1799, 1817, 1842], "multipole_grad": 103, "multipoleint": [1817, 1827], "multipolepotentialint": 1817, "multipolesymmetri": 1827, "multirefer": [232, 295, 393, 1222, 1229, 1682, 1688, 1756, 1766, 1776, 1781, 1812, 1829, 1838], "multiroot": [655, 1206, 1704], "multistag": [284, 300, 301, 302, 318, 319, 1740, 1772, 1800], "multithread": 1738, "multp": 1785, "muon": 1706, "muon_compton_wavelength": 1706, "muon_compton_wavelength_over_2_pi": 1706, "muon_electron_mass_ratio": 1706, "muon_g_factor": 1706, "muon_mag_mom": 1706, "muon_mag_mom_anomali": 1706, "muon_mag_mom_to_bohr_magneton_ratio": 1706, "muon_mag_mom_to_nuclear_magneton_ratio": 1706, "muon_mass": 1706, "muon_mass_energy_equival": 1706, "muon_mass_energy_equivalent_in_mev": 1706, "muon_mass_in_u": 1706, "muon_molar_mass": 1706, "muon_neutron_mass_ratio": 1706, "muon_proton_mag_mom_ratio": 1706, "muon_proton_mass_ratio": 1706, "muon_tau_mass_ratio": 1706, "mura": [1231, 1534, 1633, 1704, 1838], "must": [2, 100, 106, 150, 267, 303, 314, 335, 342, 356, 383, 389, 399, 550, 569, 573, 577, 593, 601, 614, 622, 637, 660, 665, 681, 690, 694, 709, 711, 712, 830, 861, 1203, 1206, 1210, 1224, 1229, 1238, 1401, 1704, 1714, 1730, 1735, 1738, 1740, 1742, 1743, 1748, 1750, 1752, 1753, 1755, 1757, 1759, 1767, 1774, 1775, 1782, 1788, 1791, 1792, 1794, 1795, 1796, 1799, 1801, 1808, 1809, 1810, 1817, 1828, 1829, 1832, 1833, 1835, 1838, 1842], "muster_modelchem": 1743, "muster_psi4opt": 1743, "muto": 1759, "mv": [288, 289, 339, 340], "mvd1": [677, 1206, 1704], "mvd2": [677, 1206, 1704], "mvg": [1669, 1776], "mx": [1692, 1752], "my": 1737, "my_mo": 1838, "my_pbe0": 1757, "my_str": 1802, "my_unique_nam": 1757, "my_wfn": [1767, 1838], "myba": 1730, "mycalc": [150, 296, 314, 1769, 1791, 1832], "mymodul": 1801, "mymodule__data_fil": 1801, "mymol": 1796, "myplugin": 1808, "myscratch": 1767, "myself": 1737, "myxtplfn_2": [295, 318, 319, 1766, 1800], "m\u00f8ller": 1806, "n": [0, 2, 20, 64, 82, 86, 92, 100, 103, 106, 139, 150, 215, 265, 284, 295, 303, 314, 323, 329, 342, 352, 356, 368, 369, 377, 574, 582, 586, 588, 594, 606, 611, 612, 614, 632, 645, 659, 661, 665, 681, 684, 710, 808, 811, 833, 864, 979, 1147, 1206, 1210, 1214, 1221, 1224, 1226, 1231, 1240, 1323, 1490, 1568, 1668, 1669, 1673, 1675, 1683, 1684, 1685, 1690, 1692, 1704, 1706, 1707, 1714, 1731, 1733, 1734, 1737, 1738, 1739, 1740, 1742, 1743, 1748, 1749, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1763, 1764, 1766, 1767, 1768, 1771, 1775, 1776, 1781, 1785, 1786, 1788, 1791, 1792, 1794, 1798, 1799, 1802, 1803, 1805, 1806, 1810, 1817, 1828, 1829, 1833, 1834, 1836, 1838, 1841, 1842, 1844], "n0": [295, 1766], "n1": [621, 1100, 1206, 1220, 1704, 1775], "n12": [295, 318, 319, 1695, 1697, 1698, 1699, 1700, 1701, 1703, 1758, 1766, 1800], "n2": [621, 1100, 1206, 1220, 1692, 1704, 1712, 1714, 1729, 1752, 1775, 1788, 1842], "n3": [621, 1100, 1206, 1220, 1704, 1775], "n4": [621, 1206, 1704, 1767], "n5": [621, 1206, 1704], "n_": [368, 369, 377, 1759, 1776], "n_atom": 110, "n_data": 110, "n_ecp_cor": 8, "n_ecp_shell_on_cent": 8, "n_frozen_cor": 8, "n_guess": [1, 404, 1197, 1704], "n_pair": 1817, "n_point": 110, "n_site": 103, "na": [1692, 1706, 1707, 1731, 1752], "nabla": [89, 103, 109, 1757, 1817, 1838], "nabla_i": 1838, "nablaint": [1817, 1827], "nacl": [1714, 1842], "nact": 1746, "nacv": [655, 1206, 1704], "naiv": [1231, 1518, 1528, 1704, 1740, 1753, 1757], "nallatom": 106, "nalpha": [11, 150, 1810, 1838], "nalphapi": 150, "name": [0, 2, 8, 16, 27, 62, 63, 64, 68, 73, 79, 80, 82, 83, 84, 88, 92, 96, 100, 101, 106, 111, 115, 122, 126, 135, 138, 148, 150, 202, 221, 222, 223, 225, 226, 252, 265, 267, 268, 283, 284, 288, 289, 290, 292, 295, 296, 297, 298, 300, 301, 302, 304, 306, 307, 314, 315, 316, 318, 319, 320, 326, 331, 333, 339, 340, 343, 346, 347, 348, 350, 355, 358, 371, 372, 373, 381, 382, 391, 392, 393, 394, 679, 934, 993, 1025, 1026, 1027, 1206, 1213, 1215, 1217, 1225, 1227, 1228, 1231, 1254, 1255, 1283, 1294, 1377, 1393, 1578, 1584, 1692, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1709, 1730, 1736, 1739, 1740, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1752, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1764, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1774, 1775, 1776, 1781, 1782, 1787, 1788, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1808, 1809, 1812, 1814, 1822, 1823, 1826, 1828, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1841, 1844], "name_frag": 2, "name_hint": [267, 1759], "namedtupl": 106, "namelist": [599, 1206, 1704], "namespac": [86, 288, 289, 339, 340, 354, 1785, 1808, 1810, 1828, 1844], "nan": [2, 1714, 1757, 1842], "nanohartre": 1838, "nanomet": 377, "nao": [8, 1810], "napthalen": [1692, 1752], "narr": [1738, 1743, 1764], "narrow": [377, 1714, 1742, 1842], "nascimento": 1734, "nat": [106, 267, 386, 387, 388, 389, 399, 1759, 1774, 1776, 1794], "nat_orb": [0, 1, 2, 1084, 1085, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "nat_orbs_t2": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "nat_orbs_t3": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "nat_orbs_v4": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "national_schem": 1750, "nativ": [8, 318, 319, 1722, 1737, 1738, 1748, 1752, 1766, 1772, 1781, 1782, 1797, 1800, 1801, 1802], "native_fil": [265, 1740, 1794], "nativefilesprotocolenum": [265, 1740, 1794], "natom": [100, 103, 106, 1226, 1336, 1704, 1752, 1799, 1802, 1833], "natur": [106, 150, 255, 262, 263, 295, 314, 367, 424, 675, 851, 866, 940, 1000, 1065, 1198, 1206, 1210, 1213, 1215, 1219, 1225, 1230, 1276, 1459, 1460, 1461, 1462, 1704, 1706, 1712, 1714, 1738, 1743, 1746, 1766, 1777, 1781, 1785, 1790, 1791, 1794, 1798, 1799, 1808, 1809, 1824, 1828, 1838, 1841, 1842, 1844], "natural_unit_of_act": 1706, "natural_unit_of_action_in_ev_": 1706, "natural_unit_of_energi": 1706, "natural_unit_of_energy_in_mev": 1706, "natural_unit_of_length": 1706, "natural_unit_of_mass": 1706, "natural_unit_of_momum": 1706, "natural_unit_of_momum_in_mevpc": 1706, "natural_unit_of_tim": 1706, "natural_unit_of_veloc": 1706, "naux": [1675, 1680, 1776], "navig": [1737, 1738, 1788, 1824], "nb": [430, 1199, 1704, 1707, 1731, 1794], "nbasi": 1740, "nbc1": 1743, "nbc10": [1743, 1832, 1835], "nbc100": [1692, 1752], "nbc10a": [1692, 1752], "nbeta": [150, 1810, 1838], "nbetapi": 150, "nbf": [2, 8, 103, 1810], "nblock": 147, "nbo": [150, 1714, 1842], "nbodi": [1714, 1715, 1740, 1743, 1776, 1794, 1831, 1832, 1842, 1844], "nbodies_per_mc_level": 1794, "nbody_level": 1794, "nbody_list": 1794, "nbody_result": 1794, "nbsphinx": 1738, "ncart": 1810, "ncartesian": 81, "ncb31": 1832, "ncbi": 1734, "ncc": [586, 1206, 1704], "nccl": [1231, 1634, 1704], "ncd": 16, "ncenter": 81, "nch": [1714, 1842], "nconda": 1748, "ncprec": 389, "nctu": [2, 285, 296, 336, 1769], "ndarrai": [2, 8, 64, 100, 106, 147, 148, 150, 255, 262, 263, 277, 322, 324, 325, 331, 334, 342, 356, 367, 377, 385, 386, 387, 388, 390, 399, 1740, 1759, 1772, 1774, 1797], "ndb_rgt": 1752, "ndb_rxn": 1752, "ndet": 13, "ndocc": 1838, "ndof": [386, 1772], "ndoub": [1224, 1237, 1704], "ne": [11, 295, 1692, 1707, 1714, 1731, 1743, 1752, 1759, 1763, 1766, 1774, 1828, 1842, 1844], "ne2": [1714, 1828, 1842, 1844], "ne2_geometri": 1828, "ne3": 1759, "nearbi": [1226, 1298, 1704], "nearest": [1776, 1796, 1802], "nearli": 1810, "neatli": 1801, "neccesari": [1829, 1832], "necessari": [2, 86, 430, 935, 1199, 1205, 1213, 1226, 1306, 1704, 1730, 1733, 1738, 1743, 1753, 1755, 1764, 1767, 1779, 1780, 1781, 1788, 1794, 1802, 1808, 1809, 1834, 1835, 1838], "necessarili": [267, 1748, 1755, 1759, 1763, 1781, 1788, 1835], "neck": 1781, "need": [0, 1, 2, 84, 103, 138, 258, 284, 314, 342, 352, 393, 574, 599, 616, 626, 628, 658, 680, 682, 761, 774, 921, 922, 1202, 1206, 1209, 1213, 1229, 1230, 1409, 1464, 1465, 1466, 1704, 1708, 1714, 1730, 1735, 1736, 1737, 1738, 1740, 1743, 1747, 1748, 1750, 1753, 1754, 1757, 1759, 1761, 1763, 1764, 1767, 1770, 1771, 1772, 1776, 1780, 1785, 1786, 1788, 1791, 1797, 1798, 1800, 1801, 1802, 1804, 1808, 1809, 1815, 1817, 1819, 1821, 1822, 1828, 1829, 1832, 1833, 1835, 1836, 1837, 1838, 1841, 1842, 1844], "needn": [1739, 1785], "needs_exchang": [89, 1817], "needs_grac": 138, "needs_vv10": 138, "needs_xc": 138, "nees": [1734, 1838], "neg": [0, 1, 374, 385, 388, 395, 404, 407, 408, 601, 640, 656, 1197, 1206, 1231, 1520, 1704, 1795, 1796, 1801, 1817, 1828, 1836, 1838, 1844], "negat": 1743, "neglect": [415, 446, 484, 608, 710, 740, 905, 1053, 1198, 1199, 1200, 1206, 1208, 1212, 1218, 1224, 1230, 1231, 1234, 1455, 1569, 1704, 1759, 1763, 1789, 1837], "neglig": [608, 1206, 1704, 1757, 1798, 1817, 1832, 1837, 1838], "negoti": [195, 197], "neighbor": [1228, 1379, 1704, 1749], "neither": [2, 1730, 1736, 1737, 1738, 1748, 1776, 1786], "nekr": [1692, 1752], "nelec": [2, 11, 286, 298, 337, 348, 1810], "nene": [1692, 1752, 1759, 1774], "neoformat": 1747, "neon": [1692, 1738, 1752, 1759, 1828, 1832, 1844], "neq": 1759, "nervou": 1786, "ness": [8, 1714, 1738, 1748, 1842], "nest": [2, 300, 301, 302, 318, 319, 370, 1752, 1767, 1772, 1776, 1800], "net": 1738, "netherland": 1791, "netlib": 1738, "netlifi": [1748, 1788], "network": [1738, 1748, 1767, 1777, 1780], "networkx": 1738, "neugebau": 1734, "neuhaus": 1734, "neural": 1806, "neutral": [1714, 1757, 1768, 1770, 1828, 1833, 1837, 1838, 1842, 1844], "neutral_guess": 1768, "neutron": 1706, "neutron_compton_wavelength": 1706, "neutron_compton_wavelength_over_2_pi": 1706, "neutron_electron_mag_mom_ratio": 1706, "neutron_electron_mass_ratio": 1706, "neutron_g_factor": 1706, "neutron_gyromag_ratio": 1706, "neutron_gyromag_ratio_over_2_pi": 1706, "neutron_mag_mom": 1706, "neutron_mag_mom_to_bohr_magneton_ratio": 1706, "neutron_mag_mom_to_nuclear_magneton_ratio": 1706, "neutron_mass": 1706, "neutron_mass_energy_equival": 1706, "neutron_mass_energy_equivalent_in_mev": 1706, "neutron_mass_in_u": 1706, "neutron_molar_mass": 1706, "neutron_muon_mass_ratio": 1706, "neutron_proton_mag_mom_ratio": 1706, "neutron_proton_mass_differ": 1706, "neutron_proton_mass_difference_energy_equival": 1706, "neutron_proton_mass_difference_energy_equivalent_in_mev": 1706, "neutron_proton_mass_difference_in_u": 1706, "neutron_proton_mass_ratio": 1706, "neutron_tau_mass_ratio": 1706, "neutron_to_shielded_proton_mag_mom_ratio": 1706, "never": [611, 1206, 1226, 1323, 1704, 1738, 1743, 1786, 1788, 1802, 1808, 1809], "nevertheless": [1764, 1822, 1829], "new": [2, 14, 64, 84, 86, 88, 96, 100, 101, 106, 115, 128, 130, 145, 148, 150, 240, 259, 279, 329, 331, 346, 428, 451, 465, 486, 512, 535, 685, 1101, 1199, 1200, 1202, 1203, 1206, 1220, 1669, 1704, 1714, 1715, 1724, 1730, 1734, 1736, 1737, 1738, 1740, 1743, 1747, 1748, 1757, 1759, 1764, 1767, 1770, 1775, 1776, 1777, 1781, 1782, 1783, 1785, 1786, 1787, 1794, 1797, 1798, 1801, 1809, 1810, 1814, 1818, 1824, 1828, 1833, 1834, 1835, 1838, 1841, 1842, 1844], "new_basis_nam": 1730, "new_charg": 1805, "new_civector": 13, "new_mat": 1797, "new_multipl": 1805, "new_tripl": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "new_vec": 1797, "new_vector": 329, "new_x_k": 329, "newer": [1759, 1774, 1786, 1802, 1817, 1828, 1838], "newest": [1748, 1774, 1828], "newfangl": 1737, "newli": [1730, 1781, 1788, 1801, 1834, 1837, 1838], "newlin": 1799, "newton": [635, 652, 746, 944, 1206, 1208, 1213, 1225, 1226, 1279, 1368, 1704, 1753, 1789, 1798, 1802, 1838], "newtonian": 1706, "newtonian_constant_of_gravit": 1706, "newtonian_constant_of_gravitation_over_h_bar_c": 1706, "next": [3, 243, 279, 284, 314, 318, 319, 321, 603, 669, 1206, 1704, 1714, 1730, 1740, 1743, 1754, 1767, 1782, 1786, 1787, 1791, 1800, 1824, 1828, 1832, 1833, 1835, 1837, 1838, 1842, 1844], "next_geom_coords_as_numpy_arrai": [318, 319, 1800], "nez": 1734, "nf": [1738, 1768], "nfli": [1229, 1433, 1704, 1833], "nfragment": [106, 1768, 1794], "nfrzc": 150, "nfunction": 81, "ng": 1748, "ngamma": 20, "ngstr": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "nh": [295, 1692, 1714, 1752, 1766, 1768, 1842], "nh2": [1692, 1711, 1714, 1752, 1842], "nh3": [284, 1692, 1714, 1740, 1752, 1754, 1782, 1803, 1842], "ni": [1707, 1731], "nice": [1738, 1748, 1764, 1788, 1794, 1828, 1834, 1844], "nicknam": 1759, "nightli": [1737, 1738, 1748, 1788], "nih": 1734, "nij": [574, 1206, 1704], "nijmegen": 1791, "nil": 98, "nine": 1748, "ninja": [1738, 1764], "nirrep": [2, 11, 16, 88, 90, 100, 115, 148, 150, 187, 569, 593, 660, 1206, 1704, 1810], "nist": [1832, 1837], "nitrat": [1714, 1842], "nitrogen": [1712, 1714, 1842], "nl": [2, 267, 287, 295, 318, 319, 338, 388, 1231, 1542, 1543, 1544, 1582, 1695, 1696, 1698, 1699, 1700, 1702, 1703, 1704, 1757, 1758, 1759, 1766, 1777, 1781, 1790, 1791, 1800], "nl_dispersion_paramet": [0, 1, 2, 1704, 1714, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "nl_dispersion_paramt": 1760, "nlc": [1710, 1757], "nlevel": 1794, "nlm": 1734, "nm": [377, 550, 1203, 1704, 1714, 1742, 1841, 1842], "nmax": 1757, "nmo": [150, 1810, 1838], "nmopi": [150, 1810], "nmp2": 1752, "nmr": [636, 669, 695, 703, 1206, 1704], "nn": 1776, "nne": [295, 1766], "no_com": [1749, 1754, 1770, 1782, 1802, 1803, 1833, 1837], "no_dfil": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "no_occup": [111, 150, 1799], "no_reori": [1749, 1754, 1770, 1782, 1802, 1803, 1833, 1837], "no_root1": [150, 314, 1791], "no_singl": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "nobeta": [1714, 1842], "nobl": [1125, 1221, 1704, 1714, 1771, 1837, 1842], "noc1": 2, "nocc": [95, 140, 1746], "nocom": [1802, 1833], "nocp": [1714, 1794, 1842], "nocp_energy_body_dict": 1794, "nocp_gradient_body_dict": 1794, "nocp_hessian_body_dict": 1794, "node": [1735, 1763, 1767, 1832], "nois": [1008, 1215, 1704, 1746], "nojacobi": [584, 1206, 1704], "nomenclatur": 1810, "nomin": [268, 1743], "non": [2, 8, 84, 106, 267, 295, 296, 307, 318, 319, 342, 356, 384, 386, 399, 418, 573, 575, 577, 605, 609, 617, 655, 658, 677, 681, 704, 780, 819, 1024, 1147, 1198, 1204, 1206, 1209, 1210, 1217, 1221, 1226, 1230, 1231, 1298, 1372, 1448, 1449, 1450, 1591, 1689, 1692, 1704, 1714, 1715, 1730, 1733, 1735, 1738, 1743, 1744, 1745, 1748, 1752, 1753, 1759, 1760, 1763, 1766, 1767, 1768, 1769, 1770, 1772, 1776, 1781, 1785, 1787, 1790, 1794, 1797, 1800, 1803, 1808, 1809, 1814, 1817, 1824, 1828, 1831, 1832, 1836, 1837, 1838, 1839, 1842, 1844], "non_h": [1692, 1752], "nonabelian": [573, 1206, 1704], "nonapproxim": 1734, "nonbond": 1833, "noncontigu": 1721, "noncoval": [1692, 1730, 1733, 1752, 1757, 1770, 1781, 1802, 1837], "nondynam": [1226, 1305, 1704], "none": [2, 3, 5, 6, 7, 8, 9, 12, 13, 15, 16, 18, 19, 21, 23, 24, 27, 31, 33, 34, 35, 43, 44, 45, 46, 48, 49, 50, 51, 52, 53, 55, 56, 57, 58, 59, 60, 61, 64, 68, 73, 74, 75, 76, 78, 80, 84, 86, 87, 88, 90, 92, 94, 96, 97, 99, 100, 103, 104, 105, 106, 111, 112, 114, 115, 118, 119, 131, 133, 138, 139, 141, 143, 147, 148, 149, 150, 153, 154, 155, 156, 157, 158, 159, 163, 166, 168, 169, 170, 171, 172, 174, 175, 176, 187, 188, 189, 206, 223, 224, 226, 227, 228, 229, 230, 234, 235, 236, 240, 243, 244, 245, 249, 250, 251, 252, 253, 254, 255, 257, 258, 260, 261, 264, 265, 266, 267, 282, 290, 291, 296, 297, 303, 308, 311, 314, 317, 321, 326, 328, 331, 332, 335, 341, 342, 346, 347, 351, 355, 356, 357, 362, 365, 372, 375, 376, 378, 381, 382, 383, 384, 386, 389, 390, 396, 397, 399, 411, 430, 446, 464, 484, 513, 523, 546, 547, 557, 589, 613, 725, 727, 758, 898, 900, 968, 1011, 1048, 1119, 1167, 1198, 1199, 1200, 1202, 1203, 1204, 1206, 1207, 1208, 1212, 1214, 1216, 1218, 1221, 1225, 1226, 1229, 1230, 1231, 1293, 1329, 1403, 1470, 1507, 1532, 1553, 1615, 1631, 1649, 1658, 1704, 1714, 1738, 1740, 1750, 1757, 1759, 1761, 1765, 1768, 1769, 1770, 1772, 1773, 1774, 1775, 1783, 1784, 1788, 1791, 1794, 1796, 1801, 1809, 1826, 1837, 1839, 1841, 1842], "nonempti": 267, "nonequilibrium": 1803, "noninteract": [1048, 1218, 1704, 1757, 1770], "nonit": [1771, 1781], "nonlinear": [377, 1734, 1771, 1838], "nonlinearli": [596, 1206, 1704], "nonloc": [1757, 1776], "nonneg_onli": 342, "nonphys": [106, 1714, 1768, 1842], "nonrelativist": [284, 1740, 1836], "nonsens": [1771, 1776], "nonsepar": [295, 318, 319, 1695, 1697, 1698, 1699, 1700, 1701, 1703, 1758, 1766, 1800], "nonsingular": 100, "nonsuperimpos": 106, "nontrivi": 1755, "nonun": 1759, "nonunit": 1841, "nonzero": [635, 652, 827, 1206, 1210, 1704, 1756, 1810, 1838], "nooijen": [1734, 1805], "noon": [1154, 1221, 1231, 1662, 1704], "nor": [1127, 1128, 1221, 1704, 1730, 1736, 1737, 1738, 1748, 1755, 1776, 1786], "norb": [2, 286, 298, 337, 348], "noreori": 1833, "norm": [12, 149, 277, 335, 342, 356, 388, 491, 500, 594, 683, 722, 903, 904, 1001, 1200, 1206, 1207, 1212, 1215, 1230, 1231, 1444, 1638, 1654, 1673, 1704, 1746, 1757, 1776, 1810, 1837, 1841], "normal": [2, 69, 81, 122, 149, 265, 342, 356, 384, 386, 389, 399, 572, 657, 679, 707, 804, 975, 1027, 1206, 1210, 1214, 1217, 1226, 1312, 1704, 1735, 1740, 1748, 1763, 1767, 1771, 1777, 1782, 1789, 1794, 1798, 1802, 1810, 1828, 1831, 1837, 1838, 1840, 1844], "normal_modes_writ": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "norman": 1734, "norman2018": [1734, 1841], "normco": 389, "nosampl": 2, "notabl": [1755, 1757, 1837], "notat": [229, 1743, 1771, 1801, 1804, 1810, 1832, 1833, 1837, 1838], "note": [0, 2, 8, 100, 106, 148, 150, 259, 265, 267, 285, 287, 295, 296, 314, 318, 319, 322, 324, 325, 331, 335, 336, 338, 342, 356, 368, 369, 377, 386, 388, 390, 430, 539, 561, 570, 573, 574, 586, 590, 592, 599, 609, 610, 627, 655, 660, 664, 665, 669, 672, 680, 699, 833, 887, 1078, 1079, 1086, 1093, 1095, 1126, 1199, 1203, 1204, 1206, 1210, 1219, 1221, 1224, 1230, 1231, 1232, 1239, 1445, 1507, 1619, 1658, 1665, 1666, 1667, 1692, 1704, 1714, 1730, 1735, 1738, 1739, 1740, 1742, 1743, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1763, 1764, 1766, 1767, 1768, 1769, 1771, 1772, 1777, 1782, 1783, 1784, 1785, 1786, 1788, 1790, 1791, 1794, 1797, 1798, 1799, 1800, 1801, 1802, 1805, 1806, 1808, 1810, 1817, 1821, 1828, 1829, 1831, 1832, 1833, 1835, 1836, 1837, 1838, 1839, 1841, 1842, 1843, 1844], "notebook": [1738, 1828], "noth": [640, 855, 1206, 1210, 1704, 1738, 1767, 1786, 1789, 1801], "notic": [2, 1231, 1564, 1704, 1730, 1738, 1756, 1770, 1801, 1828, 1844], "notori": 1757, "nottoli": [1734, 1777, 1780], "notwithstand": [208, 209, 210, 1801], "nov": [267, 1230, 1469, 1470, 1704, 1738, 1759, 1783, 1837], "novemb": 1770, "novic": 1748, "now": [2, 267, 279, 603, 682, 1206, 1226, 1231, 1326, 1629, 1704, 1714, 1738, 1743, 1748, 1753, 1756, 1757, 1759, 1764, 1767, 1770, 1774, 1781, 1785, 1786, 1788, 1798, 1801, 1802, 1808, 1809, 1810, 1817, 1828, 1833, 1837, 1842, 1844], "nowher": [1692, 1752], "np": [2, 11, 12, 100, 148, 150, 262, 277, 306, 307, 318, 319, 331, 342, 356, 377, 1772, 1797, 1800, 1832, 1838, 1841], "np_out": 106, "np_read": [100, 148], "np_write": [100, 148], "nph": [100, 148, 1797], "npoint": [9, 105, 138, 377], "nprimit": [8, 81], "npy": 1838, "npz": [100, 148, 1838], "nr": [635, 652, 656, 1206, 1225, 1226, 1279, 1368, 1694, 1704, 1707, 1731, 1732, 1733, 1798, 1802], "nre": 1833, "nremov": 100, "nroot": [277, 342, 356], "ns1": 86, "ns2": 86, "nsf": 1805, "nshell": [8, 1817], "nshell_on_cent": 8, "nsing": [1224, 1238, 1704], "nso": [2, 100, 150, 1810, 1821, 1838], "nsocc": 1838, "nsopi": 150, "ntask": 1794, "nthread": [156, 251, 1767], "ntrip": [1224, 1239, 1704], "nu": [377, 1757, 1761, 1829, 1836, 1838], "nucelobas": [1692, 1752], "nucenergi": 2, "nuclear": [2, 73, 76, 89, 103, 106, 147, 294, 298, 345, 348, 695, 1206, 1217, 1231, 1528, 1670, 1690, 1704, 1706, 1714, 1743, 1750, 1770, 1776, 1798, 1799, 1802, 1803, 1817, 1828, 1833, 1836, 1838, 1842, 1844], "nuclear_charg": 1799, "nuclear_dipol": 106, "nuclear_magneton": 1706, "nuclear_magneton_in_evpt": 1706, "nuclear_magneton_in_inverse_meters_per_tesla": 1706, "nuclear_magneton_in_kpt": 1706, "nuclear_magneton_in_mhzpt": 1706, "nuclear_repulsion_energi": [2, 106, 1833], "nuclear_repulsion_energy_deriv1": 106, "nuclear_repulsion_energy_deriv2": 106, "nuclei": [76, 150, 1770, 1781, 1799, 1843], "nucleic": [460, 1199, 1704, 1837], "nucleobas": [295, 1766, 1798], "nucleophil": 1750, "nucleu": [1231, 1532, 1704, 1757], "null": [153, 1814, 1817, 1819], "nullifi": 1801, "nullptr": [1231, 1553, 1704, 1814, 1819], "num": [795, 1210, 1704], "num_": 1785, "num_amps_print": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "num_core_orbit": [0, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "num_dets_print": [0, 1, 2, 525, 549, 868, 1202, 1203, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "num_frozen_docc": [0, 1, 2, 1125, 1127, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "num_frozen_uocc": [0, 1, 2, 1128, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "num_guess": [2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "num_init_vec": [0, 1, 2, 830, 842, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "num_root": [0, 1, 2, 150, 314, 830, 842, 867, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "num_thread": [1785, 1817], "number": [0, 1, 2, 5, 8, 9, 16, 20, 81, 84, 86, 87, 88, 92, 100, 103, 105, 106, 115, 138, 147, 148, 150, 199, 251, 266, 267, 270, 276, 277, 284, 285, 286, 288, 289, 298, 317, 321, 329, 334, 335, 336, 337, 339, 340, 342, 348, 356, 365, 374, 389, 390, 395, 404, 405, 406, 407, 410, 419, 422, 431, 435, 447, 452, 469, 470, 485, 487, 489, 495, 524, 525, 527, 531, 548, 549, 564, 569, 575, 580, 583, 585, 593, 595, 601, 607, 609, 614, 616, 621, 628, 633, 640, 644, 646, 660, 671, 686, 689, 692, 724, 734, 735, 741, 751, 756, 757, 760, 768, 770, 775, 776, 782, 783, 785, 789, 790, 793, 796, 797, 798, 805, 806, 808, 811, 814, 815, 823, 824, 825, 827, 829, 835, 840, 842, 847, 852, 853, 859, 860, 868, 869, 870, 871, 875, 877, 878, 879, 881, 884, 890, 893, 894, 895, 896, 901, 911, 912, 914, 931, 932, 950, 966, 969, 970, 984, 993, 1003, 1007, 1009, 1028, 1031, 1055, 1062, 1065, 1066, 1077, 1080, 1084, 1102, 1114, 1123, 1125, 1126, 1127, 1128, 1134, 1136, 1138, 1141, 1143, 1144, 1148, 1149, 1159, 1160, 1161, 1162, 1164, 1165, 1168, 1176, 1177, 1185, 1190, 1191, 1192, 1197, 1198, 1199, 1200, 1202, 1203, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1217, 1218, 1219, 1221, 1222, 1224, 1225, 1226, 1228, 1229, 1230, 1231, 1232, 1237, 1238, 1239, 1243, 1250, 1251, 1263, 1267, 1286, 1302, 1303, 1325, 1333, 1341, 1347, 1379, 1391, 1397, 1408, 1409, 1416, 1433, 1456, 1457, 1458, 1477, 1493, 1494, 1495, 1496, 1508, 1515, 1517, 1533, 1536, 1542, 1544, 1547, 1548, 1575, 1577, 1590, 1592, 1597, 1607, 1625, 1632, 1635, 1640, 1641, 1642, 1645, 1646, 1652, 1655, 1659, 1662, 1666, 1704, 1706, 1708, 1714, 1730, 1735, 1738, 1740, 1742, 1743, 1746, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1761, 1763, 1764, 1767, 1768, 1770, 1771, 1776, 1781, 1782, 1785, 1788, 1789, 1794, 1795, 1798, 1799, 1801, 1802, 1804, 1805, 1810, 1817, 1823, 1824, 1828, 1829, 1832, 1833, 1835, 1837, 1838, 1840, 1841, 1842, 1843, 1844], "numer": [2, 100, 110, 615, 657, 666, 707, 918, 1206, 1213, 1225, 1231, 1249, 1491, 1638, 1639, 1704, 1714, 1738, 1753, 1757, 1770, 1771, 1780, 1781, 1785, 1797, 1802, 1810, 1833, 1837, 1838, 1842], "numint_grid": 110, "numinthelp": 1827, "numpi": [2, 8, 100, 106, 147, 148, 150, 322, 325, 331, 334, 342, 356, 367, 377, 387, 1714, 1738, 1740, 1748, 1759, 1767, 1777, 1780, 1824, 1838, 1841, 1842], "numpy_help": 1797, "numpy_mat": 1797, "numpy_mat_view": 1797, "numpy_vec": 1797, "nvir": 1810, "nvirt": [95, 140], "nwarn": [265, 1740, 1794], "nwchem": [265, 1740, 1794, 1802], "nwchem_loos": [1226, 1324, 1704, 1802], "nweight": [95, 140], "nx3": 70, "nxn": [342, 356], "nyi": [586, 672, 1206, 1704, 1759], "nzapa": 1733, "o": [0, 2, 106, 138, 188, 213, 307, 354, 374, 395, 580, 641, 727, 837, 856, 857, 907, 1206, 1208, 1210, 1212, 1230, 1435, 1436, 1695, 1696, 1697, 1699, 1700, 1701, 1702, 1704, 1707, 1714, 1728, 1730, 1731, 1734, 1736, 1742, 1743, 1748, 1749, 1750, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1763, 1764, 1767, 1770, 1771, 1772, 1781, 1782, 1785, 1788, 1789, 1792, 1794, 1798, 1802, 1808, 1817, 1824, 1828, 1829, 1832, 1833, 1837, 1838, 1839, 1841, 1842, 1844], "o1": 1802, "o2": [1692, 1714, 1727, 1752, 1829, 1842], "o24": [1692, 1752], "o24x5": [1692, 1752], "o2h": [1692, 1752], "o3lyp": [295, 318, 319, 1695, 1697, 1698, 1700, 1703, 1758, 1766, 1800], "o4": 1781, "o_i": [1032, 1115, 1218, 1221, 1704, 1750], "o_x": [1032, 1115, 1218, 1221, 1704, 1750], "o_z": [1032, 1115, 1218, 1221, 1704, 1750], "obara": [1817, 1839], "obei": [1798, 1832], "obj": [1740, 1772], "objdir": [2, 323, 1736, 1748, 1767, 1786, 1828], "objdir8": 1786, "object": [0, 8, 14, 21, 64, 74, 84, 86, 87, 88, 89, 92, 100, 101, 102, 103, 106, 128, 130, 132, 137, 145, 147, 148, 150, 191, 195, 197, 200, 249, 262, 265, 267, 274, 275, 281, 304, 314, 321, 323, 324, 326, 327, 329, 331, 335, 355, 358, 370, 383, 386, 849, 1210, 1231, 1613, 1704, 1714, 1726, 1736, 1738, 1740, 1743, 1752, 1757, 1764, 1767, 1772, 1777, 1780, 1785, 1791, 1794, 1796, 1801, 1808, 1809, 1810, 1823, 1828, 1833, 1838, 1842], "oblig": [1781, 1785], "oblivi": 329, "oblyp": [295, 318, 319, 1695, 1697, 1698, 1699, 1703, 1758, 1766, 1800], "observ": [368, 369, 729, 1208, 1229, 1405, 1704, 1714, 1726, 1753, 1757, 1770, 1785, 1786, 1798, 1841, 1842], "obsolet": 1804, "obsur": 1785, "obtain": [1, 13, 75, 106, 284, 410, 608, 655, 707, 811, 874, 1197, 1206, 1210, 1225, 1279, 1704, 1714, 1726, 1735, 1740, 1742, 1743, 1746, 1748, 1749, 1750, 1753, 1754, 1755, 1757, 1759, 1761, 1762, 1765, 1767, 1770, 1771, 1773, 1774, 1775, 1777, 1781, 1782, 1783, 1784, 1785, 1792, 1794, 1798, 1801, 1803, 1806, 1807, 1824, 1828, 1829, 1832, 1833, 1836, 1837, 1838, 1839, 1841, 1842, 1844], "obvious": [1730, 1837], "occ": [98, 150, 400, 941, 1158, 1213, 1221, 1231, 1258, 1261, 1262, 1264, 1266, 1277, 1283, 1290, 1294, 1562, 1704, 1705, 1708, 1709, 1714, 1739, 1742, 1755, 1771, 1777, 1785, 1790, 1809, 1810, 1829, 1842], "occ_orbs_print": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "occ_percentag": [0, 1, 2, 1065, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "occ_toler": [0, 1, 2, 1065, 1084, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "occa": 104, "occasion": [1754, 1764, 1768, 1810], "occb": 104, "occup": [2, 84, 150, 287, 338, 648, 660, 671, 984, 1084, 1085, 1206, 1214, 1219, 1230, 1462, 1561, 1562, 1606, 1610, 1704, 1713, 1714, 1743, 1757, 1763, 1768, 1771, 1785, 1798, 1799, 1810, 1829, 1833, 1837, 1838, 1842], "occupation_a": 84, "occupation_b": 84, "occupations_and_eigenvalu": [265, 1740, 1794], "occupi": [2, 11, 76, 84, 95, 140, 150, 476, 575, 589, 660, 664, 665, 671, 1102, 1123, 1127, 1164, 1165, 1168, 1177, 1192, 1200, 1206, 1221, 1222, 1225, 1231, 1260, 1559, 1561, 1606, 1704, 1714, 1742, 1750, 1755, 1756, 1757, 1763, 1768, 1770, 1771, 1776, 1785, 1789, 1801, 1810, 1829, 1833, 1838, 1841, 1842], "occur": [0, 833, 1210, 1704, 1743, 1756, 1789, 1798, 1802, 1810, 1838], "occurr": 111, "ocepa": [1225, 1297, 1704, 1734, 1776, 1798], "ochsenfeld": [1734, 1838], "octob": [1740, 1792], "octohedr": 1757, "octre": [1231, 1516, 1518, 1704, 1757], "octupol": [1685, 1776, 1799], "od": [1734, 1798], "odc": [730, 742, 1208, 1704, 1714, 1753, 1781, 1842], "odc_guess": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "odd": [374, 395, 1224, 1239, 1704], "odditi": 1782, "odtl": [1734, 1798], "oe": 1767, "oe_int": [297, 347], "oe_integr": 1785, "oei": [103, 1785], "oei_typ": 103, "oeprop": [0, 1, 2, 400, 1154, 1221, 1704, 1709, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1790, 1791, 1792, 1794, 1795, 1797, 1798, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "off": [100, 106, 295, 300, 301, 302, 318, 319, 321, 561, 574, 579, 584, 596, 597, 598, 602, 608, 610, 617, 625, 626, 636, 637, 639, 640, 641, 642, 648, 655, 658, 669, 673, 677, 678, 679, 682, 688, 691, 692, 693, 695, 696, 698, 699, 701, 702, 706, 1013, 1015, 1018, 1024, 1204, 1206, 1216, 1217, 1229, 1230, 1231, 1420, 1441, 1480, 1520, 1692, 1704, 1738, 1742, 1743, 1748, 1752, 1757, 1766, 1772, 1782, 1785, 1794, 1795, 1796, 1800, 1817, 1822, 1837, 1838], "offdiagonal_ccsd_t": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "offend": 1786, "offer": [647, 680, 1206, 1704, 1757, 1781, 1804, 1837], "offlin": 1764, "offset": [671, 1206, 1704, 1764], "ofil": 1768, "ofnam": 252, "often": [2, 149, 150, 255, 314, 584, 681, 685, 700, 813, 846, 1206, 1210, 1704, 1738, 1740, 1743, 1748, 1753, 1757, 1764, 1767, 1768, 1771, 1776, 1789, 1791, 1802, 1809, 1837, 1838], "oh": [1692, 1714, 1752, 1770, 1802, 1842], "ohm": 1706, "ok": [1786, 1788, 1833, 1838], "olccd": [284, 295, 318, 319, 381, 382, 1675, 1684, 1714, 1739, 1740, 1766, 1776, 1781, 1798, 1800, 1826, 1842], "olccd1": [1714, 1842], "olccd2": [1714, 1842], "olccd3": [1714, 1842], "old": [279, 350, 428, 457, 465, 488, 530, 574, 685, 1199, 1200, 1202, 1206, 1226, 1360, 1704, 1708, 1714, 1738, 1740, 1742, 1748, 1752, 1788, 1802, 1817, 1838, 1842], "older": [2, 285, 336, 1101, 1220, 1704, 1757, 1759, 1774, 1775, 1777, 1781, 1837, 1839], "oldest": [321, 434, 1199, 1704, 1742], "oliveira": [1781, 1784], "olsen": [811, 833, 889, 1210, 1704, 1714, 1734, 1740, 1749, 1755, 1842], "omega": [0, 1, 2, 80, 89, 92, 103, 377, 383, 385, 386, 1196, 1223, 1231, 1663, 1704, 1710, 1714, 1730, 1733, 1735, 1739, 1740, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "omega_": 1841, "omega_converg": 1768, "omega_erf": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "omega_l": 1768, "omega_r": 1768, "omega_toler": 1768, "omit": [648, 660, 1206, 1704, 1730, 1771, 1832], "omp": [1738, 1798], "omp2": [284, 295, 296, 318, 319, 381, 382, 917, 921, 922, 962, 1213, 1225, 1258, 1261, 1262, 1264, 1268, 1297, 1675, 1684, 1704, 1714, 1727, 1734, 1739, 1740, 1766, 1769, 1776, 1781, 1798, 1800, 1826, 1842], "omp2grad": [1734, 1798], "omp2p5": [1714, 1842], "omp3": [284, 295, 318, 319, 381, 382, 1225, 1268, 1297, 1675, 1684, 1704, 1714, 1734, 1739, 1740, 1766, 1776, 1781, 1798, 1800, 1826, 1842], "omp3grad": [1734, 1798], "omp_nest": [1756, 1767], "omp_num_thread": [661, 1206, 1224, 1240, 1704, 1743, 1767], "onc": [84, 260, 321, 703, 1206, 1704, 1708, 1738, 1743, 1747, 1752, 1757, 1759, 1767, 1782, 1788, 1794, 1798, 1804, 1805, 1806, 1838, 1844], "one": [0, 2, 8, 13, 87, 90, 92, 100, 103, 106, 112, 113, 115, 150, 260, 267, 282, 284, 285, 286, 287, 295, 296, 297, 306, 317, 327, 332, 336, 337, 338, 342, 347, 356, 365, 369, 377, 378, 389, 399, 416, 417, 434, 443, 476, 479, 519, 543, 550, 574, 589, 608, 609, 616, 669, 671, 681, 693, 743, 808, 811, 828, 829, 833, 835, 837, 842, 872, 875, 909, 910, 921, 922, 942, 1126, 1156, 1198, 1199, 1200, 1202, 1203, 1206, 1208, 1210, 1212, 1213, 1221, 1224, 1225, 1231, 1236, 1241, 1244, 1278, 1663, 1704, 1711, 1714, 1726, 1730, 1738, 1739, 1740, 1742, 1743, 1748, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1762, 1766, 1768, 1769, 1770, 1771, 1774, 1776, 1779, 1781, 1782, 1785, 1786, 1788, 1789, 1790, 1792, 1794, 1796, 1798, 1800, 1802, 1804, 1805, 1808, 1809, 1810, 1817, 1823, 1828, 1829, 1832, 1833, 1835, 1836, 1837, 1838, 1842, 1844], "one_electron_integr": 103, "oneapi": 1738, "onebodi": [310, 361], "onebodyaoint": [4, 65, 71, 72, 89, 93, 107, 109, 116, 121, 127, 142, 1827], "onebodyint": 89, "onebodysoint": [89, 1827], "onel_hx": 84, "onelin": [1786, 1788], "onepdm": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "onepot_grid_read": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ones": [277, 342, 356, 367, 1738, 1740, 1743, 1838], "ongo": 1785, "onli": [0, 1, 2, 8, 11, 13, 75, 86, 87, 89, 100, 106, 111, 148, 150, 248, 249, 260, 265, 267, 271, 284, 285, 287, 297, 300, 301, 302, 318, 319, 326, 329, 331, 336, 338, 342, 347, 367, 370, 381, 382, 399, 401, 404, 406, 407, 416, 430, 471, 539, 550, 573, 574, 575, 576, 592, 597, 608, 609, 610, 615, 616, 625, 626, 628, 641, 657, 662, 665, 675, 681, 694, 699, 718, 739, 742, 745, 746, 749, 786, 787, 795, 810, 811, 833, 851, 867, 881, 882, 887, 906, 948, 1041, 1078, 1079, 1084, 1085, 1086, 1089, 1090, 1091, 1096, 1126, 1150, 1175, 1197, 1198, 1199, 1200, 1203, 1206, 1207, 1208, 1210, 1212, 1213, 1218, 1219, 1221, 1222, 1224, 1225, 1226, 1228, 1229, 1230, 1231, 1235, 1236, 1238, 1241, 1248, 1258, 1261, 1262, 1264, 1300, 1323, 1334, 1352, 1380, 1441, 1463, 1464, 1465, 1466, 1532, 1564, 1588, 1591, 1620, 1651, 1655, 1658, 1688, 1704, 1708, 1711, 1714, 1722, 1730, 1735, 1737, 1738, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1763, 1764, 1767, 1768, 1770, 1771, 1772, 1774, 1776, 1781, 1782, 1785, 1786, 1788, 1792, 1794, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1809, 1810, 1817, 1824, 1826, 1828, 1829, 1832, 1833, 1836, 1837, 1838, 1840, 1841, 1842, 1844], "onlin": [1738, 1764, 1788], "ons": [1738, 1748, 1781, 1785], "onto": [1229, 1415, 1431, 1432, 1434, 1704, 1743, 1756, 1771, 1788, 1838], "onward": 1759, "oo": [943, 1213, 1704, 1714, 1730, 1733, 1734, 1781, 1790, 1842], "oo_scal": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ooc": [1225, 1296, 1704, 1798], "oovv": [1714, 1842], "op": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1788, 1800], "opa": [377, 1841], "opa_hf_h2o_noneq_pcmsolv": 1724, "opa_residu": 1841, "opa_spectrum": 1841, "opac": 1750, "opb": [295, 318, 319, 1695, 1697, 1698, 1699, 1703, 1758, 1766, 1800], "opdm": [0, 1, 2, 13, 1225, 1230, 1295, 1462, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "opdm_comput": 1785, "opdm_onli": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "opdm_relax": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "open": [2, 86, 87, 224, 660, 662, 676, 695, 861, 1206, 1210, 1224, 1228, 1231, 1237, 1396, 1615, 1692, 1704, 1714, 1734, 1737, 1738, 1739, 1742, 1750, 1752, 1753, 1755, 1756, 1757, 1781, 1783, 1786, 1788, 1798, 1810, 1817, 1825, 1827, 1828, 1829, 1832, 1838, 1842, 1844], "open_check": 86, "openbla": 1738, "openfermion": 1738, "openmp": [1737, 1738, 1756, 1767, 1824, 1838], "openmp_library_dir": 1738, "openssl": 1788, "oper": [2, 17, 87, 91, 103, 139, 149, 159, 259, 329, 342, 356, 402, 539, 573, 738, 1051, 1197, 1203, 1206, 1208, 1218, 1231, 1589, 1704, 1714, 1735, 1738, 1742, 1753, 1757, 1767, 1771, 1773, 1780, 1782, 1797, 1798, 1810, 1818, 1824, 1829, 1836, 1837, 1838, 1840, 1841, 1842], "oppenheim": [597, 1206, 1704], "opportun": 1817, "oppos": [351, 1232, 1666, 1704, 1738, 1743, 1748, 1770, 1785, 1796, 1816, 1837, 1843], "opposit": [2, 106, 150, 295, 436, 449, 922, 923, 936, 937, 938, 1081, 1199, 1213, 1219, 1225, 1283, 1669, 1670, 1674, 1675, 1676, 1680, 1684, 1704, 1743, 1756, 1757, 1766, 1770, 1771, 1776, 1781, 1798], "oppposit": [1067, 1219, 1704, 1771], "opt": [2, 300, 301, 302, 319, 1711, 1714, 1724, 1738, 1740, 1743, 1772, 1779, 1782, 1798, 1800, 1803, 1828, 1840, 1842, 1844], "opt1": [1714, 1842], "opt11": [1714, 1842], "opt12": [1714, 1842], "opt13": [1714, 1842], "opt14": [1714, 1842], "opt15": [1714, 1842], "opt16": [1714, 1842], "opt2": [1714, 1842], "opt3": [1714, 1842], "opt4": [1714, 1842], "opt5": [1714, 1842], "opt6": [1714, 1842], "opt7": [1714, 1842], "opt8": [1714, 1842], "opt9": [1714, 1842], "opt_coordin": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "opt_func": [318, 319, 1779, 1800], "opt_method": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "opt_mod": 1779, "opt_rec": [669, 1206, 1704], "opt_restart": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "opt_typ": [0, 1, 2, 652, 1206, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "optfreq": 1723, "optic": [377, 381, 382, 454, 539, 551, 669, 780, 1199, 1203, 1206, 1209, 1704, 1714, 1734, 1742, 1826, 1842], "optim": [106, 179, 218, 266, 270, 284, 295, 296, 300, 301, 302, 306, 318, 381, 382, 457, 460, 575, 586, 592, 599, 611, 632, 633, 634, 635, 648, 652, 656, 706, 739, 828, 921, 922, 933, 938, 944, 945, 1066, 1127, 1128, 1147, 1164, 1165, 1179, 1199, 1206, 1208, 1210, 1213, 1217, 1219, 1221, 1222, 1225, 1231, 1269, 1279, 1280, 1302, 1305, 1323, 1324, 1325, 1352, 1353, 1368, 1373, 1374, 1565, 1575, 1675, 1684, 1692, 1704, 1708, 1710, 1711, 1714, 1723, 1724, 1735, 1737, 1738, 1740, 1742, 1743, 1746, 1752, 1753, 1755, 1757, 1759, 1763, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1774, 1776, 1777, 1778, 1779, 1782, 1785, 1789, 1790, 1792, 1794, 1796, 1803, 1817, 1824, 1826, 1829, 1831, 1832, 1833, 1834, 1837, 1838, 1840, 1842], "optima": 1738, "optimizationconvergenceerror": [318, 319, 1800, 1827], "optimizationresult": [1226, 1372, 1704], "optimizer_keyword": [318, 319, 1800, 1802], "optimz": [1714, 1802, 1842], "option": [0, 1, 2, 8, 21, 84, 92, 100, 106, 148, 150, 169, 182, 196, 201, 208, 209, 210, 220, 226, 227, 228, 235, 236, 247, 259, 265, 266, 267, 272, 282, 284, 297, 299, 303, 308, 314, 318, 319, 321, 326, 329, 331, 332, 335, 346, 347, 349, 351, 357, 370, 371, 372, 375, 376, 378, 383, 384, 386, 389, 390, 393, 396, 397, 399, 401, 404, 406, 407, 430, 521, 523, 545, 547, 561, 573, 586, 592, 599, 608, 613, 617, 619, 621, 623, 627, 637, 640, 641, 655, 661, 662, 665, 670, 671, 672, 675, 679, 692, 696, 703, 713, 727, 794, 811, 823, 827, 865, 874, 881, 882, 884, 897, 906, 935, 944, 946, 1084, 1085, 1095, 1125, 1126, 1129, 1130, 1197, 1199, 1202, 1203, 1204, 1206, 1208, 1211, 1212, 1213, 1219, 1221, 1224, 1225, 1226, 1228, 1230, 1231, 1232, 1233, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1244, 1279, 1281, 1296, 1324, 1378, 1441, 1483, 1521, 1532, 1563, 1589, 1633, 1636, 1658, 1666, 1692, 1704, 1711, 1714, 1736, 1740, 1743, 1746, 1747, 1748, 1749, 1752, 1753, 1754, 1755, 1757, 1759, 1762, 1765, 1768, 1770, 1771, 1772, 1774, 1776, 1777, 1780, 1782, 1785, 1788, 1790, 1792, 1794, 1797, 1798, 1799, 1800, 1802, 1803, 1808, 1809, 1810, 1812, 1815, 1817, 1827, 1828, 1829, 1831, 1832, 1835, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "option_molecule_nam": 1833, "option_nam": [376, 397], "optional_basis_nam": 1730, "optional_molecule_nam": [1743, 1833], "options1": [1714, 1842], "options_dict": [375, 376, 396, 397], "options_lo": [284, 1740], "optionsst": [328, 1801, 1809, 1827], "optionst": [327, 1827], "optk": [318, 319, 400, 611, 632, 633, 634, 652, 656, 1206, 1304, 1352, 1353, 1355, 1367, 1704, 1705, 1738, 1743, 1790, 1800], "optmiz": [1226, 1349, 1350, 1351, 1364, 1365, 1704, 1802], "optproc": 1827, "optri": [1707, 1731], "optshandl": 1788, "optstash": [327, 1801, 1809], "opwlyp": [295, 318, 319, 1695, 1697, 1698, 1699, 1703, 1758, 1766, 1800], "orb": [1713, 1714, 1785, 1842], "orb1": [897, 1211, 1704], "orb2": [897, 1211, 1704], "orb_en": [835, 861, 1210, 1704, 1755], "orb_opt": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "orb_resp": [1225, 1279, 1704, 1798], "orb_resp_solv": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "orb_rot": 1713, "orb_spac": 115, "orbit": [0, 1, 2, 8, 10, 13, 21, 26, 76, 84, 92, 95, 97, 98, 106, 115, 117, 132, 140, 150, 179, 218, 268, 286, 291, 295, 296, 297, 298, 303, 314, 317, 318, 319, 337, 341, 347, 348, 365, 381, 382, 406, 424, 432, 433, 443, 466, 479, 507, 514, 519, 543, 568, 569, 575, 579, 589, 593, 600, 601, 608, 625, 626, 636, 640, 648, 658, 660, 662, 664, 665, 669, 671, 672, 674, 675, 677, 681, 693, 704, 726, 729, 731, 739, 744, 746, 747, 749, 799, 809, 835, 845, 851, 854, 855, 856, 857, 866, 897, 930, 931, 932, 933, 938, 940, 941, 944, 945, 946, 958, 965, 973, 995, 1000, 1036, 1037, 1041, 1048, 1054, 1065, 1066, 1102, 1103, 1111, 1112, 1123, 1125, 1126, 1127, 1128, 1147, 1148, 1149, 1159, 1160, 1161, 1162, 1164, 1165, 1168, 1171, 1172, 1174, 1177, 1188, 1189, 1190, 1191, 1192, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1206, 1208, 1210, 1211, 1213, 1214, 1215, 1218, 1219, 1221, 1222, 1225, 1230, 1231, 1242, 1259, 1260, 1266, 1267, 1269, 1271, 1276, 1277, 1279, 1280, 1281, 1288, 1290, 1437, 1454, 1459, 1460, 1461, 1462, 1497, 1510, 1558, 1559, 1561, 1562, 1563, 1565, 1573, 1574, 1575, 1579, 1581, 1584, 1594, 1606, 1675, 1684, 1694, 1704, 1708, 1712, 1713, 1714, 1726, 1729, 1730, 1732, 1739, 1742, 1743, 1746, 1753, 1756, 1757, 1764, 1766, 1767, 1768, 1769, 1775, 1776, 1777, 1785, 1790, 1791, 1799, 1800, 1801, 1812, 1814, 1823, 1824, 1826, 1828, 1831, 1833, 1836, 1838, 1841, 1842, 1844], "orbital1": [855, 1210, 1704, 1789], "orbital2": [855, 1210, 1704, 1789], "orbital_basi": 92, "orbital_level_shift": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "orbital_nam": 13, "orbital_valu": 119, "orbitals_and_eigenvalu": [265, 1740, 1794], "orbitals_writ": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "orbitalspac": [150, 1827], "orbsym": [2, 286, 298, 337, 348], "order": [0, 2, 13, 15, 17, 20, 26, 27, 63, 64, 84, 89, 100, 103, 106, 107, 120, 133, 150, 267, 295, 300, 301, 302, 318, 319, 329, 342, 381, 382, 446, 484, 575, 601, 614, 660, 662, 669, 677, 696, 856, 857, 861, 863, 921, 922, 1000, 1065, 1097, 1122, 1123, 1168, 1189, 1199, 1200, 1206, 1213, 1215, 1219, 1220, 1221, 1222, 1225, 1228, 1229, 1230, 1231, 1244, 1256, 1380, 1395, 1403, 1413, 1433, 1448, 1449, 1450, 1452, 1455, 1459, 1464, 1465, 1466, 1521, 1643, 1644, 1645, 1646, 1648, 1673, 1695, 1696, 1698, 1700, 1704, 1714, 1730, 1734, 1738, 1739, 1742, 1743, 1744, 1745, 1746, 1747, 1749, 1750, 1753, 1754, 1757, 1758, 1759, 1761, 1762, 1763, 1766, 1767, 1771, 1772, 1775, 1776, 1777, 1781, 1783, 1785, 1786, 1788, 1790, 1794, 1798, 1799, 1800, 1801, 1802, 1806, 1808, 1809, 1810, 1817, 1826, 1828, 1832, 1834, 1840, 1842, 1844], "ordered_param": [267, 1759], "ordinari": [2, 1737, 1738, 1752, 1831], "oremp": [1225, 1297, 1704, 1714, 1734, 1798, 1842], "oremp2": [295, 318, 319, 1675, 1684, 1739, 1766, 1776, 1781, 1798, 1800], "org": [0, 297, 308, 347, 377, 1692, 1714, 1717, 1734, 1737, 1738, 1740, 1748, 1750, 1752, 1761, 1764, 1768, 1776, 1781, 1787, 1821, 1828, 1839, 1842], "organ": [1777, 1804], "oribit": [1771, 1776], "oribt": 150, "orient": [105, 106, 1721, 1743, 1757, 1770, 1782, 1802, 1833], "orientation_fix": 106, "origin": [0, 2, 8, 103, 106, 112, 386, 539, 681, 1084, 1099, 1156, 1203, 1206, 1219, 1220, 1221, 1669, 1692, 1704, 1714, 1737, 1742, 1752, 1759, 1760, 1770, 1771, 1775, 1776, 1786, 1788, 1789, 1804, 1809, 1817, 1836, 1838, 1841, 1842], "original_coef": 81, "orth_typ": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "orthogon": [100, 115, 130, 647, 752, 947, 1048, 1206, 1208, 1213, 1218, 1225, 1231, 1282, 1601, 1704, 1757, 1763, 1770, 1776, 1781, 1790, 1798, 1799, 1810], "orthonorm": [863, 1210, 1704, 1810, 1838], "os": 1788, "os_scal": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "oscil": [0, 1668, 1669, 1690, 1776, 1838, 1841], "oscillator_strength": [0, 381, 382, 1826], "oscillatori": [729, 1208, 1229, 1231, 1405, 1499, 1704, 1753, 1838], "osd": 328, "oso": [1810, 1838], "ostlund": 1734, "osx": 1788, "other": [0, 2, 8, 73, 75, 111, 115, 148, 150, 262, 263, 278, 284, 292, 300, 301, 302, 318, 319, 343, 346, 377, 381, 382, 386, 390, 393, 599, 608, 615, 699, 700, 813, 1206, 1210, 1229, 1230, 1231, 1431, 1432, 1434, 1441, 1620, 1704, 1707, 1714, 1730, 1731, 1734, 1737, 1738, 1740, 1742, 1743, 1746, 1748, 1752, 1755, 1756, 1757, 1762, 1763, 1764, 1765, 1767, 1768, 1771, 1772, 1773, 1775, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1790, 1792, 1794, 1798, 1800, 1801, 1802, 1804, 1808, 1809, 1810, 1817, 1823, 1826, 1828, 1829, 1832, 1835, 1837, 1838, 1839, 1842, 1843, 1844], "otherwis": [2, 92, 100, 148, 150, 267, 284, 296, 326, 383, 596, 636, 836, 865, 872, 888, 1129, 1206, 1210, 1221, 1224, 1231, 1238, 1500, 1704, 1714, 1730, 1738, 1740, 1743, 1752, 1755, 1759, 1767, 1769, 1794, 1797, 1801, 1802, 1810, 1817, 1828, 1829, 1838, 1842, 1844], "otpss": [295, 318, 319, 1695, 1697, 1698, 1702, 1703, 1758, 1766, 1800], "oughtn": 1809, "our": [1748, 1753, 1757, 1770, 1798, 1817, 1828, 1832, 1836, 1837, 1841, 1844], "out": [2, 64, 92, 106, 115, 138, 139, 150, 284, 288, 289, 306, 314, 321, 329, 339, 340, 374, 386, 395, 570, 573, 617, 623, 706, 823, 827, 828, 861, 890, 998, 1041, 1124, 1206, 1210, 1215, 1218, 1221, 1226, 1231, 1311, 1322, 1360, 1649, 1657, 1704, 1708, 1714, 1724, 1725, 1737, 1740, 1742, 1743, 1746, 1748, 1750, 1752, 1755, 1756, 1757, 1767, 1768, 1770, 1786, 1788, 1791, 1794, 1799, 1800, 1801, 1802, 1804, 1810, 1817, 1824, 1828, 1833, 1837, 1838, 1841, 1842, 1844], "out_fnam": [9, 119], "out_of_cor": [721, 1166, 1207, 1221, 1231, 1609, 1620, 1704, 1749, 1754, 1803, 1838], "out_unit": [377, 1841], "outer": [1794, 1810], "outermost": 1779, "outfil": [8, 9, 73, 100, 118, 119, 261, 278, 280, 1788, 1810, 1821], "outlin": [1738, 1752, 1763, 1771, 1779, 1798, 1806, 1824, 1838], "output": [8, 16, 64, 88, 100, 106, 115, 148, 150, 153, 172, 189, 202, 221, 227, 228, 229, 230, 234, 252, 265, 267, 271, 278, 280, 282, 285, 287, 300, 301, 302, 318, 319, 332, 336, 338, 350, 374, 377, 380, 390, 393, 395, 667, 701, 716, 720, 934, 1021, 1025, 1026, 1027, 1104, 1118, 1153, 1170, 1206, 1207, 1213, 1216, 1217, 1221, 1230, 1231, 1463, 1578, 1608, 1704, 1708, 1714, 1730, 1738, 1750, 1757, 1759, 1767, 1768, 1769, 1770, 1772, 1775, 1780, 1785, 1787, 1788, 1790, 1791, 1794, 1799, 1800, 1801, 1810, 1814, 1821, 1828, 1831, 1832, 1833, 1834, 1837, 1838, 1840, 1841, 1842, 1844], "output_alpha": 323, "output_file_typ": 323, "output_nam": 1802, "outright": [1714, 1726, 1737, 1740, 1842], "outsid": [2, 106, 586, 1206, 1704, 1738, 1804, 1805], "ov": [1730, 1733, 1756, 1841], "over": [2, 13, 112, 295, 318, 319, 576, 609, 667, 835, 1125, 1206, 1210, 1221, 1229, 1231, 1411, 1507, 1704, 1706, 1708, 1714, 1718, 1735, 1743, 1744, 1745, 1753, 1754, 1755, 1756, 1757, 1759, 1766, 1767, 1770, 1771, 1772, 1776, 1783, 1788, 1798, 1800, 1804, 1817, 1828, 1832, 1837, 1838, 1842, 1844], "overal": [100, 106, 259, 1739, 1759, 1770, 1824, 1828, 1833, 1837, 1838, 1843, 1844], "overcom": [1770, 1771, 1786, 1808, 1838], "overcomplet": 1838, "overestim": 1757, "overhaul": 247, "overhead": [1742, 1756, 1770], "overlap": [76, 89, 103, 116, 141, 150, 323, 488, 761, 774, 829, 886, 977, 1013, 1015, 1135, 1200, 1209, 1210, 1214, 1216, 1221, 1231, 1491, 1509, 1600, 1669, 1704, 1714, 1754, 1763, 1776, 1781, 1801, 1802, 1809, 1810, 1817, 1828, 1836, 1838, 1842, 1844], "overlap_3c": 89, "overlap_check": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "overlap_grad": 103, "overlapint": [1817, 1827], "overli": 0, "overload": [5, 8, 13, 20, 27, 29, 64, 88, 90, 92, 96, 100, 101, 103, 106, 114, 119, 147, 148, 246, 248, 252, 1821], "overrid": [8, 106, 267, 284, 661, 697, 821, 897, 1065, 1084, 1100, 1206, 1210, 1211, 1219, 1220, 1224, 1231, 1236, 1240, 1642, 1704, 1738, 1740, 1743, 1755, 1757, 1759, 1767, 1771, 1775, 1819, 1832], "overridden": [267, 1231, 1641, 1704, 1808, 1838], "overriden": [284, 1740], "overrul": [284, 1740], "overview": [0, 1738, 1743, 1760, 1777, 1797, 1819], "overwhelmingli": 1788, "overwrit": [106, 1226, 1231, 1324, 1636, 1704, 1714, 1740, 1759, 1788, 1802, 1842], "overwritten": [106, 267, 1743, 1759, 1776], "ovvv": [1714, 1842], "ow": 1838, "own": [329, 1226, 1304, 1704, 1737, 1738, 1743, 1748, 1759, 1774, 1775, 1781, 1782, 1785, 1786, 1795, 1817, 1823, 1837], "owner": [265, 1740, 1785, 1786, 1794], "owner_group": [265, 1740, 1794], "oxford": 1734, "oxid": [1714, 1842], "oxygen": [0, 1714, 1789, 1829, 1838, 1842], "ozon": [1714, 1842], "p": [0, 1, 2, 3, 13, 103, 143, 144, 295, 300, 301, 302, 346, 390, 392, 443, 479, 519, 543, 628, 721, 903, 904, 1199, 1200, 1202, 1203, 1206, 1207, 1212, 1231, 1485, 1704, 1714, 1730, 1734, 1738, 1740, 1747, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1793, 1794, 1795, 1798, 1800, 1801, 1803, 1805, 1806, 1807, 1808, 1809, 1811, 1813, 1820, 1821, 1822, 1823, 1826, 1829, 1832, 1834, 1835, 1836, 1837, 1839, 1840, 1841, 1842], "p4": 1743, "p4c4": 1743, "p4c4_info": 1743, "p4dep": 1738, "p4dev": [1738, 1748], "p4env": [1737, 1738, 1748], "p4mol": 1833, "p4util": [2, 84, 278, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 396, 1777, 1797, 1801, 1832, 1841], "p_": 1837, "p_gaussian": [968, 1214, 1231, 1532, 1704], "p_rfo": [1226, 1368, 1704, 1802], "p_slater": [968, 1214, 1231, 1532, 1704, 1757], "pa": [390, 1706], "pack": [90, 100, 148, 1726], "packag": [0, 1, 1129, 1221, 1704, 1736, 1738, 1746, 1749, 1754, 1762, 1765, 1767, 1773, 1774, 1775, 1777, 1780, 1782, 1783, 1784, 1785, 1786, 1787, 1790, 1803, 1806, 1807, 1839], "page": [1734, 1736, 1737, 1738, 1748, 1757, 1764, 1770, 1777, 1785, 1787, 1798, 1817], "pai": 1738, "pain": 1810, "pair": [106, 112, 258, 295, 445, 446, 453, 484, 522, 523, 546, 547, 704, 833, 985, 1070, 1071, 1101, 1199, 1200, 1202, 1203, 1206, 1210, 1214, 1219, 1220, 1231, 1488, 1622, 1669, 1680, 1692, 1704, 1714, 1752, 1759, 1766, 1770, 1775, 1776, 1777, 1781, 1790, 1801, 1802, 1828, 1837, 1838, 1841, 1842, 1844], "pair_energies_print": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "pairpq": 1817, "pairr": 1817, "pairwis": [267, 1759, 1770, 1776, 1837], "pam": 1817, "panda": 1832, "pao": [979, 980, 982, 1214, 1704, 1763], "papajak": [1730, 1733, 1734, 1828, 1844], "paper": [786, 1210, 1704, 1714, 1757, 1762, 1770, 1781, 1799, 1805, 1810, 1837, 1842], "paradigm": [1209, 1672], "paragraph": [1752, 1810], "parallel": [0, 1, 2, 199, 251, 570, 624, 1041, 1206, 1218, 1692, 1704, 1730, 1733, 1735, 1737, 1738, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1841, 1843, 1844], "param": [106, 1695, 1696, 1697, 1700, 1757, 1758, 1759], "param_tweak": [267, 1759], "paramet": [0, 2, 8, 13, 14, 64, 92, 96, 100, 106, 128, 130, 138, 145, 147, 148, 150, 176, 212, 255, 259, 262, 263, 265, 266, 267, 268, 269, 270, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 308, 309, 312, 313, 314, 317, 318, 319, 321, 322, 324, 325, 326, 327, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 346, 347, 348, 349, 350, 351, 352, 354, 355, 356, 358, 359, 360, 363, 364, 365, 366, 367, 370, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 395, 396, 397, 399, 460, 658, 755, 761, 774, 781, 832, 833, 955, 957, 1070, 1088, 1199, 1206, 1208, 1209, 1210, 1213, 1219, 1224, 1225, 1226, 1231, 1241, 1279, 1283, 1284, 1289, 1294, 1355, 1511, 1512, 1513, 1521, 1529, 1530, 1539, 1540, 1582, 1695, 1696, 1698, 1700, 1702, 1704, 1706, 1710, 1714, 1735, 1740, 1742, 1743, 1750, 1752, 1753, 1757, 1758, 1759, 1760, 1761, 1766, 1768, 1769, 1771, 1772, 1774, 1775, 1776, 1780, 1782, 1790, 1791, 1794, 1797, 1798, 1799, 1800, 1810, 1817, 1821, 1826, 1837, 1838, 1842], "parameter": [2, 295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1758, 1766, 1800, 1837], "parametr": 1841, "parent": [106, 1150, 1221, 1704, 1737, 1776, 1808], "parent_atom": 9, "parent_symmetri": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "parenthes": [8, 1730, 1737, 1772], "parenthesi": 1733, "parenthet": 1776, "parker": [106, 1734, 1781, 1837], "parr": [1734, 1757], "parrish": [94, 288, 289, 339, 340, 1135, 1221, 1704, 1734, 1750, 1756, 1757, 1770, 1781, 1786, 1799, 1837, 1838], "pars": [271, 380, 1227, 1377, 1704, 1714, 1730, 1743, 1767, 1768, 1788, 1801, 1832, 1842], "parser": [1714, 1743, 1781, 1785, 1833, 1842], "parsingerror": 1827, "part": [0, 2, 267, 284, 574, 603, 664, 677, 680, 681, 1199, 1206, 1231, 1612, 1669, 1692, 1704, 1708, 1711, 1714, 1722, 1738, 1740, 1743, 1747, 1752, 1753, 1757, 1759, 1763, 1767, 1781, 1785, 1786, 1788, 1802, 1808, 1817, 1823, 1828, 1837, 1838, 1842, 1844], "parti": 1785, "partial": [100, 386, 641, 662, 708, 1206, 1231, 1600, 1606, 1704, 1753, 1757, 1771, 1772, 1776, 1786, 1794, 1798, 1802, 1828, 1829, 1838, 1844], "partial_cholesky_factor": 100, "partialcholeski": [1231, 1601, 1704, 1838], "particip": [1743, 1786], "particl": [13, 416, 417, 627, 743, 758, 794, 828, 872, 875, 888, 909, 910, 1198, 1206, 1208, 1210, 1212, 1671, 1704, 1706, 1753, 1755, 1771, 1776, 1781, 1785, 1790, 1798, 1799, 1805, 1823, 1829, 1838, 1843], "particular": [86, 268, 568, 569, 593, 628, 640, 660, 679, 685, 827, 829, 1206, 1210, 1704, 1714, 1730, 1735, 1738, 1740, 1743, 1747, 1748, 1752, 1754, 1756, 1757, 1759, 1774, 1779, 1781, 1788, 1794, 1802, 1808, 1809, 1828, 1829, 1833, 1834, 1837, 1838, 1842], "particularli": [2, 433, 466, 507, 514, 611, 628, 632, 633, 634, 635, 652, 1199, 1200, 1201, 1202, 1206, 1225, 1242, 1704, 1742, 1748, 1753, 1755, 1757, 1761, 1767, 1783, 1788, 1824, 1833, 1837, 1838], "partit": [76, 352, 1230, 1442, 1704, 1714, 1738, 1757, 1776, 1781, 1790, 1799, 1837, 1842], "pascal": [1232, 1665, 1704, 1843], "pass": [0, 2, 64, 86, 92, 100, 103, 106, 148, 150, 265, 275, 281, 285, 287, 291, 304, 306, 312, 314, 318, 319, 329, 331, 336, 338, 341, 350, 374, 378, 383, 395, 575, 1130, 1206, 1221, 1225, 1254, 1255, 1704, 1710, 1714, 1722, 1738, 1740, 1743, 1746, 1750, 1759, 1767, 1768, 1769, 1775, 1779, 1785, 1787, 1791, 1794, 1797, 1800, 1802, 1803, 1805, 1808, 1809, 1810, 1817, 1828, 1838, 1842], "passabl": 1738, "passnon": 2, "past": [106, 137, 1804], "pastur": 1738, "pasturerequirederror": 1827, "patch": [1714, 1759, 1788, 1833, 1842], "patch_grimme_dftd3": 1759, "path": [2, 87, 106, 150, 194, 245, 285, 287, 288, 289, 336, 338, 339, 340, 354, 1735, 1736, 1737, 1743, 1746, 1748, 1750, 1752, 1759, 1762, 1764, 1765, 1767, 1768, 1773, 1774, 1775, 1782, 1783, 1784, 1786, 1788, 1790, 1792, 1808, 1824, 1828, 1839, 1844], "pathlib": 2, "patkowski": [1734, 1770, 1781, 1786, 1837], "patter": 1785, "pattern": [106, 1736, 1737, 1738, 1740, 1748, 1768, 1770, 1785, 1788, 1801, 1809, 1817], "paus": 1788, "pb": [1707, 1731, 1736, 1748, 1777], "pbe": [295, 318, 319, 1695, 1697, 1698, 1699, 1700, 1701, 1703, 1739, 1757, 1758, 1759, 1766, 1781, 1800], "pbe0": [295, 318, 319, 1230, 1471, 1695, 1696, 1697, 1698, 1700, 1701, 1703, 1704, 1714, 1757, 1758, 1766, 1800, 1837, 1842], "pbe1w": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "pbe50": [295, 318, 319, 1695, 1698, 1700, 1703, 1758, 1766, 1800], "pbe_c": 1757, "pbe_x": 1757, "pbeb95": [295, 1695, 1696, 1697, 1698, 1700, 1702, 1758, 1766], "pbeh": [106, 295, 1718, 1757, 1766, 1774, 1781], "pbeh3c": [106, 295, 318, 319, 1695, 1698, 1700, 1703, 1718, 1758, 1766, 1774, 1800], "pbelyp1w": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "pbep86": [295, 1695, 1696, 1697, 1698, 1700, 1714, 1758, 1766, 1842], "pbepb": [295, 1695, 1696, 1697, 1698, 1700, 1758, 1766], "pbs_jobid": 1767, "pbs_nodefil": 1767, "pbs_o_workdir": 1767, "pccp": [1692, 1752, 1837], "pcg": [946, 1213, 1225, 1281, 1284, 1704], "pcg_beta_typ": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "pcg_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "pcg_maxit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "pcm": [0, 1, 2, 150, 366, 376, 379, 397, 400, 769, 1209, 1375, 1376, 1704, 1705, 1709, 1724, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "pcm__input": [366, 376, 379, 397], "pcm_cc_type": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "pcm_enabl": 150, "pcm_scf_type": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "pcmpotentialint": 1817, "pcmsolver": [366, 379, 400, 1151, 1221, 1227, 1377, 1704, 1736, 1738, 1748, 1754, 1777, 1780, 1785, 1786, 1842], "pcmsolver_dir": 1803, "pcmsolver_librari": 1785, "pcmsolver_parsed_fnam": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "pcmsolverconfig": 1803, "pcseg": [1231, 1485, 1694, 1704, 1707, 1731, 1732, 1733, 1838], "pcsseg": [1694, 1707, 1731, 1732, 1733], "pctc": [106, 1759, 1774], "pcv": [1694, 1732, 1733], "pcv5z": [1694, 1707, 1731, 1732], "pcv6z": [1694, 1707, 1731, 1732], "pcv_5pd_z": [1694, 1707, 1731, 1732], "pcv_6pd_z": [1694, 1707, 1731, 1732], "pcv_dpd_z": [1694, 1707, 1731, 1732], "pcv_qpd_z": [1694, 1707, 1731, 1732], "pcv_tpd_z": [1694, 1707, 1731, 1732], "pcvdz": [1694, 1707, 1714, 1731, 1732, 1842], "pcvqz": [1694, 1707, 1731, 1732, 1740], "pcvtz": [1692, 1694, 1707, 1731, 1732, 1752], "pcvxz": [1733, 1836], "pd": [1707, 1731, 1832], "pdb": 1770, "pdf": [1735, 1764], "pdm": [1225, 1288, 1704, 1708, 1798], "pe": [0, 1, 2, 103, 400, 1392, 1704, 1705, 1709, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "pe_ecp": [0, 1, 2, 1704, 1707, 1730, 1731, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "peak": 1735, "pedersen": [1734, 1798], "pedersen1995": [1734, 1841], "peform": [303, 1775], "penalti": 1838, "pend": 1776, "penetr": [1015, 1216, 1704], "peng": [1734, 1802], "pentacen": [1692, 1710, 1752], "pentanediol": [1714, 1770, 1842], "pentupli": [697, 1206, 1704], "peopl": 1804, "pep": 1804, "pep0000model": 1804, "pep1": [1777, 1830], "pepxxxx": 1804, "per": [1, 8, 88, 100, 106, 138, 148, 150, 259, 262, 263, 310, 356, 361, 389, 410, 422, 495, 502, 505, 525, 531, 549, 628, 771, 868, 1031, 1065, 1102, 1114, 1123, 1125, 1126, 1127, 1128, 1159, 1160, 1161, 1162, 1164, 1165, 1168, 1177, 1192, 1197, 1198, 1200, 1202, 1203, 1206, 1209, 1210, 1218, 1219, 1221, 1222, 1226, 1231, 1336, 1515, 1517, 1576, 1625, 1640, 1642, 1655, 1704, 1706, 1714, 1730, 1739, 1742, 1754, 1755, 1771, 1776, 1788, 1794, 1801, 1802, 1810, 1832, 1837, 1838, 1841, 1842], "perceiv": [660, 1206, 1704], "percent": [1084, 1130, 1219, 1221, 1704, 1838], "percentag": [729, 1208, 1229, 1231, 1405, 1499, 1704, 1802], "percol": 1757, "perdew": [295, 318, 319, 1695, 1697, 1698, 1699, 1703, 1758, 1766, 1800], "perfectli": 1843, "perfom": 1752, "perform": [0, 10, 84, 97, 117, 139, 154, 155, 156, 157, 158, 159, 277, 284, 295, 300, 301, 302, 318, 319, 342, 356, 390, 399, 412, 516, 581, 586, 596, 613, 616, 629, 630, 631, 640, 644, 653, 670, 672, 676, 679, 707, 708, 742, 749, 753, 837, 841, 921, 922, 952, 1197, 1198, 1200, 1202, 1203, 1206, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1220, 1222, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1236, 1279, 1399, 1409, 1417, 1423, 1453, 1485, 1498, 1550, 1566, 1596, 1645, 1646, 1649, 1668, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1681, 1682, 1684, 1686, 1687, 1688, 1689, 1690, 1704, 1711, 1714, 1722, 1730, 1735, 1737, 1738, 1740, 1743, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1762, 1763, 1766, 1767, 1770, 1772, 1776, 1781, 1782, 1789, 1792, 1798, 1800, 1801, 1802, 1805, 1809, 1810, 1817, 1821, 1823, 1824, 1828, 1829, 1831, 1832, 1833, 1836, 1837, 1838, 1841, 1842, 1843, 1844], "perhap": [387, 1738, 1743, 1757, 1767, 1779], "perkin": 1734, "perl": 1738, "perman": 1748, "permiss": [1743, 1788], "permit": [281, 304, 635, 648, 652, 1206, 1704, 1738, 1743, 1770, 1775, 1799, 1832, 1834], "permitt": 1706, "permut": [0, 330, 355, 358, 1708, 1838], "permutation": 1817, "pernal": [1734, 1759], "perpendicular": [1041, 1218, 1704, 1770, 1828, 1844], "persist": 1817, "person": 1786, "perspect": [1757, 1824], "pert": 1785, "pertain": [226, 1738, 1833], "pertin": [1767, 1823, 1832], "pertub": [295, 1766, 1792, 1793], "perturb": [0, 84, 103, 106, 237, 295, 318, 319, 381, 382, 442, 446, 484, 518, 542, 548, 552, 614, 622, 665, 674, 677, 690, 703, 704, 758, 873, 957, 1024, 1199, 1200, 1202, 1203, 1206, 1208, 1213, 1217, 1225, 1229, 1230, 1231, 1289, 1423, 1587, 1588, 1589, 1673, 1689, 1695, 1696, 1698, 1700, 1704, 1714, 1724, 1734, 1742, 1743, 1744, 1745, 1746, 1753, 1758, 1761, 1766, 1776, 1777, 1785, 1790, 1792, 1793, 1800, 1806, 1826, 1828, 1829, 1833, 1842, 1844], "perturb_cb": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "perturb_cbs_coupl": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "perturb_dipol": [0, 1, 2, 1588, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "perturb_grad": 103, "perturb_h": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "perturb_magnitud": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "perturb_with": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "peter": [1740, 1750], "petit": [103, 1231, 1628, 1704], "petite_list": [103, 132], "petite_list1": 103, "petitelist": [100, 103, 132, 1827], "pf": [615, 1206, 1704], "pfxc": 1738, "ph": 1770, "ph3": [1714, 1842], "phase": [440, 457, 823, 826, 884, 1199, 1210, 1231, 1656, 1704, 1742, 1838, 1841], "phenol": [1714, 1770, 1842], "phenomen": 1757, "phenomenolog": [377, 1841], "phenomenon": 2, "phenyl": [1770, 1833], "phenylacetylen": [1714, 1842], "phenylbenzenesulfonamid": 1833, "phenylenedinitren": 1729, "phenylmethanol": 1833, "phenylpropanenitril": 1833, "phi": [1714, 1802, 1842], "phi_": [574, 1206, 1704, 1742, 1755, 1757, 1829, 1838], "phi_0": [1742, 1755], "phi_a": 1802, "phi_b": 1802, "phi_i": [1742, 1755], "phi_n": [1112, 1221, 1704, 1750], "phi_point": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "philosophi": [1737, 1804, 1823], "phosphinothioylsulfanylethyl": 1833, "phosphoryl": 1833, "photon": [369, 377, 1790], "php": [1738, 1750], "phy": [297, 347, 356, 443, 479, 519, 543, 693, 885, 1199, 1200, 1202, 1203, 1206, 1210, 1230, 1469, 1692, 1704, 1714, 1734, 1740, 1752, 1762, 1781, 1837, 1842], "physconst": 1764, "physic": [106, 377, 400, 620, 1206, 1704, 1714, 1726, 1742, 1743, 1757, 1764, 1767, 1770, 1777, 1781, 1828, 1837, 1838, 1842, 1844], "physicist": 1756, "physreva": 1734, "physrevlett": [295, 318, 319, 1695, 1697, 1698, 1702, 1703, 1758, 1766, 1800], "pi": [81, 295, 308, 368, 369, 377, 576, 1057, 1058, 1206, 1218, 1231, 1556, 1684, 1692, 1704, 1706, 1714, 1738, 1752, 1766, 1768, 1776, 1781, 1798, 1810, 1837, 1838, 1842], "pick": [897, 1125, 1211, 1221, 1704, 1750, 1771, 1788, 1837, 1838, 1844], "pictur": [76, 1770, 1837], "pid": [86, 288, 289, 339, 340, 1767, 1838], "pidspac": 354, "piec": [2, 1714, 1743, 1757, 1824, 1842], "piecuch": [1714, 1734, 1738, 1755, 1842], "pin": 1757, "pinch": 1738, "pinski": [1734, 1763], "pint": 1738, "piotr": [1692, 1734, 1752], "pip": [1747, 1750, 1764, 1805, 1806], "pipek": [117, 664, 1061, 1206, 1218, 1704], "pipek_mezei": [965, 1214, 1704], "pipelin": 1788, "piquem": 1734, "pittner": [1229, 1399, 1704], "pitzer": [13, 150, 643, 1206, 1704], "pitzer_to_ci_order_onel": 13, "pitzer_to_ci_order_twoel": 13, "pivot": 100, "pk": [92, 623, 721, 1166, 1206, 1207, 1221, 1231, 1576, 1592, 1609, 1620, 1704, 1708, 1714, 1729, 1749, 1754, 1803, 1832, 1836, 1838, 1842], "pk_all_nonsym": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "pk_max_bucket": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "pk_ref": [1714, 1842], "pkzb": [295, 318, 319, 1695, 1697, 1698, 1702, 1703, 1758, 1766, 1800], "pl": 1764, "place": [0, 1, 2, 100, 279, 321, 389, 406, 1197, 1704, 1714, 1730, 1738, 1740, 1743, 1748, 1755, 1757, 1764, 1767, 1770, 1775, 1782, 1785, 1788, 1795, 1796, 1801, 1802, 1804, 1808, 1810, 1815, 1828, 1829, 1832, 1833, 1838, 1840, 1842, 1844], "placehold": [185, 186, 1748], "plai": [2, 84, 103, 1838], "plain": [371, 1740, 1764, 1771, 1794, 1798, 1808], "plan": [265, 1736, 1740, 1767, 1768, 1772, 1777, 1781, 1785, 1794, 1804], "planar": 1802, "planck": 1706, "planck_const": 1706, "planck_constant_in_ev_": 1706, "planck_constant_over_2_pi": 1706, "planck_constant_over_2_pi_in_ev_": 1706, "planck_constant_over_2_pi_times_c_in_mev_fm": 1706, "planck_length": 1706, "planck_mass": 1706, "planck_mass_energy_equivalent_in_gev": 1706, "planck_temperatur": 1706, "planck_tim": 1706, "plane": [106, 139, 1226, 1311, 1322, 1360, 1704, 1714, 1730, 1743, 1782, 1833, 1842], "platform": [1734, 1748, 1767, 1780, 1788, 1808], "pleas": [0, 2, 1126, 1221, 1704, 1735, 1736, 1737, 1738, 1748, 1755, 1757, 1759, 1762, 1764, 1767, 1770, 1788, 1802, 1808, 1817, 1832, 1837, 1838], "plesset": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "plot": [0, 76, 106, 324, 377, 1040, 1052, 1218, 1704, 1714, 1750, 1761, 1770, 1788, 1790, 1791, 1842], "plot_fit": 1761, "plot_spectrum": 0, "plu": [8, 295, 298, 348, 934, 1025, 1026, 1027, 1102, 1213, 1217, 1221, 1231, 1578, 1695, 1696, 1698, 1700, 1704, 1733, 1743, 1746, 1748, 1758, 1759, 1766, 1772, 1775, 1776, 1782, 1791, 1792, 1802], "plug": [656, 1206, 1704], "plugin": [223, 224, 225, 226, 1714, 1715, 1736, 1737, 1738, 1747, 1748, 1764, 1767, 1777, 1780, 1785, 1801, 1805, 1806, 1819, 1842], "plugin_": 1764, "plugin_load": 1808, "plump": 367, "pluse": 8, "pm": [1182, 1222, 1704], "pmatrix": [0, 1836, 1841], "pmem": 1767, "pmlocal": 1827, "pna": [295, 318, 319, 1695, 1698, 1702, 1703, 1749, 1758, 1766, 1800], "pna_6w": 1749, "png": [1764, 1770, 1788], "pno": [984, 1214, 1704, 1763], "pno_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "po": [1707, 1731, 1786], "podeszwa": [1734, 1759, 1837], "poelman": 1781, "point": [0, 1, 2, 8, 17, 20, 89, 91, 100, 103, 105, 106, 110, 111, 120, 138, 149, 150, 159, 275, 284, 295, 306, 314, 377, 386, 390, 569, 573, 574, 593, 616, 617, 619, 635, 652, 657, 660, 697, 698, 707, 770, 775, 776, 969, 970, 1031, 1099, 1114, 1134, 1135, 1136, 1143, 1144, 1206, 1209, 1214, 1218, 1220, 1221, 1222, 1226, 1230, 1231, 1232, 1314, 1339, 1347, 1477, 1493, 1494, 1495, 1496, 1515, 1517, 1533, 1535, 1536, 1542, 1544, 1590, 1597, 1625, 1632, 1635, 1659, 1666, 1682, 1690, 1692, 1704, 1710, 1711, 1714, 1722, 1726, 1730, 1733, 1735, 1738, 1739, 1740, 1741, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1767, 1768, 1769, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1790, 1791, 1792, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1828, 1829, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "point_group": 106, "point_valu": 119, "pointer": [100, 148, 150, 1797, 1810, 1817, 1821], "pointfunct": [129, 146, 147, 1827], "pointgroup": [20, 106, 1827], "poisson": 1754, "pol_3a": 1722, "polak": [1225, 1284, 1704], "polak_ribier": [948, 1213, 1225, 1284, 1704], "polar": [1, 2, 286, 298, 337, 348, 1017, 1018, 1020, 1216, 1686, 1704, 1711, 1714, 1757, 1770, 1776, 1777, 1790, 1803, 1838, 1842], "polaris": [1749, 1754, 1803], "polariz": [381, 382, 454, 539, 551, 669, 673, 715, 1152, 1199, 1203, 1206, 1207, 1221, 1227, 1228, 1381, 1384, 1390, 1669, 1686, 1687, 1704, 1706, 1714, 1724, 1725, 1738, 1742, 1776, 1780, 1817, 1826, 1842], "pole": [0, 1, 377, 410, 1197, 1225, 1258, 1261, 1262, 1264, 1685, 1704, 1776, 1798, 1799, 1841], "polici": [265, 321, 1125, 1126, 1221, 1704, 1740, 1771, 1794, 1837], "poll": 1788, "polynomi": 1763, "poor": [584, 1206, 1704, 1757, 1763, 1802, 1841], "poorli": 1802, "pop": [5, 13, 106], "popl": [647, 929, 1206, 1213, 1704, 1707, 1730, 1731, 1734, 1771], "popovici": 1734, "popul": [671, 1128, 1206, 1221, 1704, 1755, 1823], "popular": [1730, 1742, 1752, 1757, 1771, 1828, 1838, 1844], "populateextern": 275, "portabl": 1810, "portfolio": 1788, "portion": [380, 1709, 1711, 1714, 1730, 1743, 1752, 1768, 1776, 1782, 1802, 1808, 1838, 1840, 1842], "posit": [5, 100, 106, 275, 335, 356, 601, 1125, 1206, 1221, 1704, 1714, 1750, 1757, 1759, 1771, 1774, 1782, 1786, 1788, 1794, 1802, 1804, 1817, 1828, 1836, 1837, 1838, 1841, 1842, 1844], "position_camera": 323, "posix": 1738, "possess": [1833, 1835], "possibl": [0, 1, 2, 13, 106, 279, 296, 329, 355, 358, 402, 403, 409, 411, 428, 430, 434, 444, 445, 446, 454, 456, 465, 467, 474, 475, 482, 483, 484, 492, 506, 513, 539, 551, 557, 568, 570, 571, 573, 574, 575, 584, 586, 589, 590, 592, 599, 600, 608, 610, 613, 615, 617, 619, 623, 624, 627, 635, 636, 637, 638, 640, 641, 643, 647, 650, 652, 655, 656, 662, 664, 665, 666, 668, 669, 673, 674, 676, 677, 680, 683, 693, 696, 701, 702, 703, 705, 707, 708, 717, 719, 721, 725, 726, 727, 730, 731, 732, 733, 746, 748, 750, 758, 769, 773, 810, 811, 830, 835, 843, 845, 851, 858, 867, 874, 880, 889, 891, 892, 898, 899, 900, 926, 929, 935, 944, 946, 947, 948, 951, 959, 960, 961, 963, 964, 965, 968, 975, 989, 1000, 1011, 1013, 1015, 1018, 1047, 1048, 1049, 1075, 1098, 1106, 1107, 1119, 1120, 1125, 1129, 1146, 1147, 1158, 1163, 1166, 1167, 1187, 1195, 1197, 1198, 1199, 1200, 1202, 1203, 1204, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1218, 1219, 1220, 1221, 1222, 1223, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1248, 1279, 1281, 1282, 1284, 1291, 1292, 1293, 1296, 1297, 1313, 1324, 1329, 1338, 1339, 1342, 1346, 1352, 1354, 1367, 1368, 1375, 1376, 1383, 1384, 1394, 1398, 1399, 1402, 1403, 1417, 1429, 1437, 1443, 1445, 1446, 1454, 1470, 1472, 1475, 1479, 1484, 1490, 1500, 1501, 1502, 1505, 1507, 1509, 1518, 1527, 1528, 1534, 1537, 1563, 1589, 1599, 1601, 1609, 1615, 1620, 1626, 1628, 1629, 1630, 1631, 1633, 1634, 1649, 1658, 1664, 1704, 1714, 1738, 1742, 1743, 1746, 1749, 1753, 1754, 1755, 1756, 1757, 1762, 1763, 1767, 1769, 1770, 1771, 1775, 1781, 1785, 1789, 1794, 1798, 1799, 1801, 1802, 1803, 1804, 1809, 1810, 1817, 1824, 1829, 1833, 1836, 1837, 1838, 1841, 1842], "possibli": [1748, 1788, 1804, 1809, 1835], "post": [74, 150, 267, 312, 314, 439, 473, 568, 580, 601, 664, 737, 818, 850, 924, 1079, 1199, 1200, 1206, 1208, 1210, 1213, 1219, 1224, 1225, 1229, 1231, 1233, 1257, 1410, 1541, 1704, 1714, 1738, 1742, 1759, 1763, 1769, 1770, 1771, 1787, 1789, 1790, 1791, 1798, 1809, 1814, 1831, 1832, 1842], "post_scf": 393, "postdat": 1788, "posteriori": [106, 1759, 1774], "postreleas": 1787, "pot": [1228, 1393, 1704, 1749], "potassium": [1714, 1842], "potenit": 138, "potenti": [73, 76, 84, 89, 103, 106, 111, 121, 150, 295, 602, 614, 617, 776, 896, 925, 1015, 1206, 1209, 1211, 1213, 1216, 1225, 1227, 1228, 1231, 1262, 1264, 1376, 1392, 1393, 1583, 1590, 1597, 1598, 1611, 1659, 1660, 1669, 1678, 1690, 1704, 1706, 1711, 1714, 1726, 1738, 1749, 1750, 1754, 1757, 1761, 1766, 1770, 1776, 1778, 1781, 1782, 1790, 1791, 1798, 1799, 1802, 1803, 1805, 1824, 1832, 1836, 1837, 1842], "potential_grad": 103, "potential_integr": 110, "potential_vari": 150, "potentialint": [1817, 1827], "potfil": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "pov": 323, "powel": [1226, 1329, 1704], "power": [100, 1056, 1218, 1704, 1740, 1747, 1771, 1781, 1802, 1828, 1829, 1832, 1833, 1838, 1844], "pp": [1225, 1256, 1271, 1704, 1781], "ppl": [951, 1213, 1704], "ppl_type": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "pprint": 1752, "pps5": [1692, 1752], "pq": [13, 1753, 1798, 1817, 1838], "pqpair_idx": 1817, "pqr": 13, "pr": [1753, 1786, 1788, 1838], "practic": [8, 208, 209, 210, 342, 586, 647, 1206, 1704, 1711, 1734, 1737, 1738, 1743, 1748, 1757, 1759, 1763, 1771, 1774, 1777, 1781, 1785, 1786, 1804, 1809, 1829, 1837, 1838], "pragma": 1822, "prakash": 1836, "pre": [14, 128, 130, 145, 150, 267, 434, 982, 1199, 1214, 1704, 1708, 1737, 1738, 1740, 1742, 1746, 1747, 1748, 1749, 1757, 1759, 1760, 1762, 1765, 1773, 1775, 1782, 1783, 1784, 1785, 1787, 1803, 1809, 1814, 1819, 1832, 1833, 1838, 1839], "pre_commit": 1747, "prec": [106, 389], "preced": [284, 609, 1206, 1704, 1735, 1740, 1743, 1748, 1757, 1782, 1783, 1785, 1801], "preceed": 1796, "precis": [2, 100, 1125, 1221, 1704, 1735, 1757, 1771, 1810, 1837], "preclud": 1743, "precompil": 1781, "precomput": 0, "precondit": [0, 329, 335, 725, 811, 946, 949, 950, 1207, 1210, 1213, 1225, 1281, 1285, 1286, 1704, 1753, 1755], "precondition": [0, 1, 2, 329, 335, 483, 831, 832, 1200, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "predefin": [1743, 1747, 1752, 1756, 1809], "predict": [1781, 1786], "prefactor": [100, 329, 368, 369, 1008, 1215, 1704, 1746, 1756], "prefer": [106, 150, 151, 152, 174, 175, 207, 211, 238, 239, 244, 250, 252, 254, 275, 279, 342, 366, 379, 430, 575, 586, 605, 703, 1199, 1206, 1704, 1730, 1738, 1743, 1748, 1753, 1756, 1759, 1767, 1768, 1770, 1774, 1798, 1814, 1819, 1835, 1837, 1838], "preferenti": [1738, 1743, 1759, 1774], "prefix": [0, 86, 100, 148, 205, 288, 289, 339, 340, 388, 934, 1025, 1026, 1027, 1213, 1217, 1231, 1578, 1704, 1738, 1746, 1772, 1775, 1779, 1785, 1786, 1791, 1792, 1810, 1828, 1832], "pregener": 1738, "preiter": [276, 1735], "preliminari": [1231, 1485, 1500, 1704, 1781], "prematur": [883, 1210, 1704], "prep": 1838, "prepar": [2, 76, 84, 100, 114, 148, 267, 367, 372, 394, 1730, 1737, 1738, 1743, 1749, 1759, 1768, 1788, 1804, 1835, 1840, 1844], "prepare_result": 1794, "prepend": [96, 317, 365, 1738, 1743, 1748, 1771, 1799, 1832], "preprint": [1734, 1781], "preprocess": [380, 1767, 1768], "preprocessor": [1738, 1767, 1832], "prereleas": 1788, "prerequisit": [1735, 1781, 1831], "prescrib": 106, "presenc": [284, 670, 1024, 1206, 1217, 1704, 1714, 1724, 1740, 1770, 1838, 1842], "present": [2, 106, 150, 176, 267, 284, 286, 298, 337, 348, 381, 382, 383, 390, 609, 638, 641, 827, 944, 1125, 1206, 1210, 1213, 1221, 1226, 1231, 1339, 1620, 1704, 1714, 1738, 1740, 1743, 1749, 1753, 1754, 1755, 1756, 1757, 1759, 1763, 1764, 1767, 1770, 1771, 1774, 1776, 1782, 1785, 1786, 1788, 1789, 1794, 1798, 1802, 1803, 1804, 1824, 1826, 1829, 1832, 1833, 1837, 1838, 1839, 1840, 1842], "preserv": [106, 279, 393, 1743, 1770, 1801, 1817, 1841], "preset": 1838, "presort": [61, 1708, 1838], "presort_so_tei": 90, "press": [1692, 1734, 1752, 1781, 1828], "pressur": [390, 1232, 1665, 1704, 1706, 1714, 1842, 1843], "presum": 1801, "pretti": [389, 1837], "prevent": [138, 147, 1231, 1649, 1704, 1756, 1767, 1801, 1802, 1810, 1821, 1832, 1833, 1837, 1841], "preview": 1788, "previou": [18, 284, 393, 470, 474, 680, 729, 731, 760, 808, 1125, 1186, 1200, 1206, 1208, 1209, 1210, 1221, 1222, 1224, 1225, 1226, 1229, 1230, 1231, 1241, 1268, 1331, 1332, 1333, 1357, 1358, 1359, 1405, 1445, 1469, 1470, 1499, 1704, 1714, 1738, 1740, 1742, 1743, 1754, 1757, 1767, 1768, 1770, 1771, 1788, 1798, 1802, 1817, 1828, 1832, 1833, 1837, 1838, 1842, 1844], "previous": [243, 279, 830, 1210, 1224, 1241, 1704, 1738, 1743, 1755, 1759, 1767, 1771, 1774, 1792, 1809, 1817, 1838, 1844], "prim": 81, "primari": [8, 21, 75, 150, 265, 372, 898, 1195, 1212, 1223, 1226, 1230, 1231, 1313, 1437, 1484, 1704, 1714, 1730, 1736, 1737, 1738, 1740, 1743, 1748, 1752, 1756, 1757, 1767, 1771, 1788, 1794, 1801, 1802, 1817, 1828, 1836, 1837, 1842, 1844], "primarili": [106, 1757, 1767, 1781, 1788, 1824, 1838], "primit": [8, 81, 1101, 1220, 1704, 1775, 1810, 1824], "primitivetyp": 1827, "princip": [1226, 1339, 1704, 1802, 1838], "principal_ax": [1226, 1339, 1704], "principl": [697, 1206, 1704, 1734, 1743, 1781, 1817, 1828, 1838, 1844], "print": [0, 1, 2, 8, 9, 15, 16, 64, 73, 75, 76, 86, 87, 88, 100, 103, 105, 106, 111, 114, 115, 118, 119, 138, 147, 148, 150, 227, 228, 229, 230, 261, 267, 271, 282, 296, 300, 301, 302, 318, 319, 326, 327, 331, 332, 335, 342, 346, 356, 374, 376, 380, 383, 386, 389, 395, 397, 399, 401, 448, 452, 453, 487, 498, 525, 549, 644, 659, 667, 679, 700, 716, 807, 833, 868, 869, 886, 941, 998, 999, 1098, 1118, 1138, 1154, 1197, 1199, 1200, 1202, 1203, 1206, 1210, 1213, 1215, 1220, 1225, 1226, 1229, 1231, 1277, 1355, 1414, 1483, 1593, 1594, 1608, 1647, 1649, 1650, 1657, 1662, 1704, 1730, 1733, 1735, 1738, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1819, 1820, 1822, 1823, 1825, 1826, 1827, 1828, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "print_atom_vector": 100, "print_basi": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "print_bond_angl": 106, "print_clust": 106, "print_density_threshold": 138, "print_detail": [80, 138], "print_detail_out": 8, "print_dist": 106, "print_dpd_lookup": 90, "print_energi": [68, 84], "print_global_opt": 114, "print_gradi": 68, "print_head": [27, 76, 84, 92, 147, 1768, 1786], "print_hessian": 68, "print_in_input_format": 106, "print_level": [380, 1768], "print_lvl": 84, "print_mat": [1138, 1221, 1704, 1810], "print_mo": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "print_module_opt": 114, "print_noon": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "print_opt_param": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "print_orbit": 84, "print_out": [8, 9, 15, 16, 64, 68, 73, 80, 87, 88, 100, 106, 115, 119, 138, 148, 267, 300, 301, 302, 306, 307, 318, 319, 1772, 1800, 1828, 1832, 1833, 1834, 1844], "print_out_in_angstrom": 106, "print_out_in_bohr": 106, "print_out_of_plan": 106, "print_preiter": 84, "print_rotational_const": 106, "print_stability_analysi": 84, "print_stdout": [1743, 1752], "print_tensor_pqq": 75, "print_trail": 76, "print_trajectory_xyz_fil": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "print_vari": 1832, "print_vector": 13, "print_vib": 1772, "printer": [335, 389], "printf": 1821, "printlvl": 335, "printout": [2, 1841], "prior": [661, 1206, 1224, 1231, 1240, 1560, 1704, 1730, 1837, 1838], "priori": [1817, 1838], "prioriti": [265, 434, 1199, 1704, 1740, 1742, 1743, 1767, 1794], "pritchard": [1734, 1777, 1780, 1781, 1786], "privat": [84, 1781, 1817], "privileg": [1231, 1658, 1704, 1841], "probabl": [2, 367, 697, 881, 1206, 1210, 1704, 1738, 1750, 1757, 1764, 1776, 1785, 1788, 1808, 1828, 1844], "probe": 1781, "problem": [0, 266, 270, 271, 276, 277, 280, 342, 356, 433, 466, 498, 507, 514, 609, 726, 1199, 1200, 1201, 1202, 1206, 1208, 1225, 1231, 1242, 1499, 1704, 1717, 1738, 1742, 1743, 1753, 1755, 1757, 1770, 1771, 1781, 1782, 1786, 1790, 1804, 1808, 1810, 1821, 1828, 1837, 1838, 1839, 1841, 1844], "problemat": [1770, 1790, 1798, 1833], "proc": [1788, 1819], "proc_tabl": 1809, "proce": [106, 300, 301, 302, 318, 319, 640, 1206, 1704, 1737, 1738, 1771, 1772, 1800, 1837], "procedur": [0, 97, 106, 267, 284, 321, 393, 433, 466, 474, 496, 507, 514, 672, 686, 687, 688, 704, 729, 783, 784, 824, 825, 870, 918, 933, 1059, 1070, 1088, 1199, 1200, 1201, 1202, 1206, 1208, 1210, 1213, 1218, 1219, 1225, 1231, 1242, 1249, 1269, 1564, 1565, 1568, 1573, 1574, 1704, 1711, 1714, 1738, 1740, 1742, 1743, 1753, 1755, 1756, 1757, 1759, 1767, 1768, 1770, 1771, 1776, 1777, 1781, 1785, 1787, 1789, 1798, 1799, 1801, 1808, 1809, 1828, 1829, 1832, 1833, 1834, 1837, 1838, 1840, 1842, 1844], "process": [0, 2, 8, 86, 265, 285, 287, 336, 338, 357, 380, 570, 994, 1206, 1215, 1704, 1714, 1734, 1737, 1738, 1740, 1743, 1746, 1755, 1757, 1764, 1767, 1768, 1769, 1770, 1772, 1785, 1786, 1794, 1804, 1817, 1824, 1828, 1831, 1832, 1835, 1838, 1842, 1844], "process_grid": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "process_input": [350, 1768, 1777, 1835], "processor": [1231, 1595, 1704, 1737], "prochnow": [1734, 1781], "procrout": [1743, 1757, 1759, 1764, 1809, 1827, 1841], "procud": 1802, "prodcut": 84, "produc": [76, 314, 644, 667, 835, 1206, 1210, 1226, 1231, 1372, 1564, 1704, 1743, 1748, 1750, 1752, 1757, 1759, 1791, 1802, 1808, 1817, 1836, 1837, 1838, 1840, 1841], "product": [0, 84, 100, 128, 148, 149, 277, 329, 335, 342, 356, 666, 1206, 1704, 1730, 1733, 1742, 1753, 1755, 1756, 1757, 1770, 1771, 1776, 1781, 1783, 1810, 1817, 1835, 1837, 1838, 1841, 1843], "product_count": [277, 342, 356], "profici": 1748, "profil": [322, 325, 1231, 1620, 1704, 1748, 1777], "program": [106, 205, 235, 236, 241, 242, 265, 267, 284, 295, 303, 318, 319, 434, 574, 580, 586, 590, 609, 611, 614, 616, 622, 627, 639, 643, 648, 656, 660, 667, 679, 681, 690, 708, 709, 711, 712, 755, 833, 837, 1125, 1199, 1206, 1208, 1210, 1220, 1221, 1224, 1241, 1681, 1683, 1704, 1714, 1715, 1730, 1734, 1735, 1738, 1740, 1742, 1743, 1744, 1745, 1748, 1750, 1751, 1753, 1755, 1757, 1759, 1763, 1766, 1767, 1770, 1771, 1774, 1775, 1777, 1780, 1781, 1789, 1791, 1792, 1793, 1794, 1798, 1800, 1802, 1816, 1824, 1828, 1832, 1834, 1835, 1837, 1838, 1842, 1843, 1844], "programm": [1767, 1801, 1808, 1817, 1818, 1824], "progress": [106, 1743, 1802], "prohibit": [1738, 1763], "proj": 1738, "project": [75, 115, 150, 267, 295, 386, 399, 573, 617, 707, 1206, 1231, 1485, 1704, 1735, 1738, 1747, 1748, 1755, 1759, 1763, 1764, 1766, 1770, 1771, 1781, 1785, 1786, 1788, 1797, 1808, 1810, 1824, 1825, 1838, 1841], "project_dens": 75, "project_rot": [386, 399], "project_tran": [386, 399], "promin": 1809, "prompt": [106, 1738, 1748, 1768, 1802, 1828, 1833], "proof": 1743, "prop": [0, 70, 268, 382, 1742, 1785, 1799, 1826, 1827, 1833], "prop_al": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "prop_root": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "prop_sym": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "propag": [1, 26, 295, 1197, 1225, 1263, 1668, 1704, 1738, 1766, 1777, 1790], "propan": 1833, "proper": [608, 681, 1206, 1704, 1735, 1738, 1743, 1757, 1789, 1792, 1820, 1838], "properli": [1757, 1767], "properti": [0, 1, 2, 21, 84, 111, 147, 150, 265, 268, 291, 314, 317, 329, 341, 356, 365, 381, 386, 414, 418, 419, 489, 490, 526, 527, 601, 608, 668, 669, 681, 743, 750, 942, 1112, 1156, 1198, 1200, 1201, 1202, 1206, 1208, 1213, 1225, 1231, 1278, 1619, 1704, 1714, 1721, 1730, 1733, 1734, 1735, 1739, 1740, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1790, 1791, 1792, 1794, 1795, 1797, 1798, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1827, 1829, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "properties_al": 1785, "properties_origin": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "propertynam": 111, "proport": [1230, 1231, 1481, 1624, 1704, 1767], "propos": [2, 1759, 1760, 1770, 1777, 1830, 1838], "props1": [1714, 1842], "props2": [1714, 1842], "props3": [1714, 1842], "props4": [1714, 1799, 1842], "prospect": [1743, 1786], "protect": [1786, 1788, 1808], "protein": [11, 1692, 1752, 1763], "protocol": [87, 265, 1740, 1794, 1804], "protointvector": [88, 1827], "protomodel": [2, 1827], "proton": 1706, "proton_charge_to_mass_quoti": 1706, "proton_compton_wavelength": 1706, "proton_compton_wavelength_over_2_pi": 1706, "proton_electron_mass_ratio": 1706, "proton_g_factor": 1706, "proton_gyromag_ratio": 1706, "proton_gyromag_ratio_over_2_pi": 1706, "proton_mag_mom": 1706, "proton_mag_mom_to_bohr_magneton_ratio": 1706, "proton_mag_mom_to_nuclear_magneton_ratio": 1706, "proton_mag_shielding_correct": 1706, "proton_mass": 1706, "proton_mass_energy_equival": 1706, "proton_mass_energy_equivalent_in_mev": 1706, "proton_mass_in_u": 1706, "proton_molar_mass": 1706, "proton_muon_mass_ratio": 1706, "proton_neutron_mag_mom_ratio": 1706, "proton_neutron_mass_ratio": 1706, "proton_rms_charge_radiu": 1706, "proton_tau_mass_ratio": 1706, "prototyp": 1824, "protovector": [148, 1827], "prove": 1747, "proven": [106, 372, 378, 1768], "provid": [0, 1, 2, 8, 20, 106, 112, 139, 150, 268, 303, 314, 329, 335, 394, 584, 625, 679, 1097, 1126, 1206, 1220, 1221, 1704, 1714, 1730, 1733, 1734, 1737, 1738, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1753, 1754, 1755, 1757, 1759, 1761, 1762, 1764, 1765, 1767, 1770, 1771, 1773, 1774, 1775, 1779, 1781, 1782, 1783, 1784, 1785, 1788, 1790, 1791, 1792, 1794, 1798, 1799, 1801, 1802, 1803, 1808, 1810, 1817, 1824, 1828, 1829, 1832, 1833, 1837, 1838, 1839, 1841, 1842, 1843, 1844], "provision": [150, 1738], "proxim": [1228, 1231, 1378, 1532, 1704, 1749], "prudent": 1743, "prune": [321, 968, 1133, 1142, 1214, 1221, 1231, 1492, 1531, 1532, 1631, 1704, 1714, 1743, 1757, 1842], "psa": [662, 1206, 1704], "pseudo": [662, 1206, 1704, 1764], "pseudocanon": [989, 1215, 1704, 1746], "pseudoinvers": [100, 1135, 1221, 1704], "pseudopotenti": [602, 1206, 1704], "pseudospectr": 1838, "pshell": 1817, "psi": [0, 1, 2, 22, 23, 24, 25, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 85, 100, 150, 158, 198, 250, 284, 288, 289, 295, 318, 319, 339, 340, 354, 390, 601, 609, 611, 632, 633, 634, 652, 656, 660, 1170, 1206, 1221, 1225, 1293, 1704, 1708, 1711, 1714, 1725, 1730, 1738, 1740, 1742, 1743, 1746, 1749, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1763, 1764, 1766, 1767, 1770, 1771, 1772, 1775, 1777, 1781, 1782, 1788, 1789, 1790, 1791, 1792, 1798, 1800, 1803, 1808, 1810, 1823, 1829, 1833, 1834, 1835, 1837, 1838, 1841, 1842, 1843], "psi3": [1694, 1707, 1714, 1731, 1732, 1737, 1781, 1808, 1842], "psi4": [2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1747, 1750, 1751, 1752, 1753, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1763, 1764, 1766, 1767, 1768, 1769, 1770, 1771, 1774, 1776, 1777, 1778, 1779, 1780, 1781, 1787, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1804, 1805, 1806, 1807, 1808, 1809, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1825, 1826, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1840, 1841, 1842, 1843, 1844], "psi4_descript": 1738, "psi4_email": 1738, "psi4_io": [1738, 1767], "psi4_licens": 1738, "psi4_python": 1806, "psi4_release_firework": 1788, "psi4_skip_enable_fortran": 1738, "psi4_url": 1738, "psi4aiqc": 1738, "psi4conda": [1736, 1738, 1759, 1767, 1774, 1787, 1806, 1807, 1808], "psi4config": 1738, "psi4configvers": 1738, "psi4doc": 1788, "psi4fockci": [1738, 1777, 1780], "psi4manu": [1738, 1764, 1788, 1828], "psi4media": 1738, "psi4meta": [1785, 1788], "psi4numpi": [400, 1734, 1751, 1777, 1797, 1819, 1842], "psi4pastur": [272, 561, 1204, 1704, 1738], "psi4plugincach": 1808, "psi4rc": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "psi_": [1750, 1763, 1771, 1832], "psi_0": [1771, 1838], "psi_1": 1838, "psi_2": 1838, "psi_a_5_1": 1750, "psi_a_6_4": 1750, "psi_a_n": [1112, 1221, 1704, 1750], "psi_a_n_homo": [1112, 1221, 1704, 1750], "psi_a_n_lumo": [1112, 1221, 1704, 1750], "psi_b_n": [1112, 1221, 1704, 1750], "psi_bohr2angstrom": [1833, 1838], "psi_h": 1832, "psi_hartree2kcalmol": [1743, 1832, 1844], "psi_i": [1757, 1771, 1838], "psi_n": 1838, "psi_q": 1750, "psi_scratch": [1738, 1748, 1767], "psiaddit": 1767, "psiapi": [283, 333, 1726, 1736, 1767, 1777, 1778, 1786, 1788, 1790, 1814, 1832, 1844], "psiclean": 87, "psicod": [1717, 1736, 1737, 1738, 1748, 1764, 1781, 1787, 1828], "psidatadir": [194, 245, 1730, 1736, 1743, 1767, 1785, 1786, 1788, 1808, 1834, 1835], "psiexcept": 1827, "psif_3b_sapt_aa_df_int": 1708, "psif_3b_sapt_amp": 1708, "psif_3b_sapt_bb_df_int": 1708, "psif_3b_sapt_cc_df_int": 1708, "psif_3b_sapt_dimer_ab": 1708, "psif_3b_sapt_dimer_ac": 1708, "psif_3b_sapt_dimer_bc": 1708, "psif_3b_sapt_monomer_a": 1708, "psif_3b_sapt_monomer_b": 1708, "psif_3b_sapt_monomer_c": 1708, "psif_3b_sapt_trim": 1708, "psif_3index": 1708, "psif_aa_presort": 1708, "psif_ab_presort": 1708, "psif_ao_dgdbi": 1708, "psif_ao_dgdbx": 1708, "psif_ao_dgdbz": 1708, "psif_ao_opdm": 1708, "psif_ao_tpdm": 1708, "psif_bb_presort": 1708, "psif_cc2_het1": 1708, "psif_cc3_hc1": 1708, "psif_cc3_hc1et1": 1708, "psif_cc3_het1": 1708, "psif_cc3_misc": 1708, "psif_cc_aint": 1708, "psif_cc_aints_new": 1708, "psif_cc_bint": 1708, "psif_cc_bints_new": 1708, "psif_cc_cint": 1708, "psif_cc_cints_new": 1708, "psif_cc_denom": 1708, "psif_cc_diis_amp": 1708, "psif_cc_diis_err": 1708, "psif_cc_dint": 1708, "psif_cc_dints_new": 1708, "psif_cc_eint": 1708, "psif_cc_eints_new": 1708, "psif_cc_fint": 1708, "psif_cc_fints_new": 1708, "psif_cc_gamma": 1708, "psif_cc_gamma_new": 1708, "psif_cc_gl": 1708, "psif_cc_glg": 1708, "psif_cc_gr": 1708, "psif_cc_hbar": 1708, "psif_cc_info": 1708, "psif_cc_lambda": 1708, "psif_cc_lamp": 1708, "psif_cc_lr": 1708, "psif_cc_misc": 1708, "psif_cc_oei": 1708, "psif_cc_oei_new": 1708, "psif_cc_ramp": 1708, "psif_cc_tamp": 1708, "psif_cc_tmp": 1708, "psif_cc_tmp0": 1708, "psif_cc_tmp1": 1708, "psif_cc_tmp10": 1708, "psif_cc_tmp11": 1708, "psif_cc_tmp2": 1708, "psif_cc_tmp3": 1708, "psif_cc_tmp4": 1708, "psif_cc_tmp5": 1708, "psif_cc_tmp6": 1708, "psif_cc_tmp8": 1708, "psif_cc_tmp9": 1708, "psif_ci_c_fil": 1708, "psif_ci_d_fil": 1708, "psif_ci_hd_fil": 1708, "psif_ci_s_fil": 1708, "psif_civect": 1708, "psif_dcc_abcd1": 1708, "psif_dcc_abcd2": 1708, "psif_dcc_abci": 1708, "psif_dcc_abci2": 1708, "psif_dcc_abci3": 1708, "psif_dcc_abci4": 1708, "psif_dcc_abci5": 1708, "psif_dcc_evec": 1708, "psif_dcc_iajb": 1708, "psif_dcc_ijab": 1708, "psif_dcc_ijak": 1708, "psif_dcc_ijak2": 1708, "psif_dcc_ijkl": 1708, "psif_dcc_ovec": 1708, "psif_dcc_qso": 1708, "psif_dcc_r2": 1708, "psif_dcc_sort_start": 1708, "psif_dcc_t2": 1708, "psif_dcc_temp": 1708, "psif_dct_dens": 1708, "psif_dct_dpd": 1708, "psif_derinfo": 1708, "psif_detca": 1708, "psif_dfmp2_aia": 1708, "psif_dfmp2_qia": 1708, "psif_dfocc_ab": 1708, "psif_dfocc_amp": 1708, "psif_dfocc_den": 1708, "psif_dfocc_iabc": 1708, "psif_dfocc_iabc_aaaa": 1708, "psif_dfocc_iabc_abab": 1708, "psif_dfocc_iabc_baba": 1708, "psif_dfocc_iabc_bbbb": 1708, "psif_dfocc_ijab_aaaa": 1708, "psif_dfocc_ijab_abab": 1708, "psif_dfocc_ijab_bbbb": 1708, "psif_dfocc_int": 1708, "psif_dfocc_miabc": 1708, "psif_dfocc_miabc_aaaa": 1708, "psif_dfocc_miabc_aabb": 1708, "psif_dfocc_miabc_bbaa": 1708, "psif_dfocc_miabc_bbbb": 1708, "psif_dfocc_temp": 1708, "psif_dfscf_bj": 1708, "psif_eom_cm": 1708, "psif_eom_cmnef": 1708, "psif_eom_d": 1708, "psif_eom_r": 1708, "psif_eom_sia": 1708, "psif_eom_sijab": 1708, "psif_eom_tmp": 1708, "psif_eom_tmp0": 1708, "psif_eom_tmp1": 1708, "psif_eom_tmp_xi": 1708, "psif_eom_xi": 1708, "psif_grad": 1708, "psif_halft0": 1708, "psif_halft1": 1708, "psif_hess": 1708, "psif_intco": [1708, 1767], "psif_libdii": 1708, "psif_libtrans_a_ht": 1708, "psif_libtrans_b_ht": 1708, "psif_libtrans_dpd": 1708, "psif_mcscf": 1708, "psif_mo_aa_tei": 1708, "psif_mo_aa_tpdm": 1708, "psif_mo_ab_tei": 1708, "psif_mo_ab_tpdm": 1708, "psif_mo_bb_tei": 1708, "psif_mo_bb_tpdm": 1708, "psif_mo_lag": 1708, "psif_mo_opdm": 1708, "psif_mo_r12": 1708, "psif_mo_r12t2": 1708, "psif_mo_tei": 1708, "psif_mo_tpdm": 1708, "psif_occ_dens": 1708, "psif_occ_dpd": 1708, "psif_occ_iabc": 1708, "psif_oei": 1708, "psif_optk": 1708, "psif_psimrcc_integr": 1708, "psif_psimrcc_restart": 1708, "psif_sad": 1708, "psif_sapt_aa_df_int": 1708, "psif_sapt_ab_df_int": 1708, "psif_sapt_amp": 1708, "psif_sapt_bb_df_int": 1708, "psif_sapt_ccd": 1708, "psif_sapt_dim": 1708, "psif_sapt_lrint": 1708, "psif_sapt_monomera": 1708, "psif_sapt_monomerb": 1708, "psif_sapt_temp": 1708, "psif_scf_mo": 1708, "psif_so_erf_tei": 1708, "psif_so_erfc_tei": 1708, "psif_so_pk": 1708, "psif_so_pksuper1": 1708, "psif_so_pksuper2": 1708, "psif_so_presort": 1708, "psif_so_r12": 1708, "psif_so_r12t1": 1708, "psif_so_tei": 1708, "psif_tpdm_halftran": 1708, "psif_tpdm_presort": 1708, "psif_wk_pk": 1708, "psifil": [150, 1764, 1788], "psimrcc": [295, 400, 1704, 1705, 1709, 1714, 1766, 1777, 1790, 1842], "psimrcc_scf": [295, 1766], "psinet": 1788, "psio": [86, 87, 100, 148, 157, 1714, 1842], "psio_entri": [86, 1827], "psio_open_new": 86, "psio_open_old": 86, "psioh": [400, 1767, 1777], "psiomanag": 87, "psipath": [106, 1730, 1743, 1767, 1774, 1782, 1808, 1835], "psipep": 1777, "psireturntyp": [216, 217, 1827], "psithon": [283, 333, 366, 379, 380, 891, 1210, 1704, 1738, 1767, 1768, 1777, 1778, 1781, 1786, 1788, 1790, 1796, 1802, 1814, 1828, 1840, 1843], "psithon1": [1714, 1842], "psithon2": [1714, 1715, 1842], "psivar": [317, 365, 1714, 1799, 1837, 1842, 1843], "psixa": 1738, "psize": 1817, "psutil": 1738, "pt": [1230, 1443, 1704, 1707, 1731, 1798, 1837], "pt2": [1229, 1402, 1704, 1714, 1829, 1842], "pt_energi": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "pte": [1227, 1375, 1704, 1724, 1742, 1749, 1754, 1803], "pthread": 1738, "ptpss": [295, 1695, 1696, 1697, 1698, 1700, 1702, 1758, 1766], "ptype": 1794, "ptype_s": 1794, "pubchem": [1714, 1726, 1734, 1832, 1842], "pubchem1": [1714, 1842], "pubchem2": [1714, 1842], "public": [106, 574, 701, 706, 1206, 1704, 1734, 1737, 1738, 1753, 1770, 1774, 1781, 1788, 1798, 1817, 1836, 1837], "publish": [0, 1787, 1792, 1837], "pulai": [443, 445, 479, 519, 543, 584, 647, 1199, 1200, 1202, 1203, 1206, 1692, 1704, 1734, 1752, 1763, 1789, 1838], "pull": [265, 399, 1737, 1738, 1740, 1768, 1786, 1788, 1794, 1803, 1833], "pull_gha_instal": 1788, "pure": [0, 81, 82, 363, 835, 1157, 1210, 1221, 1704, 1738, 1743, 1757, 1782, 1808, 1810, 1817, 1828, 1831, 1838, 1844], "puream": [0, 1, 2, 8, 691, 1206, 1704, 1707, 1711, 1714, 1722, 1730, 1731, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "purpl": 1750, "purpos": [2, 111, 267, 390, 665, 671, 1096, 1206, 1219, 1704, 1714, 1756, 1757, 1759, 1781, 1801, 1810, 1829, 1834, 1841, 1842], "purvi": [584, 1206, 1704, 1734, 1742, 1771], "purview": 1785, "push": [1737, 1786, 1788, 1823], "push_back": 1817, "push_back_external_potenti": 84, "put": [0, 313, 364, 1755, 1785, 1815, 1821, 1833], "pv": [284, 295, 318, 319, 1694, 1714, 1730, 1732, 1733, 1740, 1741, 1743, 1766, 1768, 1779, 1800, 1832, 1842], "pv1": 346, "pv5z": [284, 1694, 1707, 1731, 1732, 1738, 1740, 1838], "pv6z": [1694, 1707, 1731, 1732], "pv_5pd_z": [1694, 1707, 1731, 1732], "pv_6pd_z": [1694, 1707, 1731, 1732], "pv_dpd_z": [1694, 1707, 1730, 1731, 1732], "pv_qpd_z": [1694, 1707, 1731, 1732], "pv_tpd_z": [1694, 1707, 1731, 1732], "pvdef": 346, "pvdz": [11, 106, 150, 262, 265, 284, 295, 318, 319, 1694, 1707, 1710, 1711, 1714, 1715, 1716, 1720, 1723, 1727, 1729, 1730, 1731, 1732, 1735, 1738, 1740, 1743, 1750, 1753, 1756, 1757, 1759, 1762, 1763, 1766, 1767, 1768, 1770, 1771, 1774, 1792, 1794, 1800, 1802, 1805, 1828, 1832, 1833, 1836, 1837, 1838, 1841, 1842, 1844], "pvdzp": [1707, 1731], "pvp": 103, "pvqz": [284, 1694, 1707, 1710, 1714, 1731, 1732, 1738, 1740, 1741, 1743, 1832, 1842], "pvtz": [2, 284, 318, 319, 376, 397, 1063, 1218, 1694, 1704, 1707, 1711, 1714, 1719, 1727, 1730, 1731, 1732, 1738, 1740, 1743, 1757, 1800, 1829, 1832, 1836, 1837, 1838, 1842], "pvxz": [1733, 1836], "pw6b95": [295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "pw86b95": [295, 318, 319, 1695, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "pw86pbe": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "pw91": [295, 318, 319, 1695, 1697, 1698, 1699, 1703, 1758, 1766, 1800], "pwb6k": [295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "pwcv": [1694, 1732, 1733], "pwcv5z": [1694, 1707, 1731, 1732], "pwcv_5pd_z": [1694, 1707, 1731, 1732], "pwcv_dpd_z": [1694, 1707, 1731, 1732], "pwcv_qpd_z": [1694, 1707, 1731, 1732], "pwcv_tpd_z": [1694, 1707, 1731, 1732], "pwcvdz": [1694, 1707, 1731, 1732], "pwcvqz": [1694, 1707, 1731, 1732], "pwcvtz": [1694, 1707, 1731, 1732], "pwcvxz": [1733, 1836], "pwpb95": [295, 1695, 1696, 1697, 1698, 1700, 1702, 1758, 1766], "px": 1817, "py": [106, 265, 372, 1227, 1377, 1704, 1714, 1718, 1730, 1738, 1740, 1747, 1748, 1750, 1752, 1757, 1764, 1770, 1772, 1774, 1786, 1788, 1794, 1797, 1801, 1808, 1817, 1819, 1822, 1833, 1834, 1835, 1842, 1843], "py2": [1738, 1748], "py3": [1738, 1748, 1786], "py310": 1748, "py35": 1748, "py36_sse41_0": 1748, "py38": 1748, "py39": 1748, "py39_4": 1748, "pybind11": [1738, 1808, 1823, 1833], "pybind11_builtin": 1827, "pybind11_object": [3, 5, 6, 7, 8, 9, 12, 15, 16, 17, 19, 20, 21, 27, 30, 61, 62, 63, 64, 68, 73, 74, 75, 76, 78, 79, 80, 81, 82, 83, 86, 87, 89, 90, 91, 92, 94, 95, 97, 98, 99, 100, 101, 103, 104, 105, 106, 108, 110, 111, 112, 113, 114, 115, 118, 120, 122, 123, 124, 125, 126, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 143, 147, 149, 150, 183, 184, 233, 1827], "pyc": 1738, "pydant": [265, 1738, 1740, 1768, 1772, 1794, 1827], "pyddx": 1754, "pylibefp": 1738, "pymod_install_libdir": [2, 1738], "pymod_lib_dir": 1786, "pymodul": 1808, "pymol": 1790, "pypi": [1, 1754, 1764], "pypy_s2": [1692, 1752], "pypy_t3": [1692, 1752], "pyridin": [1692, 1752], "pyrrol": [1714, 1842], "pytest": [1738, 1748, 1767, 1772, 1777, 1788, 1814, 1843], "pytest_collection_modifyitem": 1788, "pytest_output": 1788, "pytestmark": 2, "python": [0, 1, 2, 64, 73, 106, 111, 235, 236, 247, 249, 267, 300, 301, 302, 318, 319, 363, 380, 400, 1070, 1219, 1231, 1553, 1704, 1711, 1714, 1715, 1716, 1736, 1737, 1740, 1743, 1747, 1748, 1750, 1752, 1755, 1757, 1759, 1764, 1767, 1768, 1771, 1772, 1774, 1777, 1778, 1779, 1781, 1782, 1785, 1786, 1788, 1795, 1796, 1799, 1800, 1801, 1802, 1804, 1805, 1808, 1818, 1819, 1824, 1831, 1834, 1835, 1838, 1840, 1842, 1844], "python3": 1738, "python_execut": 1738, "python_include_dir": 1738, "python_librari": 1738, "pythond": [1088, 1219, 1704, 1771], "pythonhom": 1808, "pythonpath": [2, 1738, 1752, 1759, 1767, 1786, 1806, 1807, 1808], "pythonx": 1738, "pywrap": [1711, 1714, 1740, 1743, 1779, 1833, 1842], "pz": 1817, "q": [3, 13, 103, 143, 144, 275, 284, 295, 386, 389, 810, 1210, 1683, 1694, 1704, 1707, 1722, 1723, 1731, 1732, 1733, 1734, 1740, 1753, 1756, 1766, 1772, 1775, 1776, 1781, 1792, 1793, 1798, 1838], "q00": 1776, "q10": 1776, "q11": 1776, "q11c": 1776, "q20": 1776, "q21": 1776, "q21c": 1776, "q22": 1776, "q22c": 1776, "q5": [284, 1733, 1740], "q56": [1733, 1740], "qam": 1817, "qc": [150, 266, 268, 270, 276, 726, 745, 746, 1208, 1704, 1714, 1740, 1743, 1748, 1753, 1767, 1768, 1772, 1783, 1794, 1842], "qc2p": 1711, "qc_coupl": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "qc_modul": [0, 1, 2, 268, 295, 1704, 1730, 1733, 1735, 1740, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1793, 1794, 1795, 1797, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "qc_molecul": 1735, "qc_type": [0, 1, 2, 745, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "qcarchiv": 1794, "qcdb": [2, 106, 150, 383, 384, 385, 386, 387, 388, 389, 390, 399, 1714, 1726, 1730, 1759, 1764, 1768, 1774, 1831, 1842, 1843], "qcelement": [2, 106, 265, 1738, 1740, 1754, 1772, 1794, 1827, 1833], "qcengin": [2, 106, 265, 267, 1738, 1740, 1759, 1767, 1770, 1774, 1794], "qcfractal": 1794, "qchem": [1226, 1324, 1704, 1714, 1722, 1802, 1842], "qchf": [0, 1, 2, 295, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "qci": 1771, "qcisd": [190, 284, 295, 665, 1083, 1084, 1085, 1087, 1206, 1219, 1680, 1704, 1714, 1739, 1740, 1766, 1776, 1777, 1781, 1790, 1842], "qcportal": [265, 1740, 1772, 1794], "qcschema": [265, 367, 372, 378, 1721, 1740, 1767, 1772, 1794], "qcvar": 367, "qcvariabl": [150, 151, 152, 171, 174, 175, 176, 207, 211, 212, 230, 238, 239, 244, 254, 255, 262, 263, 267, 346, 367, 1740, 1770, 1772, 1776, 1777, 1794, 1809], "qlm": 1776, "qm": [106, 1019, 1020, 1022, 1216, 1228, 1378, 1382, 1704, 1714, 1722, 1749, 1776, 1781, 1782, 1790, 1842], "qmc": [297, 347], "qmefp": [0, 1, 2, 1704, 1722, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "qmefp_elst": [1019, 1216, 1704], "qmefp_pol": [1020, 1216, 1704], "qmmm": [1827, 1838], "qmmmbohr": [274, 1827, 1838], "qmo": 30, "qnr": [944, 1213, 1704, 1798], "qoo": 30, "qov": 30, "qp": 1798, "qpq": 27, "qr": 1838, "qrhf": [658, 670, 671, 672, 1206, 1704], "qrhf_orbit": [671, 1206, 1704], "qshell": 1817, "qsize": 1817, "qso": 30, "qt": 1810, "qtp0": [386, 1772], "qua": 1734, "quad": 1730, "quadrat": [295, 746, 1208, 1229, 1403, 1704, 1753, 1756, 1763, 1766, 1776, 1781, 1790, 1838], "quadratur": [147, 637, 1206, 1231, 1535, 1704, 1757, 1767, 1776, 1799, 1838], "quadrature_valu": 147, "quadrupl": [284, 295, 1714, 1740, 1741, 1742, 1743, 1756, 1763, 1766, 1771, 1776, 1792, 1793, 1842], "quadrupli": [697, 1206, 1704], "quadrupol": [89, 103, 111, 127, 142, 317, 365, 381, 382, 669, 1206, 1669, 1673, 1685, 1704, 1706, 1714, 1776, 1799, 1817, 1826, 1842], "quadrupoleint": [1817, 1827], "qualit": [1757, 1770], "qualiti": [2, 1692, 1742, 1752, 1753, 1755, 1757, 1770, 1781], "quan": 1734, "quantifi": [1754, 1828, 1844], "quantit": [1230, 1689], "quantiti": [138, 329, 377, 433, 466, 507, 514, 641, 728, 1199, 1200, 1201, 1202, 1206, 1208, 1225, 1230, 1242, 1463, 1704, 1708, 1714, 1742, 1750, 1754, 1767, 1776, 1785, 1794, 1799, 1802, 1810, 1817, 1823, 1824, 1832, 1833, 1834, 1837, 1842], "quantum": [1, 2, 265, 574, 608, 692, 884, 1206, 1210, 1232, 1666, 1704, 1706, 1734, 1738, 1740, 1742, 1743, 1746, 1749, 1756, 1757, 1762, 1765, 1771, 1775, 1776, 1781, 1782, 1794, 1797, 1803, 1824, 1827, 1828, 1834, 1838, 1841, 1843], "quantum_of_circul": 1706, "quantum_of_circulation_times_2": 1706, "quantumlib": 1738, "quartet": [92, 1817, 1838], "quartic": [573, 574, 1206, 1704], "quasi": [944, 1213, 1704, 1798], "quasiparticl": [794, 1210, 1704, 1757], "quench": 1838, "queri": [96, 138, 370, 1801, 1817, 1822], "query_libxc": 96, "question": [1743, 1752, 1786, 1804, 1816, 1835], "queu": 1767, "queue": [1736, 1767], "quick": [2, 138, 1714, 1738, 1746, 1749, 1759, 1762, 1764, 1765, 1767, 1770, 1773, 1774, 1775, 1782, 1783, 1784, 1797, 1803, 1806, 1807, 1817, 1839, 1840, 1842], "quickli": [1764, 1770, 1833], "quicktest": [2, 1738], "quiet": [2, 8, 96, 150, 250, 251, 374, 395, 1794], "quintupl": [295, 1766, 1792, 1793], "quit": [388, 1692, 1714, 1738, 1743, 1752, 1756, 1757, 1781, 1785, 1797, 1828, 1833, 1838, 1842, 1844], "quiz": [1736, 1738, 1767], "quot": [1764, 1796, 1828, 1832], "quotient": 1706, "qvv": 30, "qx": 1817, "qy": 1817, "qz": [1733, 1738, 1817], "qz2p": [1707, 1711, 1731, 1743], "qzvp": [1694, 1707, 1731, 1732, 1733], "qzvpd": [1694, 1707, 1731, 1732, 1733], "qzvpp": [1694, 1707, 1731, 1732, 1733], "qzvppd": [1694, 1707, 1731, 1732, 1733], "r": [2, 3, 13, 75, 110, 143, 144, 335, 346, 356, 384, 394, 426, 1198, 1226, 1230, 1337, 1366, 1470, 1679, 1689, 1704, 1706, 1714, 1734, 1738, 1743, 1750, 1753, 1757, 1759, 1763, 1764, 1776, 1777, 1780, 1781, 1786, 1788, 1792, 1798, 1799, 1806, 1817, 1828, 1832, 1833, 1836, 1837, 1838, 1841, 1842, 1844], "r0": 1761, "r1": [1100, 1220, 1704, 1775], "r2": [1100, 1220, 1704, 1775], "r2scan": [295, 318, 319, 1695, 1698, 1702, 1703, 1716, 1718, 1758, 1766, 1774, 1781, 1800], "r2scan0": [295, 318, 319, 1695, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "r2scan3c": [295, 1718, 1766, 1774], "r2scan50": [295, 318, 319, 1695, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "r2scanh": [295, 318, 319, 1695, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "r3": [1100, 1220, 1704, 1775], "r4": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "r_": [1692, 1752, 1757, 1759, 1763, 1837, 1838], "r_0": 1759, "r_1": [1757, 1838], "r_2": [1757, 1838], "r_a": 75, "r_b": 75, "r_converg": [2, 342, 356, 949, 1079, 1704, 1730, 1733, 1735, 1739, 1740, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "r_e": [1714, 1842], "r_k": 329, "r_point": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ra": [782, 785, 786, 789, 790, 792, 794, 795, 796, 797, 798, 837, 859, 860, 875, 877, 878, 879, 882, 890, 1102, 1210, 1221, 1673, 1704, 1714, 1755, 1805, 1810, 1842], "rab": 1802, "radial": [775, 969, 1134, 1139, 1143, 1209, 1214, 1221, 1231, 1493, 1494, 1519, 1533, 1534, 1542, 1597, 1632, 1633, 1704, 1754, 1757, 1776, 1799, 1838], "radial_scal": 323, "radian": [1226, 1340, 1343, 1704], "radianc": 1706, "radiat": [550, 1203, 1704, 1706, 1742], "radic": [1692, 1714, 1752, 1757, 1842], "radii": [106, 323, 771, 772, 773, 1100, 1209, 1220, 1226, 1303, 1341, 1704, 1714, 1715, 1724, 1754, 1757, 1759, 1775, 1802, 1842], "radiiset": 1803, "radiu": [0, 1, 2, 106, 323, 773, 1209, 1226, 1228, 1344, 1345, 1382, 1503, 1504, 1516, 1519, 1704, 1706, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "raghavachari": [1734, 1742, 1771], "rai": [323, 1781], "rais": [2, 84, 150, 255, 262, 279, 297, 318, 319, 347, 374, 395, 1125, 1221, 1225, 1229, 1245, 1246, 1247, 1253, 1254, 1255, 1265, 1272, 1273, 1274, 1275, 1421, 1422, 1704, 1771, 1798, 1800, 1802, 1809, 1837], "ram": [1817, 1832], "raman": [454, 539, 551, 673, 674, 679, 1199, 1203, 1206, 1704, 1742], "ran": 1738, "rand": [100, 148, 331, 1797], "random": [100, 106, 148, 331, 994, 1215, 1231, 1656, 1704, 1746, 1797, 1841], "rang": [0, 1, 92, 106, 138, 295, 318, 319, 400, 761, 774, 1209, 1226, 1231, 1357, 1358, 1359, 1360, 1511, 1529, 1530, 1695, 1698, 1699, 1703, 1704, 1710, 1714, 1730, 1750, 1754, 1757, 1759, 1766, 1767, 1768, 1781, 1794, 1800, 1802, 1817, 1824, 1832, 1833, 1837, 1838, 1842], "ranged_bend": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ranged_coord": 1802, "ranged_dihedr": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ranged_dist": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ranged_oofp": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "rangl": [411, 430, 433, 466, 507, 513, 514, 557, 568, 575, 641, 727, 787, 884, 917, 1198, 1199, 1200, 1201, 1202, 1204, 1206, 1208, 1210, 1213, 1225, 1242, 1704, 1714, 1742, 1755, 1756, 1757, 1763, 1771, 1798, 1829, 1836, 1838, 1841, 1842], "rank": [1810, 1838], "ranlib": 1746, "raphson": [635, 652, 746, 944, 1206, 1208, 1213, 1225, 1226, 1279, 1368, 1704, 1753, 1789, 1798, 1802], "rapid": [1734, 1781, 1819], "rapp": [1734, 1754], "rare": [1692, 1752, 1754, 1757, 1794, 1809, 1810, 1837, 1838], "ras1": [0, 1, 2, 13, 1704, 1714, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "ras2": [0, 1, 2, 13, 1704, 1714, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "ras3": [0, 1, 2, 13, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ras34_max": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ras3_max": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ras4": [0, 1, 2, 13, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ras4_max": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "rasci": [1714, 1755, 1781, 1842], "rasscf": [295, 381, 382, 843, 891, 1210, 1704, 1714, 1734, 1755, 1766, 1781, 1789, 1826, 1842], "rate": [1757, 1759, 1776, 1817, 1824], "rather": [2, 8, 106, 150, 192, 193, 203, 204, 388, 609, 863, 867, 1065, 1087, 1206, 1210, 1219, 1704, 1726, 1737, 1738, 1740, 1742, 1743, 1748, 1755, 1759, 1764, 1767, 1768, 1771, 1774, 1801, 1809, 1817, 1821, 1829, 1838, 1841], "ratio": [352, 1042, 1045, 1218, 1230, 1231, 1470, 1658, 1669, 1685, 1690, 1704, 1706, 1757, 1776, 1798, 1799, 1837, 1841], "ration": [635, 652, 1206, 1226, 1368, 1704, 1759, 1802], "rational": 1834, "ravel": 11, "raw": [268, 370, 380, 1735, 1768, 1799], "raw_compute_properti": 21, "raw_geom": [1692, 1752], "raw_input": [380, 1768], "raw_plot": 76, "rb": [1707, 1731], "rb1": 1783, "rc": [1738, 1748, 1767], "rc04": [295, 318, 319, 1695, 1698, 1700, 1703, 1758, 1766, 1800], "rcc": 1833, "rch1": 1833, "rch2": 1833, "rch3": 1833, "rcond": 335, "rcphf": [719, 1207, 1704], "rdm": [62, 1807], "re": [2, 64, 106, 300, 301, 302, 457, 1199, 1226, 1231, 1327, 1649, 1704, 1707, 1708, 1714, 1730, 1731, 1734, 1737, 1738, 1742, 1748, 1755, 1761, 1764, 1772, 1785, 1786, 1788, 1798, 1801, 1804, 1808, 1809, 1817, 1821, 1828, 1832, 1833, 1835, 1838, 1841, 1842, 1844], "reach": [106, 318, 319, 842, 1210, 1231, 1490, 1554, 1704, 1743, 1755, 1800, 1838, 1841], "reactant": [1835, 1843], "reaction": [1692, 1743, 1752, 1755, 1776, 1781, 1790, 1835, 1843], "reactiv": 1838, "read": [2, 12, 100, 148, 150, 217, 298, 303, 348, 474, 575, 638, 731, 837, 838, 954, 1186, 1200, 1206, 1208, 1210, 1213, 1222, 1225, 1226, 1231, 1268, 1270, 1300, 1563, 1583, 1592, 1704, 1711, 1714, 1738, 1739, 1742, 1743, 1747, 1748, 1749, 1755, 1757, 1764, 1767, 1768, 1769, 1775, 1782, 1785, 1786, 1788, 1802, 1812, 1828, 1832, 1833, 1837, 1838, 1842, 1844], "read1": [1714, 1842], "read2": [1714, 1842], "read3": [1714, 1842], "read_glob": [114, 1801], "read_opt": [326, 1764, 1787, 1801, 1814], "read_scf_3index": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "readabl": [266, 268, 269, 270, 276, 277, 278, 280, 1752, 1809, 1821], "reader": [697, 1206, 1704, 1755, 1837], "readi": [84, 377, 1738, 1748, 1752, 1768, 1782, 1788], "readili": [1782, 1785, 1798], "readm": [1738, 1788, 1839], "readthedoc": 1738, "reagent": [1743, 1752, 1779, 1835], "real": [79, 100, 106, 356, 385, 386, 1714, 1743, 1768, 1772, 1795, 1810, 1828, 1833, 1838, 1841, 1842], "realign": 1746, "realiz": [1757, 1824], "realli": [2, 1737, 1767, 1785], "realloc": [88, 148], "reanalyz": 1770, "reap": [350, 351, 1752, 1779, 1840], "rearrang": [575, 1206, 1704, 1788], "reason": [680, 1206, 1704, 1738, 1742, 1753, 1755, 1757, 1763, 1770, 1781, 1786, 1801, 1802, 1817, 1824, 1833, 1837, 1838], "reassign": 1770, "rebas": [1737, 1786], "rebuild": [106, 359, 1231, 1568, 1704, 1736, 1737, 1746, 1749, 1762, 1765, 1767, 1773, 1775, 1782, 1783, 1784, 1788, 1803, 1839], "recal": [1730, 1782], "recalc": [300, 301, 302, 1772], "recc": [2, 383], "recent": [434, 1199, 1704, 1738, 1742, 1757, 1759, 1776, 1781, 1802, 1817, 1823, 1833, 1837, 1838], "recip": [1785, 1788, 1837], "reciproc": 1838, "recogn": [195, 197, 200, 318, 319, 1738, 1742, 1743, 1755, 1757, 1768, 1781, 1800, 1832], "recomennd": 1832, "recommend": [430, 568, 570, 577, 584, 586, 664, 666, 685, 726, 727, 764, 1044, 1199, 1206, 1208, 1209, 1218, 1230, 1231, 1441, 1454, 1459, 1460, 1461, 1463, 1498, 1532, 1704, 1730, 1738, 1742, 1747, 1748, 1754, 1770, 1776, 1790, 1798, 1805, 1810, 1817, 1824, 1836, 1837, 1841], "recompil": [1730, 1738, 1751, 1808, 1824, 1834, 1835], "recomput": [147, 1226, 1231, 1323, 1558, 1704, 1802, 1837], "reconcil": [1743, 1788], "reconfigur": 1738, "recontract": 1836, "record": [87, 370, 580, 620, 1206, 1704, 1767, 1786, 1788, 1804], "recov": [1763, 1837], "recoveri": 1810, "rectif": [669, 1206, 1704], "recurs": [2, 1738, 1817], "red": [1738, 1748, 1750], "redefin": [315, 316, 1828], "redhat": 1738, "redirect": [153, 1767, 1788], "redist": [1228, 1384, 1704, 1749], "redistribut": [1228, 1231, 1379, 1380, 1381, 1382, 1384, 1655, 1704, 1749, 1835, 1841], "reduc": [0, 20, 386, 389, 568, 572, 575, 641, 681, 727, 875, 1009, 1206, 1208, 1210, 1215, 1226, 1231, 1306, 1491, 1704, 1730, 1740, 1746, 1753, 1755, 1756, 1757, 1771, 1772, 1776, 1798, 1802, 1817, 1821, 1833, 1838], "reduct": [0, 1231, 1232, 1634, 1666, 1704, 1756, 1833, 1838, 1843], "redund": [884, 1106, 1107, 1146, 1147, 1210, 1221, 1226, 1313, 1352, 1704, 1738, 1759, 1776, 1798, 1802, 1810, 1817, 1838], "reev": [1225, 1284, 1704], "reevalu": 106, "ref": [106, 265, 1226, 1336, 1704, 1714, 1724, 1740, 1743, 1752, 1764, 1772, 1776, 1787, 1794, 1801, 1802, 1809, 1814, 1842], "ref_dft_2": [1714, 1842], "ref_gradi": [300, 301, 302, 1772], "ref_mol": 106, "ref_wfn": [160, 161, 162, 163, 164, 165, 166, 167, 173, 177, 178, 179, 181, 185, 186, 190, 218, 241, 242, 295, 394, 1766, 1809], "refactor": 2, "refenc": 1755, "refenergi": 2, "refer": [2, 11, 61, 68, 150, 267, 268, 284, 285, 286, 287, 295, 327, 329, 336, 337, 338, 352, 356, 377, 381, 382, 383, 394, 448, 453, 475, 494, 508, 570, 586, 597, 616, 658, 660, 662, 672, 676, 835, 851, 861, 881, 1150, 1201, 1206, 1211, 1212, 1214, 1221, 1224, 1226, 1229, 1235, 1238, 1314, 1335, 1339, 1401, 1404, 1411, 1434, 1615, 1629, 1658, 1670, 1673, 1674, 1675, 1676, 1682, 1684, 1692, 1704, 1711, 1714, 1715, 1725, 1726, 1727, 1730, 1733, 1734, 1735, 1736, 1739, 1740, 1741, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1756, 1757, 1759, 1760, 1761, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1828, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "referenc": [1764, 1775, 1776, 1833], "reference_sym": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "reference_wavefunct": 150, "refin": 1759, "refit": 1837, "reflect": [106, 139, 235, 236, 1736, 1737, 1738, 1748, 1801], "refmat": 2, "reform": 1834, "reformul": 1838, "refract": [368, 369], "refresh": 9, "reg_param": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "regain": 1784, "regard": [96, 265, 1740, 1794, 1837], "regardless": [1743, 1781, 1803, 1829], "regex": [1738, 1743, 1764], "region": [635, 652, 1206, 1228, 1231, 1379, 1532, 1704, 1749, 1757, 1763, 1838], "regist": [2, 283, 333, 1740, 1808], "register_composite_funct": 1740, "register_xtpl_funct": 1740, "registerpython": 1748, "registr": 2, "regress": [2, 1760], "reguess": 1768, "regul": [1743, 1837], "regula": 1757, "regular": [0, 1, 2, 87, 153, 295, 380, 761, 955, 1209, 1229, 1231, 1426, 1428, 1522, 1523, 1524, 1525, 1526, 1704, 1714, 1730, 1733, 1735, 1738, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "regularli": [1754, 1785], "rehash": 86, "rehn": [1734, 1781], "reiher": [1777, 1780, 1836], "reiniti": [170, 1832], "reinterpret": 106, "reinterpret_coordentri": 106, "reinvok": 1738, "reissu": 1738, "reiter": 1837, "reject": [1226, 1335, 1704], "rel": [2, 603, 608, 1054, 1206, 1218, 1704, 1714, 1738, 1747, 1753, 1757, 1763, 1767, 1802, 1808, 1817, 1824, 1838, 1842, 1843], "relat": [0, 322, 669, 833, 865, 1206, 1210, 1704, 1708, 1740, 1757, 1763, 1771, 1776, 1802, 1817, 1838], "relationship": [1706, 1817, 1828], "relative_geom": 2, "relativisitc": 1836, "relativist": [0, 1, 2, 284, 677, 1206, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1779, 1780, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1790, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "relax": [0, 1, 2, 76, 417, 418, 600, 608, 665, 674, 675, 678, 743, 749, 910, 1198, 1206, 1208, 1212, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "relax_guess_orbit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "releas": [279, 467, 574, 669, 1200, 1206, 1704, 1737, 1738, 1748, 1750, 1755, 1757, 1767, 1777, 1781, 1783, 1786, 1787, 1819, 1828], "relev": [21, 267, 394, 616, 1206, 1704, 1738, 1742, 1743, 1755, 1757, 1759, 1767, 1788, 1829, 1837, 1838], "reli": [0, 106, 1738, 1756, 1757, 1773, 1783, 1784, 1823, 1824, 1837, 1838], "reliabl": [1738, 1742, 1757, 1781, 1833, 1838], "relink": 1738, "reload": 371, "relocat": 1738, "relpotentialint": 1817, "remain": [457, 570, 1199, 1206, 1704, 1714, 1737, 1742, 1781, 1788, 1789, 1804, 1809, 1810, 1817, 1824, 1828, 1833, 1837, 1842, 1844], "remaind": 1835, "remak": [1738, 1786], "remap": 1833, "remark": 1757, "rememb": [786, 1210, 1704, 1737, 1738, 1801, 1817], "remigio": [1734, 1777, 1780, 1781, 1786, 1841], "remind": [1756, 1837], "remot": [1737, 1787, 1788, 1814], "remov": [1, 2, 5, 86, 100, 150, 168, 174, 175, 176, 321, 384, 386, 671, 823, 977, 984, 1206, 1210, 1214, 1225, 1228, 1229, 1231, 1245, 1246, 1247, 1253, 1254, 1255, 1265, 1272, 1273, 1274, 1275, 1380, 1381, 1382, 1384, 1421, 1422, 1535, 1548, 1589, 1602, 1704, 1738, 1743, 1746, 1748, 1749, 1754, 1759, 1762, 1764, 1765, 1767, 1773, 1774, 1775, 1782, 1783, 1784, 1787, 1788, 1794, 1798, 1803, 1806, 1807, 1808, 1810, 1814, 1817, 1832, 1833, 1834, 1837, 1838, 1839], "removal_polici": 321, "remove_symmetri": 100, "remp": [957, 1106, 1213, 1221, 1225, 1289, 1297, 1704, 1714, 1734, 1798, 1842], "remp2": [295, 318, 319, 1675, 1684, 1739, 1766, 1776, 1781, 1798, 1800], "remp_a": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "renam": [2, 295, 1714, 1737, 1766, 1767, 1837, 1842], "rendel": [1225, 1271, 1704, 1734], "render": [1750, 1764, 1770, 1771, 1788], "renorm": [295, 1009, 1215, 1231, 1560, 1704, 1766, 1836], "reopen": 234, "reopen_outfil": 153, "reoptim": 1838, "reorder": [106, 166, 1231, 1576, 1704], "reorder_out_of_cor": [1231, 1620, 1704], "reorient": [1782, 1833], "reparameter": 1759, "repeat": [1231, 1565, 1704, 1714, 1753, 1788, 1809, 1837, 1842], "repeatedli": [1800, 1832], "repl_otf": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "replac": [8, 279, 373, 380, 391, 669, 882, 1206, 1210, 1704, 1730, 1733, 1737, 1738, 1743, 1748, 1753, 1763, 1768, 1771, 1788, 1808, 1817, 1828, 1833, 1835, 1836, 1837, 1844], "replic": [284, 351, 1231, 1628, 1704, 1740, 1768], "repo": [1737, 1738, 1748, 1786, 1788], "report": [2, 488, 1200, 1692, 1704, 1734, 1738, 1743, 1750, 1752, 1759, 1774, 1781, 1782, 1792, 1802, 1818, 1828, 1836, 1837, 1838, 1841, 1843, 1844], "repositori": [2, 1736, 1747, 1748, 1757, 1767, 1781, 1785, 1788, 1805, 1806, 1814, 1824, 1834], "repr": [268, 1714, 1842], "repres": [8, 110, 149, 284, 300, 301, 302, 335, 388, 1126, 1221, 1704, 1709, 1730, 1740, 1748, 1757, 1764, 1771, 1772, 1776, 1781, 1790, 1802, 1805, 1810, 1832, 1837], "represent": [0, 15, 91, 106, 120, 139, 150, 268, 318, 319, 363, 386, 402, 422, 495, 531, 539, 569, 593, 609, 616, 660, 679, 697, 704, 1125, 1197, 1198, 1200, 1202, 1203, 1206, 1221, 1231, 1657, 1704, 1742, 1750, 1753, 1754, 1763, 1767, 1768, 1771, 1772, 1781, 1797, 1798, 1800, 1802, 1810, 1817, 1827, 1837, 1838, 1841], "representa": 106, "reproduc": [413, 1198, 1704, 1714, 1738, 1828, 1837, 1842], "repuls": [2, 69, 73, 106, 144, 294, 298, 345, 348, 1016, 1216, 1228, 1392, 1670, 1690, 1704, 1743, 1756, 1770, 1771, 1776, 1828, 1836, 1837, 1838, 1839, 1844], "request": [13, 84, 145, 147, 150, 244, 262, 267, 268, 269, 295, 300, 301, 302, 303, 489, 490, 574, 576, 577, 586, 604, 616, 635, 650, 655, 664, 665, 669, 673, 676, 693, 694, 1125, 1200, 1202, 1206, 1221, 1224, 1230, 1231, 1236, 1241, 1464, 1465, 1466, 1589, 1704, 1730, 1737, 1738, 1739, 1740, 1742, 1743, 1752, 1753, 1755, 1757, 1759, 1766, 1767, 1769, 1771, 1772, 1775, 1776, 1781, 1788, 1794, 1795, 1799, 1803, 1804, 1817, 1828, 1829, 1832, 1833, 1837, 1838, 1841, 1844], "requir": [0, 1, 2, 84, 138, 265, 272, 284, 314, 329, 342, 356, 383, 426, 463, 503, 561, 573, 608, 614, 621, 623, 647, 664, 669, 679, 690, 699, 708, 727, 811, 823, 826, 837, 872, 875, 888, 930, 949, 958, 1095, 1198, 1199, 1200, 1201, 1204, 1206, 1208, 1210, 1213, 1217, 1219, 1223, 1225, 1231, 1266, 1290, 1629, 1634, 1704, 1713, 1730, 1735, 1736, 1740, 1743, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1763, 1764, 1767, 1769, 1770, 1771, 1772, 1773, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1801, 1802, 1803, 1808, 1810, 1817, 1819, 1821, 1823, 1824, 1828, 1829, 1832, 1833, 1836, 1837, 1838, 1839, 1844], "rerend": 1788, "rerun": [640, 1206, 1704], "res_norm": [277, 342, 356], "rescu": 1838, "research": [1750, 1806, 1839], "reserv": 1785, "reset": [2, 73, 84, 169, 370, 374, 395, 1759, 1788, 1801, 1802], "reset_ci_h0block": 13, "reset_occ_": 84, "reset_occup": 84, "reset_point_group": [106, 1838], "reset_so_int": 90, "reshap": [150, 255, 367, 386, 1740, 1772, 1794], "resid": [1740, 1834], "residu": [0, 84, 277, 321, 329, 335, 342, 356, 377, 491, 500, 594, 606, 645, 736, 747, 752, 876, 949, 953, 976, 1005, 1029, 1200, 1206, 1208, 1210, 1213, 1214, 1215, 1218, 1225, 1229, 1230, 1231, 1285, 1287, 1424, 1442, 1654, 1704, 1708, 1746, 1753, 1755, 1757, 1763, 1785, 1798, 1837, 1838, 1841], "resolut": [1756, 1757, 1771, 1785, 1838], "resolv": [267, 1743, 1746, 1759, 1838], "reson": [574, 679, 1206, 1704], "resort": [106, 430, 1199, 1704, 1838], "resourc": [194, 245, 1095, 1219, 1704, 1738, 1764, 1767, 1771, 1785, 1821], "resp": [1029, 1218, 1230, 1442, 1704, 1738, 1748, 1837], "respect": [0, 106, 150, 363, 621, 651, 671, 674, 681, 742, 1206, 1208, 1217, 1704, 1714, 1735, 1738, 1743, 1747, 1752, 1753, 1760, 1771, 1776, 1779, 1785, 1789, 1798, 1799, 1802, 1817, 1828, 1833, 1836, 1838, 1841, 1842, 1844], "respons": [0, 165, 271, 377, 445, 454, 551, 608, 639, 736, 741, 747, 750, 946, 1044, 1119, 1199, 1203, 1206, 1208, 1213, 1218, 1221, 1225, 1230, 1281, 1288, 1478, 1704, 1708, 1714, 1721, 1734, 1737, 1743, 1749, 1753, 1754, 1776, 1790, 1798, 1799, 1803, 1817, 1824, 1835, 1837, 1841, 1842, 1844], "response1": [1714, 1842], "response2": [1714, 1842], "response3": [1714, 1842], "response_algorithm": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "rest": [616, 1206, 1224, 1241, 1704, 1706, 1756, 1764, 1767, 1804, 1817, 1828, 1838, 1844], "restart": [0, 1, 2, 295, 393, 440, 493, 672, 680, 991, 1010, 1200, 1206, 1215, 1224, 1226, 1241, 1353, 1367, 1704, 1730, 1733, 1735, 1739, 1740, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1790, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1839, 1840, 1841, 1843, 1844], "restart_eom_cc3": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "restart_fil": [295, 1766, 1767, 1838], "restor": [326, 327, 328, 357, 1801, 1809], "restrict": [0, 2, 13, 106, 187, 215, 286, 295, 298, 314, 337, 348, 392, 592, 662, 676, 794, 875, 1164, 1165, 1206, 1210, 1221, 1229, 1231, 1429, 1615, 1658, 1673, 1704, 1711, 1713, 1714, 1739, 1742, 1753, 1755, 1756, 1757, 1766, 1771, 1776, 1781, 1785, 1788, 1789, 1791, 1798, 1799, 1802, 1817, 1828, 1838, 1841, 1842, 1844], "restricted_docc": [0, 1, 2, 1704, 1714, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "restricted_uocc": [0, 1, 2, 1704, 1714, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "restructur": 1804, "restructuredtext": [1777, 1808], "result": [0, 2, 76, 100, 150, 222, 265, 295, 300, 301, 302, 318, 319, 329, 350, 370, 377, 384, 388, 389, 470, 539, 568, 584, 601, 623, 671, 729, 835, 1098, 1200, 1203, 1206, 1208, 1210, 1220, 1225, 1229, 1230, 1231, 1283, 1294, 1405, 1463, 1499, 1704, 1714, 1726, 1735, 1738, 1740, 1742, 1743, 1752, 1753, 1755, 1756, 1757, 1759, 1763, 1766, 1767, 1768, 1770, 1771, 1775, 1776, 1777, 1781, 1788, 1790, 1794, 1798, 1800, 1802, 1804, 1810, 1817, 1823, 1824, 1828, 1829, 1833, 1834, 1835, 1836, 1838, 1840, 1841, 1842, 1844], "result_id": [265, 1740, 1794], "results_list": [1740, 1794], "resum": 1822, "ret": [321, 335, 1740, 1772, 1794], "ret_energi": 1794, "ret_gradi": 1794, "ret_hessian": 1794, "ret_ptyp": 1794, "retag": 1788, "retain": [87, 295, 433, 466, 467, 507, 514, 617, 808, 1009, 1065, 1199, 1200, 1201, 1202, 1206, 1210, 1215, 1219, 1225, 1242, 1704, 1736, 1742, 1746, 1757, 1766, 1767, 1771, 1776, 1798, 1843], "retent": [87, 1714, 1842], "retir": 1748, "retriev": [1801, 1817, 1824, 1833], "retrigg": 1788, "return": [0, 2, 3, 5, 8, 9, 11, 12, 13, 14, 15, 16, 17, 18, 20, 21, 64, 75, 76, 81, 84, 86, 87, 88, 89, 91, 92, 94, 95, 100, 101, 102, 103, 105, 106, 110, 115, 118, 120, 126, 128, 130, 132, 138, 139, 140, 145, 147, 148, 149, 150, 151, 152, 176, 182, 183, 184, 191, 194, 195, 196, 197, 198, 199, 200, 202, 205, 208, 209, 210, 212, 221, 222, 225, 226, 231, 238, 239, 255, 259, 262, 263, 265, 267, 282, 284, 290, 291, 292, 294, 295, 296, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 313, 314, 317, 318, 319, 321, 322, 324, 325, 327, 328, 329, 330, 331, 332, 334, 335, 341, 342, 343, 344, 345, 348, 349, 350, 351, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 395, 396, 397, 399, 640, 1206, 1704, 1714, 1737, 1738, 1740, 1743, 1750, 1752, 1755, 1759, 1761, 1766, 1768, 1769, 1772, 1774, 1775, 1776, 1777, 1785, 1786, 1791, 1794, 1797, 1799, 1800, 1801, 1808, 1809, 1810, 1817, 1823, 1826, 1833, 1834, 1838, 1841, 1842, 1843], "return_arrai": 106, "return_atomlist": 8, "return_dict": 106, "return_handl": 2, "return_histori": [318, 319, 1800], "return_messag": 2, "return_molecul": 106, "return_result": [265, 1740, 1794], "return_total_data": 1794, "return_wfn": [11, 150, 291, 295, 296, 297, 300, 301, 302, 303, 306, 307, 314, 317, 318, 319, 341, 347, 365, 1740, 1749, 1750, 1766, 1767, 1769, 1772, 1775, 1791, 1794, 1799, 1800, 1828, 1832, 1837, 1838, 1841, 1844], "reus": [300, 301, 302, 457, 1199, 1704, 1714, 1740, 1742, 1757, 1772, 1828, 1842, 1843], "rev": [1714, 1734, 1781, 1786, 1788, 1842], "revamp": 106, "revb3lyp": [295, 318, 319, 1695, 1698, 1700, 1703, 1758, 1766, 1800], "revers": [350, 833, 1210, 1704], "review": [1749, 1770, 1781, 1787, 1788, 1814, 1828, 1837, 1844], "revis": [295, 318, 319, 1692, 1695, 1697, 1698, 1700, 1702, 1703, 1752, 1758, 1766, 1788, 1800, 1837], "revm06": [295, 318, 319, 1695, 1698, 1702, 1703, 1758, 1766, 1800], "revok": [370, 1757, 1802], "revoke_chang": 1801, "revoke_global_option_chang": [1757, 1801], "revoke_local_option_chang": 1801, "revpb": [295, 318, 319, 1695, 1697, 1698, 1699, 1703, 1758, 1766, 1800], "revpbe0": [295, 318, 319, 1695, 1697, 1698, 1700, 1703, 1758, 1766, 1800], "revscan": [295, 318, 319, 1695, 1698, 1702, 1703, 1758, 1766, 1800], "revscan0": [295, 318, 319, 1695, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "revtpss": [295, 318, 319, 1695, 1697, 1698, 1702, 1703, 1758, 1766, 1800], "revtpssh": [295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "reward": 1837, "reweight": 1776, "rewrit": 1786, "rewritten": [356, 1781, 1838], "rezac": [1692, 1752], "rf": [1738, 1767, 1802], "rfa": [635, 652, 656, 1206, 1704], "rfo": [1226, 1361, 1362, 1363, 1366, 1368, 1704, 1802], "rfo_follow_root": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "rfo_normalization_max": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "rfo_root": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "rgc1": 1752, "rgen": 1743, "rgensen": 1734, "rgi": 1734, "rh": [100, 335, 1707, 1731], "rhf": [0, 1, 11, 297, 300, 301, 302, 347, 381, 382, 409, 421, 448, 453, 456, 475, 492, 494, 508, 553, 560, 565, 597, 640, 664, 676, 681, 748, 851, 880, 1187, 1197, 1198, 1199, 1200, 1201, 1203, 1204, 1205, 1206, 1208, 1210, 1211, 1212, 1214, 1222, 1231, 1599, 1674, 1676, 1682, 1704, 1711, 1714, 1719, 1725, 1739, 1742, 1743, 1746, 1749, 1753, 1754, 1755, 1756, 1757, 1763, 1771, 1772, 1781, 1792, 1798, 1801, 1803, 1809, 1826, 1827, 1828, 1829, 1832, 1833, 1836, 1838, 1841, 1842, 1844], "rhf_energi": 133, "rhf_triplet": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "rho": [110, 323, 1230, 1231, 1478, 1543, 1704, 1750], "rho_": [1750, 1757], "rhs_vec": 335, "ri": [2, 733, 892, 899, 963, 1208, 1211, 1212, 1214, 1230, 1231, 1446, 1506, 1694, 1704, 1707, 1714, 1730, 1731, 1732, 1733, 1756, 1770, 1771, 1785, 1828, 1837, 1838, 1842, 1844], "ri_spac": 115, "ribier": [1225, 1284, 1704], "rich": [1824, 1828, 1844], "richard": [1781, 1786], "rifit": [8, 1837], "right": [100, 284, 296, 323, 356, 411, 430, 466, 513, 514, 557, 1198, 1199, 1200, 1202, 1204, 1669, 1704, 1708, 1714, 1722, 1726, 1739, 1740, 1741, 1742, 1753, 1755, 1756, 1757, 1769, 1771, 1776, 1781, 1785, 1788, 1798, 1801, 1821, 1829, 1837, 1838, 1841, 1842], "rightarrow": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "rigid": [106, 1226, 1317, 1704, 1782], "rigor": [1757, 1837], "ring": 1802, "ripling": 1734, "risc": [575, 1206, 1704], "rise": 1743, "risk": 1738, "rizzo": [377, 1734, 1841], "rizzo2011": [1734, 1841], "rk": [1231, 1599, 1704, 1714, 1739, 1756, 1757, 1781, 1798, 1801, 1842], "rksfunction": 1827, "rl": 1788, "rle": [584, 1206, 1704], "rlxd": [1692, 1752], "rm": [100, 276, 321, 386, 606, 632, 736, 747, 752, 854, 857, 876, 958, 1002, 1206, 1208, 1210, 1213, 1215, 1225, 1226, 1231, 1290, 1364, 1365, 1497, 1549, 1562, 1648, 1704, 1706, 1738, 1742, 1743, 1746, 1752, 1753, 1755, 1767, 1772, 1776, 1789, 1798, 1802, 1828, 1832, 1836, 1837, 1838, 1844], "rmp2": 1756, "rmroutfil": 100, "rms_": [1226, 1324, 1704, 1802], "rms_disp_g_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "rms_force_g_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "rms_mograd_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "rmsd": 106, "rn": [1707, 1731, 1788], "ro": [394, 1734], "roa": [381, 382, 454, 551, 1199, 1203, 1704, 1742, 1826], "roa_tensor": [381, 382, 551, 1203, 1704, 1742, 1826], "rob": [1692, 1752, 1837], "robert": [1750, 1756, 1757, 1770, 1799, 1838], "roberto": [1803, 1841], "robust": [2, 811, 968, 1133, 1142, 1210, 1214, 1221, 1231, 1492, 1532, 1549, 1631, 1704, 1748, 1755, 1756, 1757, 1792, 1802, 1841], "rocket": [1714, 1842], "roh": 1832, "rohf": [11, 84, 295, 381, 382, 456, 461, 475, 492, 497, 562, 566, 586, 640, 658, 662, 664, 672, 676, 748, 861, 880, 1187, 1199, 1200, 1204, 1205, 1206, 1208, 1210, 1212, 1222, 1230, 1231, 1441, 1599, 1674, 1682, 1704, 1710, 1711, 1713, 1714, 1723, 1739, 1742, 1746, 1755, 1756, 1757, 1766, 1771, 1776, 1781, 1792, 1798, 1803, 1809, 1826, 1827, 1828, 1829, 1837, 1838, 1842, 1844], "rohf_ccsdt_q_": 1723, "rok": 1757, "role": [1, 2, 8, 1738, 1743, 1746, 1749, 1754, 1756, 1762, 1765, 1773, 1775, 1782, 1783, 1784, 1785, 1788, 1801, 1803, 1835, 1837, 1839], "roll": [2, 1804], "rollin": [1782, 1802, 1843], "roo": [1707, 1731, 1734, 1755, 1789, 1836], "root": [11, 13, 150, 277, 314, 342, 356, 419, 468, 470, 471, 489, 496, 502, 505, 527, 609, 681, 783, 787, 811, 828, 829, 842, 870, 871, 887, 992, 1004, 1198, 1200, 1202, 1206, 1215, 1224, 1226, 1229, 1231, 1236, 1237, 1238, 1239, 1363, 1412, 1415, 1640, 1641, 1642, 1655, 1668, 1669, 1673, 1690, 1704, 1714, 1738, 1740, 1742, 1746, 1747, 1748, 1752, 1762, 1764, 1765, 1773, 1775, 1776, 1782, 1783, 1784, 1785, 1788, 1790, 1791, 1795, 1802, 1829, 1838, 1839, 1841, 1842], "roots_per_irrep": [0, 2, 407, 1704, 1730, 1733, 1735, 1739, 1740, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "rot": [1713, 1843], "rot_const": 390, "rotat": [97, 100, 106, 139, 381, 382, 384, 386, 390, 399, 454, 539, 551, 574, 617, 640, 681, 695, 701, 704, 845, 852, 855, 1000, 1024, 1183, 1188, 1189, 1190, 1191, 1199, 1203, 1206, 1210, 1215, 1217, 1222, 1225, 1232, 1279, 1666, 1669, 1704, 1713, 1714, 1729, 1742, 1743, 1746, 1750, 1757, 1772, 1776, 1789, 1798, 1802, 1810, 1826, 1828, 1838, 1842, 1843, 1844], "rotate_column": 100, "rotate_mcscf_integr": 13, "rotate_mo_angl": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "rotate_mo_irrep": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "rotate_mo_p": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "rotate_mo_q": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "rotate_n": 139, "rotate_orbit": 84, "rotate_theta": 139, "rotation": [617, 707, 1206, 1704], "rotational_const": 106, "rotational_strength": [381, 382, 1826], "rotational_symmetry_numb": [0, 1, 2, 106, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1844], "rotatori": [377, 1668, 1669, 1690, 1776, 1841], "rotor": [106, 390], "rotor_typ": [106, 390], "rough": [1714, 1757, 1833, 1838, 1842], "roughli": [1, 2, 404, 1197, 1704, 1748, 1756, 1770], "round": [1692, 1743, 1752, 1776, 1821], "roundoff": [1755, 1828, 1844], "roundtrip": [1714, 1842], "rout": [247, 1158, 1221, 1704, 1714, 1730, 1738, 1743, 1753, 1759, 1774, 1792, 1809, 1835, 1842], "routin": [70, 154, 155, 156, 157, 159, 266, 270, 276, 277, 352, 372, 786, 823, 1210, 1704, 1742, 1767, 1775, 1781, 1801, 1812, 1817, 1824, 1828, 1838, 1841, 1844], "row": [2, 100, 183, 184, 292, 343, 389, 629, 630, 631, 1206, 1704, 1733, 1770, 1774, 1775, 1776, 1810, 1817, 1832, 1837, 1838], "rowdim": [100, 148, 183, 184, 331, 1797], "rpa": [1231, 1656, 1704, 1714, 1841, 1842], "rpbe": [295, 318, 319, 1695, 1697, 1698, 1699, 1703, 1758, 1766, 1800], "rqd": 1740, "rs6000": [575, 1206, 1704], "rs_i_rfo": [1226, 1368, 1704, 1802], "rse30": [1692, 1752], "rshell": 1817, "rsize": 1817, "rsp": [811, 1210, 1704, 1755], "rsrfo_alpha_max": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "rst": [1764, 1785, 1786, 1788, 1804, 1808, 1823], "rstr_docc": 1810, "rstr_uocc": 1810, "rt": [1748, 1788, 1806, 1807], "rt_atom": [106, 390], "rt_linear": 390, "rt_symmetric_top": 106, "rtd": 1794, "rtol": 2, "rtype": [351, 375, 396, 1740], "ru": [388, 1707, 1731], "rudimentari": 1838, "ruhe": 1841, "rule": [346, 1743, 1755, 1757, 1788, 1835, 1838], "run": [106, 150, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 173, 177, 178, 179, 180, 181, 185, 186, 190, 215, 218, 232, 237, 241, 242, 265, 277, 279, 284, 295, 303, 308, 342, 356, 393, 562, 570, 590, 611, 614, 616, 632, 633, 634, 637, 652, 656, 660, 681, 698, 700, 715, 844, 849, 964, 1204, 1206, 1207, 1210, 1214, 1231, 1490, 1500, 1585, 1649, 1656, 1704, 1714, 1730, 1737, 1740, 1748, 1752, 1754, 1755, 1763, 1766, 1767, 1768, 1770, 1772, 1775, 1777, 1778, 1780, 1785, 1787, 1790, 1794, 1795, 1799, 1801, 1805, 1806, 1808, 1809, 1813, 1814, 1823, 1829, 1831, 1832, 1833, 1834, 1835, 1837, 1838, 1839, 1840, 1841, 1842], "run_": 393, "run_ccsd": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "run_cctransort": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "run_cepa": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "run_cfour": 1743, "run_dct": 1809, "run_detci": 1809, "run_dfocc": 1809, "run_dftd3": [106, 1759], "run_dftd4": [106, 1759], "run_fnocc": 1809, "run_gcp": [106, 1774], "run_methodnam": 1809, "run_methodname_gradi": 1809, "run_mirror": 106, "run_mp2": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "run_mp2_5": 1834, "run_mp3": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "run_mp4": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "run_myplugin": 1808, "run_occ": 1809, "run_psi4": 1738, "run_resort": 106, "run_scf": 1809, "run_to_complet": 106, "runabl": 2, "rung": [138, 267, 1759], "runner": [2, 323, 1828], "runtest": 1788, "runtim": [1735, 1748, 1763, 1764, 1777, 1785, 1838], "russ": 1781, "ruud": [377, 1734], "rval": [1743, 1761, 1828, 1832, 1844], "rw": 2, "rx": [1750, 1817], "rxn": 1776, "rxnm": 1835, "ry": [1750, 1817], "rydberg": 1706, "rydberg_const": 1706, "rydberg_constant_times_c_in_hz": 1706, "rydberg_constant_times_hc_in_ev": 1706, "rydberg_constant_times_hc_in_j": 1706, "ryno": [1734, 1781], "rz": [1750, 1817], "s0009": 1740, "s00214": [295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1740, 1758, 1766, 1781, 1800], "s0065": 1781, "s1": [90, 1817], "s11": [1692, 1752], "s2": [90, 1817], "s22": [1714, 1715, 1718, 1757, 1828, 1832, 1842, 1844], "s220": [1692, 1752], "s22_dd": [1692, 1752], "s22_hb": [1692, 1752], "s22_mx": [1692, 1752], "s22a": [1692, 1752], "s22b": [1692, 1752, 1832], "s22by5": 1832, "s3": [90, 1735], "s4": 90, "s6": [68, 1759], "s66": 1832, "s66by8": 1832, "s66x10": [1714, 1842], "s8": [68, 106, 1759], "s_": [1759, 1763, 1838], "s_6": 1759, "s_8": 1759, "s_9": 1759, "s_cholesky_toler": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "s_cut": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "s_n": 1759, "s_orthogon": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "s_toler": [0, 1, 2, 1506, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "s_vib": 1843, "sa": [783, 1210, 1704, 1714, 1842], "sackur": 1706, "sackur_tetrode_constant_1_k_100_kpa": 1706, "sackur_tetrode_constant_1_k_101325_kpa": 1706, "sacrif": [2, 1838], "sad": [8, 1501, 1563, 1603, 1604, 1605, 1607, 1608, 1609, 1610, 1704, 1707, 1708, 1714, 1731, 1757, 1770, 1781, 1837, 1838, 1842], "sad1": [1714, 1842], "sad_": 84, "sad_chol_toler": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "sad_d_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "sad_e_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "sad_frac_occ": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "sad_maxit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "sad_print": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "sad_scf_typ": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "sad_spin_averag": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "saddl": 1838, "sadguess": 1827, "sadlej": [1694, 1707, 1731, 1732, 1733], "sadno": [1231, 1563, 1704, 1838], "saeb": 1734, "safe": [329, 586, 1206, 1704, 1738, 1743, 1757, 1767], "safer": 1785, "safeti": [714, 1051, 1207, 1218, 1230, 1231, 1482, 1618, 1704, 1821, 1837], "sai": [609, 1206, 1704, 1748, 1767, 1786, 1809], "said": 0, "saika": [1817, 1839], "saitow": [1781, 1786], "salc": [15, 16, 134, 386], "salc_nam": 16, "salccompon": 1827, "salvag": 1770, "sam": 1817, "same": [2, 13, 100, 106, 115, 148, 150, 259, 267, 284, 329, 331, 352, 370, 437, 446, 450, 457, 471, 484, 523, 547, 616, 629, 630, 631, 736, 764, 887, 939, 993, 1068, 1082, 1097, 1158, 1199, 1200, 1202, 1203, 1206, 1208, 1209, 1210, 1213, 1215, 1219, 1220, 1221, 1224, 1225, 1231, 1241, 1294, 1555, 1669, 1670, 1674, 1675, 1676, 1680, 1684, 1689, 1692, 1704, 1711, 1714, 1730, 1735, 1738, 1740, 1742, 1743, 1746, 1748, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1764, 1767, 1770, 1771, 1774, 1775, 1776, 1779, 1781, 1785, 1794, 1797, 1799, 1801, 1802, 1810, 1817, 1821, 1828, 1832, 1833, 1837, 1838, 1840, 1842, 1843, 1844], "same_a_b_den": 150, "same_a_b_orb": 150, "samp": 1776, "sampl": [0, 2, 295, 318, 319, 400, 1714, 1716, 1718, 1730, 1735, 1738, 1742, 1743, 1746, 1748, 1755, 1759, 1762, 1764, 1766, 1767, 1774, 1777, 1778, 1779, 1780, 1781, 1787, 1792, 1800, 1803, 1808, 1828, 1832, 1833], "sample_hf_and_dft": 1735, "san": 1738, "sandbox": [1748, 1785], "sandwich": [611, 632, 633, 634, 652, 656, 1206, 1692, 1704, 1743, 1752], "sanit": [359, 392], "saniti": [84, 1832], "sao0": [1047, 1218, 1704, 1770], "sao1": [1047, 1218, 1704, 1770], "sao2": [1047, 1218, 1704, 1770], "saox": [1048, 1218, 1704, 1770], "sap": [1231, 1563, 1704, 1781, 1838], "sap_grasp_larg": [1707, 1731], "sap_grasp_smal": [1707, 1731], "sap_helfem_larg": [1231, 1611, 1704, 1707, 1731, 1838], "sap_helfem_smal": [1707, 1731], "sapfit": 1838, "sapgau": [1231, 1563, 1611, 1704, 1838], "sapgau_basi": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "sapt": [0, 1, 2, 76, 295, 346, 393, 400, 1029, 1038, 1039, 1042, 1043, 1044, 1045, 1046, 1064, 1218, 1442, 1445, 1446, 1448, 1450, 1453, 1454, 1455, 1459, 1460, 1461, 1463, 1470, 1471, 1475, 1479, 1679, 1704, 1705, 1708, 1709, 1711, 1714, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1779, 1780, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1790, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1828, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "sapt0": [76, 295, 346, 1230, 1448, 1450, 1464, 1465, 1466, 1479, 1679, 1689, 1704, 1708, 1711, 1714, 1752, 1766, 1770, 1776, 1781, 1790, 1828, 1833, 1842, 1844], "sapt0_e10": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "sapt0_e20disp": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "sapt0_e20ind": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "sapt1": [1714, 1748, 1842], "sapt10": [1714, 1842], "sapt11": [1714, 1842], "sapt2": [295, 1230, 1447, 1449, 1451, 1479, 1480, 1689, 1704, 1708, 1714, 1766, 1776, 1781, 1837, 1842], "sapt3": [1714, 1842], "sapt4": [1714, 1842], "sapt5": [1714, 1842], "sapt6": [1714, 1842], "sapt7": [1714, 1842], "sapt8": [1714, 1842], "sapt9": [1714, 1842], "sapt_basi": 1837, "sapt_dft_do_dhf": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "sapt_dft_do_hybrid": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "sapt_dft_exch_disp_fixed_scal": [0, 1, 2, 1470, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "sapt_dft_exch_disp_scale_schem": [0, 1, 2, 1469, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "sapt_dft_funct": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "sapt_dft_grac_determin": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "sapt_dft_grac_shift_a": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "sapt_dft_grac_shift_b": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "sapt_dft_mp2_disp_alg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "sapt_fdds_disp_leg_lambda": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "sapt_fdds_disp_num_point": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "sapt_fdds_v2_rho_cutoff": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "sapt_level": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "sapt_mem_check": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "sapt_mem_factor": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "sapt_mem_safeti": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "sapt_os_scal": 1785, "sapt_quiet": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "satisfi": [284, 372, 658, 755, 1079, 1086, 1206, 1208, 1219, 1704, 1736, 1740, 1753, 1755, 1767, 1771, 1804], "saue": 1734, "save": [100, 106, 111, 135, 148, 295, 297, 326, 327, 329, 347, 370, 575, 682, 842, 862, 882, 900, 1206, 1210, 1212, 1226, 1231, 1367, 1507, 1614, 1704, 1708, 1721, 1736, 1747, 1753, 1755, 1761, 1766, 1772, 1777, 1785, 1788, 1790, 1792, 1801, 1817, 1837, 1838], "save_dens": 323, "save_density_and_energi": 84, "save_fock": [14, 128, 130, 145], "save_info": 1801, "save_jk": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "save_molecul": 323, "save_optim": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "save_pairwise_disp": [267, 1759], "save_string_xyz": 106, "save_string_xyz_fil": 106, "save_uhf_no": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "save_xyz_fil": 106, "savelowertriangl": 100, "savesubblock": 100, "savetyp": [100, 1827], "savez": [100, 148], "saw": [1828, 1844], "sb": [1707, 1731], "sb98": [295, 318, 319, 1695, 1698, 1700, 1703, 1758, 1766, 1800], "sbeck": [1231, 1528, 1704, 1757], "sc": [138, 148, 295, 400, 459, 460, 921, 923, 959, 1067, 1068, 1081, 1082, 1092, 1093, 1094, 1199, 1213, 1219, 1225, 1254, 1255, 1283, 1291, 1293, 1294, 1669, 1674, 1675, 1676, 1684, 1695, 1696, 1697, 1698, 1700, 1702, 1704, 1707, 1711, 1714, 1731, 1756, 1757, 1766, 1771, 1776, 1785, 1798, 1832, 1837, 1842], "sca": [314, 1791], "scalabl": [1810, 1837], "scalar": [2, 76, 110, 150, 176, 212, 255, 262, 263, 367, 677, 1040, 1052, 1206, 1218, 1704, 1740, 1743, 1750, 1762, 1777, 1790, 1839], "scalar_vari": 150, "scale": [0, 12, 100, 106, 148, 295, 329, 436, 437, 449, 450, 458, 459, 568, 683, 694, 703, 772, 852, 907, 908, 921, 922, 923, 936, 937, 938, 939, 943, 1042, 1045, 1046, 1064, 1067, 1068, 1081, 1082, 1093, 1196, 1199, 1206, 1209, 1210, 1212, 1213, 1218, 1219, 1223, 1225, 1230, 1231, 1256, 1283, 1293, 1294, 1453, 1469, 1470, 1556, 1704, 1734, 1738, 1739, 1742, 1750, 1754, 1756, 1757, 1759, 1763, 1766, 1770, 1771, 1776, 1777, 1780, 1781, 1785, 1789, 1790, 1802, 1803, 1832, 1833, 1838], "scale_column": 100, "scale_row": 100, "scalmani": 1734, "scan": [295, 318, 319, 1695, 1697, 1698, 1702, 1703, 1711, 1714, 1726, 1738, 1758, 1766, 1768, 1778, 1800, 1802, 1808, 1832, 1842], "scan0": [295, 318, 319, 1695, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "scarc": 1738, "scenario": 1738, "scene": [1743, 1770, 1772, 1800, 1832], "scf": [2, 8, 18, 74, 76, 84, 150, 226, 241, 242, 266, 267, 276, 284, 286, 291, 294, 295, 296, 297, 300, 301, 302, 312, 314, 317, 318, 319, 326, 327, 337, 341, 345, 347, 365, 381, 382, 393, 400, 423, 439, 473, 511, 533, 556, 567, 576, 580, 581, 589, 597, 601, 623, 638, 640, 648, 660, 664, 667, 670, 672, 676, 681, 684, 685, 688, 689, 697, 717, 721, 736, 737, 747, 818, 833, 835, 850, 851, 924, 954, 995, 1000, 1004, 1079, 1166, 1169, 1175, 1179, 1181, 1194, 1198, 1199, 1200, 1201, 1202, 1203, 1205, 1206, 1207, 1208, 1210, 1213, 1215, 1219, 1221, 1222, 1223, 1224, 1225, 1227, 1229, 1233, 1257, 1376, 1410, 1485, 1490, 1497, 1500, 1502, 1510, 1541, 1552, 1555, 1568, 1604, 1605, 1607, 1609, 1615, 1616, 1617, 1619, 1643, 1648, 1664, 1669, 1670, 1671, 1674, 1675, 1676, 1677, 1680, 1682, 1704, 1705, 1708, 1709, 1711, 1712, 1713, 1714, 1724, 1725, 1727, 1730, 1733, 1735, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1749, 1750, 1752, 1753, 1754, 1756, 1759, 1762, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1774, 1776, 1777, 1781, 1782, 1786, 1789, 1791, 1794, 1795, 1798, 1799, 1800, 1801, 1802, 1803, 1808, 1809, 1817, 1824, 1826, 1828, 1832, 1833, 1834, 1837, 1840, 1841, 1842, 1844], "scf1": [1714, 1842], "scf2": [1714, 1842], "scf3": [1714, 1842], "scf4": [1711, 1714, 1743, 1832, 1842], "scf5": [1714, 1727, 1842], "scf6": [1714, 1842], "scf7": [1714, 1838, 1842], "scf__e_converg": 1828, "scf__refer": [376, 397], "scf_alpha": [284, 1740], "scf_basi": [284, 1740, 1741], "scf_conv": 1743, "scf_dtot": 74, "scf_e": [295, 1754, 1766, 1828, 1844], "scf_energi": 1749, "scf_helper": 1809, "scf_initial_acceler": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "scf_initial_finish_diis_transit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "scf_initial_start_diis_transit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "scf_mem_safety_factor": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "scf_method": 312, "scf_properti": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "scf_respons": 1841, "scf_scheme": [284, 1740, 1741], "scf_subtyp": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "scf_type": [0, 1, 2, 84, 92, 327, 1231, 1507, 1510, 1620, 1704, 1714, 1729, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1828, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "scf_wfn": [284, 295, 1740, 1766, 1828, 1838, 1844], "scf_xtpl_helgaker_2": [284, 1740], "scf_xtpl_helgaker_3": [284, 1740], "scf_xtpl_karton_2": [284, 1740], "scf_xtpl_truhlar_2": [284, 1740], "scfconvergenceerror": 1827, "sch": [1229, 1433, 1704, 1734, 1781, 1833], "schaefer": [1714, 1734, 1781, 1786, 1798, 1842], "schaffer": [1734, 1837], "schaftenaar": 1791, "schema": [106, 265, 1721, 1740, 1767, 1768, 1772, 1794], "scheme": [0, 97, 284, 434, 444, 482, 521, 545, 590, 635, 652, 662, 665, 786, 833, 968, 1133, 1142, 1199, 1200, 1202, 1203, 1206, 1210, 1214, 1221, 1226, 1228, 1230, 1231, 1329, 1394, 1469, 1470, 1492, 1518, 1528, 1532, 1534, 1537, 1631, 1633, 1704, 1714, 1741, 1742, 1743, 1750, 1757, 1759, 1767, 1770, 1776, 1782, 1802, 1804, 1817, 1831, 1837, 1838, 1842], "scheme1": [1231, 1629, 1704], "scheurer": [1734, 1777, 1780, 1781], "schieber": [1734, 1781], "schirmer": [0, 1734, 1781], "schlegel": [1226, 1342, 1704, 1734, 1802, 1810], "schmidt": [100, 752, 1208, 1704, 1734], "schmidt_add_residual_toler": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "schoenfli": [106, 120, 1150, 1221, 1704], "schoenflies_symbol": 106, "schriber": [1734, 1781, 1837, 1841], "schwarz": [415, 740, 905, 1053, 1167, 1198, 1208, 1212, 1218, 1221, 1224, 1230, 1231, 1234, 1455, 1569, 1704, 1837, 1838], "schwarz_cutoff": 1785, "sch\u00fc\u00fcrmann": 1734, "sci": [1734, 1781], "scientif": [1748, 1779, 1781], "scientist": 1740, "scipi": [334, 1738], "scipt": 1786, "scope": [195, 197, 208, 209, 235, 236, 248, 249, 326, 1230, 1454, 1704, 1743, 1774, 1801, 1832, 1837], "scrambl": [106, 1795], "scrape": 1764, "scraper": 1764, "scratch": [87, 150, 168, 288, 289, 339, 340, 354, 380, 867, 1210, 1704, 1736, 1743, 1748, 1757, 1764, 1768, 1777, 1781, 1833, 1837], "scratch_dir": 1767, "scratch_messi": 1788, "screen": [0, 1, 2, 92, 143, 295, 300, 301, 302, 415, 740, 905, 967, 982, 1015, 1053, 1131, 1198, 1208, 1212, 1214, 1216, 1218, 1224, 1230, 1231, 1234, 1455, 1487, 1488, 1489, 1569, 1572, 1621, 1622, 1627, 1695, 1697, 1698, 1700, 1701, 1702, 1704, 1714, 1730, 1733, 1735, 1738, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1828, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "screenshot": 1788, "screw": [440, 1199, 1704], "script": [1725, 1738, 1747, 1752, 1759, 1764, 1770, 1786, 1787, 1808, 1828, 1831, 1835, 1844], "scrpot": 1838, "scs_ccsd": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "scs_cepa": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "scs_mp2": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "scs_type": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "scsmi": [959, 1213, 1225, 1291, 1704], "scsmp2": 1711, "scsn": [959, 1213, 1225, 1291, 1293, 1704, 1776], "scsn_mp2": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "scsvdw": [959, 1213, 1225, 1291, 1293, 1704], "scuseria": [356, 444, 482, 1199, 1200, 1231, 1616, 1617, 1704, 1734, 1757], "sd": [0, 690, 1206, 1226, 1368, 1704, 1802], "sdk": 1735, "sdq": [284, 295, 318, 319, 1147, 1221, 1670, 1680, 1689, 1704, 1739, 1740, 1743, 1744, 1745, 1766, 1771, 1776, 1781, 1800, 1837], "sdtq": [1670, 1680, 1776], "se": [1707, 1731], "sear": [885, 1210, 1704], "search": [2, 106, 603, 609, 635, 640, 652, 656, 1206, 1226, 1354, 1704, 1738, 1750, 1767, 1777, 1782, 1786, 1802, 1833], "searchabl": 2, "sebastian": 1746, "sebwout": [993, 1215, 1704, 1746], "sec": [1738, 1764, 1772, 1781, 1796, 1800, 1831, 1832, 1844], "second": [2, 26, 84, 90, 106, 115, 259, 267, 284, 295, 300, 301, 302, 309, 318, 319, 360, 381, 382, 390, 446, 484, 568, 570, 571, 599, 609, 615, 629, 648, 669, 671, 677, 704, 707, 804, 825, 856, 857, 1119, 1125, 1191, 1199, 1200, 1206, 1210, 1221, 1222, 1230, 1231, 1448, 1450, 1459, 1465, 1466, 1538, 1643, 1644, 1645, 1646, 1648, 1692, 1704, 1706, 1713, 1714, 1733, 1734, 1738, 1740, 1750, 1752, 1753, 1755, 1756, 1757, 1761, 1763, 1766, 1767, 1770, 1771, 1772, 1775, 1776, 1781, 1782, 1790, 1794, 1795, 1796, 1798, 1800, 1802, 1817, 1826, 1828, 1832, 1833, 1835, 1837, 1842, 1844], "second_ord": [669, 1206, 1229, 1423, 1704], "second_radiation_const": 1706, "secondari": [1714, 1842], "secondli": [1752, 1797], "section": [0, 1, 381, 382, 622, 626, 637, 661, 1206, 1224, 1240, 1704, 1706, 1711, 1714, 1730, 1735, 1738, 1740, 1742, 1743, 1746, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1762, 1763, 1764, 1765, 1767, 1769, 1770, 1771, 1773, 1774, 1775, 1781, 1782, 1783, 1784, 1788, 1789, 1790, 1791, 1792, 1795, 1796, 1797, 1798, 1799, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1815, 1823, 1824, 1826, 1828, 1829, 1832, 1835, 1836, 1837, 1838, 1839, 1841, 1842, 1843, 1844], "sed": [1788, 1806], "see": [0, 1, 2, 86, 100, 106, 130, 148, 150, 267, 277, 283, 284, 295, 300, 301, 302, 303, 314, 317, 318, 319, 333, 342, 350, 356, 365, 399, 439, 443, 473, 479, 519, 543, 561, 569, 574, 575, 577, 581, 593, 637, 640, 737, 786, 808, 818, 824, 825, 829, 850, 885, 924, 1079, 1106, 1107, 1146, 1147, 1166, 1199, 1200, 1202, 1203, 1204, 1206, 1208, 1210, 1213, 1219, 1220, 1221, 1224, 1225, 1226, 1229, 1230, 1231, 1233, 1236, 1239, 1257, 1324, 1410, 1442, 1445, 1497, 1521, 1552, 1563, 1681, 1704, 1709, 1714, 1730, 1734, 1735, 1736, 1740, 1742, 1743, 1748, 1752, 1753, 1754, 1755, 1757, 1759, 1760, 1761, 1763, 1766, 1767, 1768, 1770, 1771, 1772, 1774, 1775, 1776, 1781, 1783, 1788, 1789, 1791, 1794, 1796, 1798, 1799, 1800, 1801, 1802, 1803, 1806, 1808, 1809, 1810, 1817, 1823, 1824, 1828, 1829, 1832, 1833, 1835, 1836, 1837, 1838, 1839, 1842, 1843, 1844], "seed": [476, 1200, 1704], "seed_atom": [106, 1768], "seek": [86, 355, 1231, 1655, 1658, 1704, 1738, 1755, 1756, 1841], "seem": [697, 786, 1206, 1210, 1704, 1738, 1810, 1837, 1838, 1839], "seen": [1738, 1742, 1756, 1809, 1817, 1828, 1832, 1844], "segment": [590, 1206, 1704], "seidl": 1781, "sekino": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "seldom": 1763, "select": [0, 2, 13, 150, 259, 314, 434, 444, 482, 521, 545, 577, 608, 774, 794, 833, 874, 1199, 1200, 1202, 1203, 1206, 1209, 1210, 1231, 1505, 1507, 1532, 1620, 1704, 1730, 1737, 1738, 1739, 1742, 1748, 1754, 1755, 1756, 1759, 1771, 1774, 1781, 1785, 1788, 1790, 1791, 1798, 1802, 1809, 1828, 1837, 1838], "select_mp3": 1809, "selector": 1809, "self": [1, 3, 5, 6, 7, 8, 9, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 26, 27, 30, 61, 64, 66, 68, 70, 73, 74, 75, 76, 77, 78, 80, 81, 84, 86, 87, 88, 89, 90, 91, 92, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 108, 110, 111, 112, 114, 115, 118, 119, 120, 128, 130, 131, 132, 133, 137, 138, 139, 140, 141, 143, 144, 145, 147, 148, 149, 150, 183, 184, 262, 267, 295, 315, 316, 318, 319, 331, 381, 382, 574, 698, 1206, 1210, 1231, 1673, 1690, 1704, 1740, 1748, 1753, 1755, 1757, 1759, 1760, 1766, 1770, 1772, 1774, 1776, 1777, 1781, 1790, 1794, 1797, 1800, 1810, 1822, 1826, 1829, 1838], "sem": [0, 811, 833, 837, 1210, 1704, 1755], "semi": [1714, 1838, 1842], "semicanon": [0, 1, 2, 664, 1206, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "semicanonic": [84, 1714, 1756, 1842], "semicanonical_orb": 13, "semicolon_separ": 2, "semidefinit": 100, "semiloc": 1759, "seminumer": [1734, 1790], "send": 1767, "sens": [0, 265, 881, 1210, 1704, 1740, 1743, 1770, 1779, 1794, 1801, 1808], "sensibl": [359, 1743, 1757], "sensibli": [106, 1774], "sensit": [778, 1170, 1209, 1221, 1231, 1584, 1704, 1752, 1754, 1772, 1791, 1801, 1832, 1834], "sent": [1708, 1738, 1743, 1767], "separ": [0, 8, 92, 106, 295, 376, 397, 561, 601, 616, 660, 671, 701, 836, 867, 1041, 1104, 1204, 1206, 1210, 1218, 1221, 1227, 1231, 1376, 1511, 1529, 1530, 1704, 1714, 1738, 1743, 1753, 1754, 1757, 1763, 1764, 1766, 1767, 1770, 1779, 1782, 1783, 1785, 1794, 1798, 1799, 1801, 1802, 1803, 1806, 1817, 1828, 1832, 1833, 1837, 1838, 1842, 1843, 1844], "seper": [138, 1714, 1802, 1842], "seperman": 1738, "septemb": [1095, 1219, 1704, 1738, 1771], "seq": 344, "seq1": [299, 309, 349, 360], "seq2": [309, 360], "sequenc": [284, 1714, 1730, 1740, 1748, 1808, 1824, 1842], "sequenti": [284, 570, 703, 1206, 1704, 1740, 1788], "seri": [100, 300, 301, 302, 318, 319, 380, 570, 861, 864, 1206, 1210, 1704, 1752, 1755, 1756, 1757, 1759, 1768, 1771, 1772, 1800, 1828, 1838, 1844], "serial": [2, 64, 100, 106, 148, 150, 295, 367, 1231, 1584, 1704, 1738, 1766, 1771, 1838], "serif": 1738, "serv": [1, 393, 1714, 1764, 1788, 1817, 1832, 1842], "server": 1788, "serverdata": [308, 1768], "servic": 1786, "session": [1714, 1748, 1788, 1832, 1842], "set": [0, 2, 8, 11, 18, 19, 21, 68, 73, 74, 84, 86, 87, 88, 92, 96, 100, 103, 106, 111, 112, 113, 114, 115, 138, 139, 147, 148, 150, 171, 195, 197, 200, 207, 211, 212, 214, 226, 227, 228, 230, 235, 236, 244, 245, 246, 248, 249, 250, 251, 252, 254, 255, 262, 263, 265, 267, 281, 283, 284, 285, 287, 291, 295, 296, 297, 300, 301, 302, 303, 306, 307, 314, 317, 318, 319, 321, 329, 333, 336, 338, 341, 346, 347, 352, 365, 367, 370, 371, 374, 375, 376, 378, 380, 386, 393, 394, 395, 396, 397, 399, 457, 474, 573, 577, 581, 586, 587, 590, 592, 599, 603, 605, 609, 614, 616, 628, 644, 648, 650, 651, 654, 658, 660, 661, 664, 665, 672, 676, 679, 684, 685, 689, 691, 696, 705, 713, 733, 743, 746, 772, 773, 778, 810, 827, 835, 861, 891, 892, 898, 899, 921, 922, 930, 934, 949, 958, 963, 964, 978, 979, 1025, 1026, 1027, 1101, 1103, 1126, 1156, 1157, 1168, 1195, 1199, 1200, 1206, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1217, 1220, 1221, 1223, 1224, 1225, 1226, 1228, 1229, 1230, 1231, 1232, 1235, 1240, 1266, 1290, 1293, 1302, 1304, 1312, 1324, 1335, 1380, 1426, 1437, 1445, 1446, 1453, 1484, 1485, 1500, 1502, 1507, 1578, 1593, 1611, 1666, 1695, 1698, 1699, 1700, 1701, 1703, 1704, 1710, 1711, 1714, 1715, 1726, 1727, 1735, 1736, 1737, 1739, 1742, 1743, 1746, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1779, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1789, 1790, 1791, 1792, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1803, 1805, 1806, 1809, 1810, 1814, 1817, 1818, 1823, 1824, 1828, 1829, 1831, 1833, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "set_aa_int_nam": 90, "set_ab_int_nam": 90, "set_active_frag": 106, "set_alpha": 80, "set_ansatz": 119, "set_ao_cor": 27, "set_arrai": [114, 150], "set_array_vari": [150, 1764], "set_atomic_fit_bas": 131, "set_basi": 265, "set_basis_all_atom": 106, "set_basis_by_label": 106, "set_basis_by_numb": 106, "set_basis_by_symbol": 106, "set_basisset": [103, 150, 1837], "set_bb_int_nam": 90, "set_bibtex": 68, "set_block": [88, 100, 148], "set_bool": 114, "set_bsse_typ": 1794, "set_c_alpha": 138, "set_c_omega": 138, "set_c_os_alpha": 138, "set_c_ss_alpha": 138, "set_camera": 323, "set_charge_field": 1817, "set_ci_guess": 13, "set_cit": [68, 80, 138], "set_color": 323, "set_com": 106, "set_connect": 106, "set_cosx_grid": 18, "set_current_modul": 114, "set_cutoff": 92, "set_d": 147, "set_da_ao": 111, "set_da_mo": 111, "set_da_so": 111, "set_db_ao": 111, "set_db_mo": 111, "set_db_so": 111, "set_debug": [131, 147], "set_default_namespac": [86, 1837], "set_default_path": [87, 1767], "set_defin": 323, "set_delta": 6, "set_density_cutoff": [80, 96], "set_density_toler": 138, "set_deriv": [7, 138], "set_deriv_density_backtransform": 61, "set_descript": [68, 80, 138], "set_do_j": 92, "set_do_k": 92, "set_do_vv10": 138, "set_do_wk": 92, "set_doubl": 114, "set_dpd_id": 90, "set_dpd_int_fil": 90, "set_driv": 1772, "set_embedding_charg": 1794, "set_energi": [84, 150], "set_external_cpscf_perturb": 84, "set_external_potenti": 150, "set_full_geometri": 106, "set_geometri": [106, 1833], "set_gga": 80, "set_ghost_frag": 106, "set_global_opt": [1801, 1809], "set_global_option_python": 1838, "set_grac_alpha": 138, "set_grac_beta": 138, "set_grac_shift": 138, "set_gradi": 150, "set_hessian": 150, "set_ignore_refer": 61, "set_input_units_to_au": 106, "set_int": 114, "set_jk": 84, "set_keep_dpd_so_int": 90, "set_keep_ht_int": 90, "set_keep_iwl_so_int": 90, "set_keyword": 265, "set_lagrangian": 150, "set_local_opt": [1801, 1809], "set_lock": 138, "set_lsda_cutoff": 80, "set_mass": 106, "set_max_nbodi": 1794, "set_max_point": 138, "set_memori": [27, 90, 92, 250, 1828, 1832], "set_memory_byt": 1832, "set_meta": 80, "set_meta_cutoff": 80, "set_method": [27, 265], "set_mo_cor": 27, "set_modul": 150, "set_molecul": [1740, 1772, 1794], "set_molecular_charg": [106, 1838], "set_multipl": [106, 295, 1766, 1838], "set_nam": [68, 80, 106, 111, 138, 150], "set_nfrag": 1794, "set_nthread": 27, "set_nuclear_charg": 106, "set_num_thread": [1767, 1788], "set_nvec": 12, "set_omega": [80, 92, 96], "set_omega_alpha": 92, "set_omega_beta": 92, "set_omp_nthread": 92, "set_opt": [283, 333, 366, 371, 375, 379, 396, 1754, 1828, 1832, 1841], "set_orbit": [13, 90], "set_output_fil": [1738, 1768, 1777, 1788, 1828, 1841], "set_param": 19, "set_paramet": 80, "set_pid": 86, "set_point": 119, "set_point_group": 106, "set_postscf_density_label": 74, "set_potential_vari": 150, "set_print": [90, 92, 103, 131, 147, 150], "set_proven": 106, "set_psio": 90, "set_radiu": 323, "set_read_glob": 114, "set_reference_wavefunct": 150, "set_return_total_data": 1794, "set_sad_basisset": 84, "set_sad_fitting_basisset": 84, "set_scalar_vari": 150, "set_schwarz_cutoff": 27, "set_siz": 323, "set_so_tei_fil": 90, "set_specific_path": [87, 1767], "set_specific_retent": [87, 1767], "set_str": 114, "set_str_i": 114, "set_subalgo": 27, "set_tei_already_presort": 90, "set_tests_properti": 2, "set_titl": 111, "set_tpdm_already_presort": 90, "set_tpdm_presort": 61, "set_tweak": 96, "set_unit": 106, "set_up": 1788, "set_up_overal": 1788, "set_vari": [106, 150, 244, 254, 1764, 1809, 1823, 1834], "set_view": 323, "set_vv10_b": 138, "set_vv10_c": 138, "set_wcombin": 92, "set_write_dpd_so_tpdm": 90, "set_x_alpha": 138, "set_x_beta": 138, "set_x_omega": 138, "set_xclib_descript": 138, "setabl": [1714, 1842], "setenv": [1738, 1767], "setnam": 73, "settl": [1786, 1838], "setup": [1738, 1746, 1754, 1767, 1788], "sever": [0, 2, 106, 284, 327, 944, 1158, 1213, 1221, 1692, 1704, 1714, 1730, 1733, 1735, 1740, 1743, 1748, 1750, 1751, 1752, 1753, 1755, 1756, 1757, 1759, 1767, 1770, 1771, 1774, 1779, 1781, 1786, 1789, 1790, 1794, 1798, 1802, 1809, 1815, 1828, 1835, 1837, 1838, 1842, 1844], "sextupl": [295, 1766, 1792, 1793], "sf": [295, 677, 1206, 1704, 1714, 1766, 1781, 1805, 1836, 1837, 1842], "sf1": [1714, 1842], "sf4": [1714, 1842], "sf_restrict": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "sfree": [677, 1206, 1704], "sfx2c": [1714, 1842], "sg0": [1231, 1527, 1704], "sg1": [1231, 1527, 1704, 1710, 1757], "sgi": [575, 1206, 1704], "sh": [1738, 1748, 1767, 1788], "sha": 1788, "sha256": 1788, "shadow": 323, "shallow_copi": 150, "sham": [84, 150, 314, 1734, 1757, 1791, 1810, 1837, 1838], "shannon": [1805, 1806], "shannonhouck": [1738, 1805], "shape": [100, 110, 148, 331, 367, 1692, 1752, 1797, 1838], "share": [86, 194, 245, 1730, 1733, 1735, 1738, 1743, 1746, 1748, 1749, 1750, 1752, 1759, 1762, 1764, 1767, 1770, 1773, 1775, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1803, 1808, 1809, 1834, 1835, 1839], "shared_object": [86, 87], "shared_ptr": [1810, 1817, 1821], "sharedmatrix": [11, 70, 1817], "shaw": [1734, 1777, 1780, 1781], "shebang": [1738, 1788], "shell": [0, 1, 2, 8, 81, 92, 103, 112, 143, 144, 158, 586, 625, 628, 660, 676, 681, 695, 861, 865, 1125, 1210, 1221, 1224, 1231, 1237, 1238, 1488, 1606, 1622, 1692, 1704, 1714, 1730, 1733, 1734, 1735, 1737, 1738, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1828, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "shell_block_signific": 1817, "shell_ext": 6, "shell_on_cent": 8, "shell_pair": 1817, "shell_signific": [143, 144, 1817], "shell_to_ao_funct": 8, "shell_to_basis_funct": 8, "shell_to_cent": 8, "shellbatch": [1231, 1626, 1704], "shellinfo": [5, 1827], "shellpair": 1817, "shells_iter": 89, "shells_local_to_glob": 9, "sherril": [1230, 1469, 1692, 1704, 1714, 1734, 1740, 1752, 1755, 1781, 1786, 1789, 1791, 1798, 1835, 1837, 1842], "sherrill_gold_standard": 1740, "shg": [669, 1206, 1704], "shield": [669, 1206, 1704, 1706], "shielded_helion_gyromag_ratio": 1706, "shielded_helion_gyromag_ratio_over_2_pi": 1706, "shielded_helion_mag_mom": 1706, "shielded_helion_mag_mom_to_bohr_magneton_ratio": 1706, "shielded_helion_mag_mom_to_nuclear_magneton_ratio": 1706, "shielded_helion_to_proton_mag_mom_ratio": 1706, "shielded_helion_to_shielded_proton_mag_mom_ratio": 1706, "shielded_proton_gyromag_ratio": 1706, "shielded_proton_gyromag_ratio_over_2_pi": 1706, "shielded_proton_mag_mom": 1706, "shielded_proton_mag_mom_to_bohr_magneton_ratio": 1706, "shielded_proton_mag_mom_to_nuclear_magneton_ratio": 1706, "shift": [0, 12, 84, 106, 138, 669, 695, 703, 738, 744, 759, 774, 920, 928, 987, 988, 1184, 1206, 1208, 1209, 1213, 1215, 1222, 1229, 1230, 1231, 1427, 1473, 1474, 1476, 1525, 1570, 1571, 1704, 1714, 1743, 1746, 1754, 1771, 1785, 1788, 1798, 1828, 1837, 1838, 1842], "ship": 1743, "short": [2, 138, 295, 318, 319, 389, 1695, 1698, 1699, 1703, 1738, 1752, 1757, 1758, 1766, 1767, 1785, 1800, 1837], "shortcod": 1788, "shortcut": [1755, 1802], "shorter": [1714, 1842], "shortest": [1714, 1842], "shorthand": [1102, 1221, 1704, 1740], "shortli": 1810, "shortlong": 389, "should": [0, 2, 13, 84, 86, 87, 100, 106, 138, 148, 150, 265, 279, 284, 285, 329, 336, 342, 359, 363, 381, 382, 389, 393, 399, 430, 586, 589, 603, 609, 610, 617, 620, 632, 641, 647, 660, 804, 833, 861, 891, 897, 1097, 1126, 1168, 1199, 1206, 1210, 1211, 1220, 1221, 1225, 1226, 1229, 1231, 1244, 1356, 1655, 1688, 1704, 1714, 1730, 1738, 1740, 1742, 1743, 1748, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1761, 1763, 1764, 1767, 1768, 1769, 1770, 1774, 1775, 1777, 1779, 1781, 1782, 1785, 1786, 1788, 1794, 1797, 1798, 1801, 1802, 1803, 1804, 1806, 1808, 1809, 1810, 1816, 1817, 1818, 1821, 1824, 1826, 1828, 1829, 1832, 1833, 1835, 1836, 1837, 1838, 1841, 1842, 1844], "shouldn": [1785, 1801], "shove": 1809, "show": [2, 106, 265, 1714, 1738, 1740, 1743, 1748, 1750, 1752, 1755, 1757, 1764, 1768, 1770, 1772, 1779, 1788, 1794, 1802, 1817, 1828, 1833, 1837, 1842, 1844], "showcas": [1714, 1842], "shown": [2, 1730, 1743, 1753, 1781, 1782, 1799, 1802, 1805, 1806, 1810, 1817, 1829, 1832, 1833, 1837, 1838, 1841, 1843], "shuffl": 106, "shy": 0, "si": [8, 368, 369, 1098, 1220, 1704, 1738, 1775, 1832], "siao0": [1047, 1218, 1704, 1770], "siao1": [1047, 1218, 1704, 1714, 1770, 1842], "siao2": [1047, 1218, 1704, 1770], "siaox": [1048, 1218, 1704, 1770], "side": [103, 106, 111, 247, 666, 1206, 1704, 1738, 1757, 1764, 1774, 1801, 1804, 1809, 1821, 1831, 1841], "sidebar": 1764, "sidechain": [1692, 1752], "siev": 1838, "sigma": [13, 390, 786, 823, 842, 883, 886, 1047, 1210, 1218, 1704, 1708, 1714, 1757, 1770, 1838, 1842], "sigma_": 1757, "sigma_overlap": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "sigma_xi": 139, "sigma_xz": 139, "sigma_yz": 139, "sign": [1730, 1743, 1752, 1764, 1776, 1810, 1832], "signal": [2, 1821], "signatur": [2, 285, 287, 336, 338, 1821], "signifi": [589, 1206, 1704], "signific": [143, 144, 1753, 1756, 1757, 1810, 1817, 1838], "significantli": [106, 430, 568, 575, 590, 641, 727, 1199, 1206, 1208, 1704, 1730, 1753, 1755, 1759, 1767, 1774, 1798, 1817, 1838], "silent": 2, "silicon": [1706, 1737, 1781], "silver_schem": 1750, "similar": [2, 163, 284, 342, 399, 474, 1200, 1704, 1714, 1738, 1740, 1742, 1748, 1753, 1755, 1760, 1763, 1782, 1785, 1792, 1798, 1802, 1817, 1823, 1832, 1837, 1838, 1842], "similarli": [1748, 1753, 1801, 1828, 1844], "simint": [400, 1129, 1221, 1704, 1738, 1777, 1780, 1785, 1842], "simint_dir": 1839, "simint_vector": 1839, "simintconfig": 1839, "simmonett": [1734, 1753, 1761, 1765, 1768, 1769, 1775, 1781, 1782, 1786, 1792, 1799, 1803, 1829, 1838], "simpl": [2, 8, 267, 279, 284, 1226, 1341, 1342, 1692, 1704, 1725, 1738, 1740, 1743, 1752, 1753, 1755, 1756, 1757, 1759, 1768, 1770, 1771, 1772, 1774, 1777, 1781, 1789, 1790, 1797, 1802, 1804, 1810, 1817, 1824, 1828, 1832, 1833, 1836, 1837, 1838, 1844], "simpler": [1824, 1828, 1832], "simplest": [1743, 1755, 1757, 1775, 1837, 1838], "simpli": [0, 84, 100, 148, 570, 672, 1206, 1704, 1730, 1743, 1755, 1757, 1759, 1769, 1771, 1774, 1775, 1782, 1792, 1797, 1798, 1817, 1824, 1832, 1833, 1835, 1836, 1837, 1838, 1840], "simplif": 1756, "simplifi": [1753, 1771, 1801, 1824, 1833, 1844], "simul": [0, 441, 444, 478, 482, 517, 521, 541, 545, 1199, 1200, 1202, 1203, 1704, 1734], "simultan": [0, 335, 703, 726, 727, 739, 742, 745, 746, 750, 751, 811, 929, 946, 1206, 1208, 1210, 1213, 1225, 1281, 1704, 1714, 1753, 1755, 1767, 1789, 1838, 1842], "sinc": [0, 2, 100, 150, 192, 193, 203, 204, 206, 253, 264, 375, 396, 599, 608, 658, 1147, 1206, 1221, 1704, 1738, 1740, 1743, 1753, 1754, 1757, 1759, 1763, 1767, 1776, 1779, 1782, 1785, 1786, 1788, 1792, 1801, 1808, 1824, 1828, 1833, 1834, 1837, 1838, 1841, 1843, 1844], "sincer": 1757, "sinf_disp": 76, "sing": 1785, "singl": [0, 2, 8, 13, 88, 100, 106, 148, 249, 265, 295, 306, 318, 319, 326, 329, 331, 334, 381, 382, 474, 476, 481, 498, 520, 544, 575, 628, 635, 652, 657, 660, 666, 707, 746, 1099, 1200, 1202, 1203, 1206, 1208, 1220, 1224, 1226, 1229, 1235, 1313, 1419, 1669, 1670, 1674, 1675, 1676, 1680, 1684, 1704, 1708, 1710, 1711, 1714, 1722, 1735, 1740, 1743, 1744, 1745, 1750, 1752, 1753, 1755, 1759, 1762, 1764, 1768, 1774, 1775, 1776, 1777, 1779, 1781, 1782, 1785, 1790, 1794, 1797, 1800, 1802, 1804, 1805, 1809, 1810, 1817, 1822, 1823, 1826, 1828, 1829, 1831, 1832, 1835, 1838, 1842, 1844], "single_point": [635, 652, 1206, 1704], "singlepass": [575, 1206, 1704], "singles_print": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "singlet": [0, 1, 138, 277, 295, 329, 403, 662, 1197, 1206, 1224, 1229, 1231, 1238, 1415, 1658, 1669, 1680, 1704, 1714, 1727, 1743, 1755, 1757, 1766, 1770, 1776, 1785, 1810, 1829, 1833, 1837, 1838, 1841, 1842], "singleton": 213, "singli": [150, 1071, 1168, 1192, 1219, 1221, 1222, 1704, 1742, 1750, 1755, 1771, 1810, 1829, 1833], "singular": [1798, 1810], "sirianni": [1734, 1781, 1828], "site": [103, 1097, 1099, 1220, 1228, 1378, 1379, 1382, 1692, 1704, 1736, 1738, 1749, 1752, 1767, 1775, 1776, 1788, 1817], "sitkoff": 1734, "situat": [1730, 1764, 1770, 1798, 1810, 1817], "siva": 1734, "six": [2, 140, 286, 337, 1692, 1752], "sixth": [677, 1206, 1704, 1771], "size": [76, 100, 105, 284, 532, 540, 555, 755, 832, 833, 834, 933, 1023, 1202, 1203, 1208, 1210, 1213, 1217, 1225, 1226, 1231, 1269, 1306, 1340, 1343, 1348, 1551, 1588, 1595, 1661, 1704, 1714, 1726, 1734, 1738, 1740, 1750, 1753, 1755, 1756, 1757, 1763, 1767, 1771, 1776, 1794, 1821, 1837, 1842], "size_t": 1817, "size_typ": 1821, "skeleton": [573, 904, 1206, 1212, 1704], "skew": 1798, "skiff": 1734, "skip": [283, 300, 301, 302, 333, 399, 501, 701, 1200, 1206, 1704, 1730, 1738, 1747, 1767, 1772, 1788, 1794], "sky": 323, "sl": [1788, 1836], "slack": [1788, 1818, 1825], "slash": [616, 660, 1206, 1704, 1774], "slater": [103, 295, 318, 319, 1695, 1698, 1703, 1714, 1730, 1755, 1757, 1758, 1766, 1800, 1829, 1838, 1842], "slice": [88, 100, 148, 1827], "slide": 1788, "slightli": [608, 1206, 1230, 1435, 1436, 1443, 1704, 1755, 1757, 1767, 1770, 1771, 1784, 1803, 1808, 1810, 1832, 1837, 1838, 1844], "slim": 1788, "slipchenko": 1782, "sloppi": 1740, "slow": [430, 510, 882, 1199, 1201, 1210, 1704, 1767, 1838], "slower": [786, 1210, 1704, 1810, 1838], "slowli": [1748, 1753, 1837], "small": [2, 84, 106, 295, 318, 319, 342, 374, 395, 726, 833, 1208, 1210, 1231, 1485, 1500, 1673, 1692, 1695, 1698, 1700, 1701, 1703, 1704, 1712, 1714, 1734, 1735, 1738, 1739, 1742, 1752, 1753, 1755, 1756, 1757, 1758, 1763, 1766, 1767, 1770, 1771, 1794, 1798, 1800, 1802, 1810, 1817, 1824, 1833, 1836, 1837, 1838, 1842], "small_basi": 1838, "small_cutoff": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "smaller": [284, 1001, 1215, 1226, 1362, 1692, 1704, 1740, 1746, 1752, 1753, 1754, 1755, 1756, 1757, 1763, 1785, 1810, 1828, 1837, 1838, 1844], "smallest": [356, 645, 1206, 1704, 1752, 1788, 1838], "smart": [1738, 1752, 1828, 1844], "smith": [1230, 1469, 1704, 1734, 1740, 1755, 1757, 1759, 1760, 1777, 1780, 1781, 1786, 1789, 1794, 1797, 1824, 1837, 1841], "smoke": [2, 1714, 1738, 1785, 1788, 1842], "smoketest": 2, "smooth": 1770, "smoother": 1757, "smp": [199, 251, 1767], "sn": [106, 1231, 1626, 1636, 1704, 1707, 1728, 1731, 1738, 1777, 1780, 1838], "snapshot": [2, 1767, 1786, 1787], "snarki": 1786, "snippet": [1730, 1740, 1752, 1817, 1832, 1838], "snlink": [721, 1166, 1207, 1221, 1621, 1622, 1623, 1624, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1704, 1838], "snlink_basis_toler": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "snlink_density_toler": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "snlink_force_cartesian": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "snlink_gpu_mem": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "snlink_grid_batch_s": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "snlink_integrator_kernel": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "snlink_ints_toler": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "snlink_load_balancer_kernel": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "snlink_lwd_kernel": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "snlink_mol_weights_kernel": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "snlink_pruning_schem": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "snlink_radial_point": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "snlink_radial_schem": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "snlink_reduction_kernel": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "snlink_spherical_point": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "snlink_use_debug_grid": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "snlink_use_gpu": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "snsmp2": [400, 1738, 1748, 1806, 1842], "so": [0, 2, 89, 100, 103, 106, 115, 118, 130, 132, 148, 150, 235, 236, 243, 283, 285, 287, 295, 297, 314, 318, 319, 329, 333, 335, 336, 338, 347, 373, 386, 391, 559, 576, 599, 611, 632, 633, 634, 652, 656, 662, 664, 697, 922, 934, 937, 938, 960, 1025, 1026, 1027, 1065, 1084, 1124, 1126, 1204, 1206, 1213, 1217, 1219, 1221, 1225, 1230, 1231, 1232, 1292, 1293, 1464, 1465, 1466, 1578, 1601, 1612, 1666, 1675, 1684, 1690, 1695, 1696, 1697, 1698, 1700, 1702, 1703, 1704, 1711, 1714, 1730, 1733, 1737, 1738, 1739, 1742, 1743, 1748, 1755, 1756, 1757, 1758, 1759, 1763, 1764, 1766, 1767, 1769, 1770, 1772, 1774, 1776, 1779, 1782, 1785, 1786, 1788, 1791, 1794, 1796, 1798, 1800, 1801, 1802, 1808, 1809, 1812, 1814, 1815, 1817, 1821, 1822, 1828, 1832, 1833, 1834, 1837, 1838, 1839, 1842, 1843, 1844], "so2": [1714, 1842], "so_angular_momentum": [89, 103], "so_dipol": [89, 103], "so_dkh": 103, "so_kinet": [89, 103], "so_multipol": 89, "so_nabla": [89, 103], "so_overlap": [89, 103], "so_potenti": [89, 103], "so_prop_int": 329, "so_quadrupol": [89, 103], "so_traceless_quadrupol": [89, 103], "sobasi": 132, "sobasisset": [103, 150, 1827], "soc": 1734, "socc": [0, 1, 2, 1704, 1714, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "soccpi": 150, "societi": 1734, "socket": 1767, "sodium": [1754, 1833], "sofeff": 130, "soft": 1750, "softwar": [2, 106, 1232, 1666, 1704, 1734, 1738, 1748, 1759, 1774, 1780, 1781, 1782, 1792, 1828, 1843, 1844], "softwarex": 1781, "softx": 1781, "sogga": [295, 318, 319, 1695, 1698, 1699, 1703, 1757, 1758, 1766, 1800], "sogga11": [295, 318, 319, 1695, 1697, 1698, 1699, 1700, 1703, 1758, 1766, 1800], "sointegr": 1808, "sokolov": [1734, 1753, 1781, 1786], "sol": [295, 318, 319, 1695, 1697, 1698, 1699, 1700, 1701, 1703, 1758, 1766, 1800], "sole": [1232, 1666, 1704, 1743, 1759, 1837, 1843], "solid": [214, 295, 318, 319, 1695, 1697, 1698, 1699, 1703, 1758, 1766, 1800], "solo": 1838, "solut": [342, 356, 389, 457, 470, 471, 498, 583, 594, 595, 607, 640, 660, 672, 681, 697, 736, 747, 750, 776, 839, 1181, 1182, 1199, 1200, 1206, 1208, 1209, 1210, 1222, 1230, 1231, 1435, 1555, 1564, 1649, 1704, 1714, 1738, 1742, 1749, 1753, 1754, 1755, 1757, 1770, 1771, 1803, 1810, 1829, 1836, 1837, 1838, 1842], "solv": [0, 76, 84, 133, 277, 335, 342, 447, 471, 584, 585, 609, 639, 647, 746, 777, 833, 913, 946, 1103, 1199, 1200, 1202, 1206, 1208, 1209, 1210, 1213, 1221, 1225, 1230, 1231, 1281, 1441, 1499, 1704, 1714, 1736, 1742, 1753, 1754, 1755, 1763, 1767, 1771, 1786, 1798, 1810, 1836, 1837, 1838, 1842], "solvat": [769, 780, 1209, 1672, 1704, 1738, 1749, 1776, 1780, 1803], "solvent": [778, 779, 780, 781, 1209, 1704, 1742, 1749, 1780, 1781, 1782, 1803], "solvent_epsilon": [778, 1209, 1704, 1754], "solvent_kappa": 1754, "solver": [0, 329, 335, 342, 356, 722, 723, 724, 725, 762, 767, 929, 1207, 1209, 1213, 1231, 1638, 1639, 1652, 1704, 1725, 1780, 1810, 1827, 1838, 1841], "solver_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "solver_maxit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "solver_n_guess": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "solver_n_root": [0, 1, 2, 1642, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "solver_precondit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "solver_roots_per_irrep": [0, 1, 2, 1641, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "solverengin": [342, 356, 1827], "solvertyp": 1803, "somcscf": [13, 28, 67, 1827], "some": [0, 2, 76, 84, 272, 284, 329, 342, 351, 356, 370, 381, 382, 614, 616, 647, 667, 692, 786, 823, 837, 1104, 1206, 1210, 1221, 1230, 1463, 1704, 1714, 1738, 1739, 1740, 1742, 1743, 1748, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1763, 1764, 1767, 1770, 1771, 1781, 1785, 1788, 1789, 1790, 1797, 1799, 1801, 1802, 1804, 1805, 1810, 1817, 1821, 1824, 1826, 1828, 1829, 1832, 1833, 1837, 1838, 1839, 1840, 1842, 1844], "somedai": 1828, "someon": 1804, "someth": [1738, 1756, 1757, 1785, 1786, 1801, 1804, 1817, 1828, 1844], "sometim": [0, 2, 609, 829, 1206, 1210, 1704, 1738, 1739, 1743, 1757, 1759, 1802, 1810, 1833, 1838, 1841], "somewhat": [623, 882, 1206, 1210, 1704], "somewher": 1802, "somo": [1713, 1750], "son": 1734, "sonam": 1738, "song": [1734, 1802], "soon": [635, 641, 1206, 1704, 1743], "sopert": [576, 1206, 1704], "sophist": [603, 1206, 1704], "sorri": 1743, "sort": [11, 1204, 1708, 1750, 1767, 1768, 1794, 1810], "sos_typ": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "sosa": [1734, 1771], "soscf": [0, 1, 2, 1647, 1704, 1714, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "soscf_conv": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "soscf_max_it": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "soscf_min_it": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "soscf_print": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "soscf_start_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "soscf_upd": 84, "sospi": [960, 1213, 1225, 1292, 1293, 1704], "sotoao": [100, 118], "sought": [1738, 1755, 1795], "sound": [2, 1764], "sourc": [1, 2, 106, 231, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 1730, 1733, 1734, 1735, 1737, 1740, 1743, 1746, 1748, 1749, 1750, 1752, 1754, 1759, 1761, 1762, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1772, 1773, 1774, 1775, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1791, 1792, 1794, 1797, 1799, 1800, 1803, 1804, 1806, 1807, 1808, 1823, 1824, 1825, 1826, 1827, 1828, 1832, 1839, 1842, 1844], "source_dir": 1738, "sourceforg": 1737, "sow": [350, 351, 1752, 1779, 1840], "soyda": [1692, 1734, 1752, 1781], "sp": [1692, 1711, 1714, 1722, 1730, 1743, 1752, 1770, 1842], "sp1": [1714, 1842], "space": [0, 2, 13, 75, 90, 98, 100, 115, 150, 215, 279, 295, 329, 356, 476, 568, 601, 609, 623, 647, 660, 662, 676, 683, 699, 703, 819, 842, 859, 860, 863, 867, 994, 1000, 1033, 1083, 1084, 1116, 1200, 1206, 1210, 1215, 1218, 1219, 1221, 1230, 1460, 1476, 1673, 1704, 1706, 1714, 1729, 1730, 1733, 1746, 1750, 1752, 1757, 1761, 1763, 1766, 1770, 1771, 1776, 1777, 1780, 1790, 1798, 1799, 1809, 1812, 1814, 1817, 1837, 1842, 1844], "spacestr": 11, "span": [115, 1738, 1755, 1757, 1801, 1832], "sparingli": [2, 1767, 1801], "spars": [0, 575, 1206, 1704, 1763], "sparse_ao": [575, 1206, 1704], "sparsiti": [1231, 1572, 1704, 1763, 1817, 1838], "sparta": 1734, "spatial": [0, 664, 1032, 1115, 1206, 1218, 1221, 1231, 1535, 1564, 1704, 1750, 1756, 1757, 1763, 1805, 1810, 1837, 1838], "spawn": [1230, 1435, 1436, 1704, 1837], "spdfghijkl": 1730, "spdfghiklm": 1730, "speak": [2, 1224, 1238, 1239, 1704, 1743, 1837], "spec": [8, 283, 333, 388, 1231, 1636, 1704, 1738, 1748, 1768, 1788, 1833], "speci": [609, 1206, 1704, 1750, 1754], "special": [0, 2, 11, 84, 150, 241, 242, 284, 295, 577, 641, 1206, 1692, 1704, 1738, 1740, 1743, 1748, 1752, 1757, 1764, 1766, 1767, 1768, 1780, 1788, 1798, 1801, 1802, 1809, 1810, 1813, 1824, 1836, 1837, 1838], "specialist": 1776, "specialti": 1788, "specif": [0, 2, 21, 87, 106, 248, 265, 280, 283, 295, 317, 333, 365, 375, 383, 396, 399, 454, 551, 603, 708, 822, 828, 1049, 1050, 1199, 1203, 1206, 1210, 1218, 1226, 1231, 1324, 1527, 1669, 1704, 1714, 1726, 1730, 1735, 1736, 1740, 1742, 1746, 1748, 1750, 1755, 1766, 1767, 1770, 1774, 1776, 1777, 1780, 1788, 1792, 1794, 1801, 1802, 1808, 1809, 1810, 1822, 1824, 1828, 1829, 1831, 1838, 1842, 1843, 1844], "specifi": [0, 2, 8, 70, 103, 106, 111, 209, 210, 265, 272, 283, 284, 295, 300, 301, 302, 303, 306, 307, 318, 319, 327, 333, 366, 377, 379, 384, 388, 399, 402, 474, 539, 550, 568, 569, 570, 571, 572, 573, 574, 577, 579, 582, 583, 584, 585, 586, 587, 588, 589, 590, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 606, 608, 609, 610, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 625, 626, 628, 632, 633, 634, 635, 636, 642, 648, 650, 651, 652, 653, 654, 656, 658, 659, 660, 662, 664, 665, 666, 669, 670, 671, 672, 674, 675, 676, 677, 678, 680, 681, 684, 685, 686, 687, 688, 689, 690, 691, 694, 695, 696, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 709, 711, 712, 811, 819, 824, 825, 826, 827, 829, 832, 833, 837, 860, 874, 957, 1065, 1100, 1102, 1125, 1126, 1197, 1200, 1203, 1206, 1210, 1213, 1219, 1220, 1221, 1225, 1226, 1229, 1231, 1289, 1307, 1309, 1310, 1311, 1314, 1318, 1319, 1320, 1321, 1322, 1354, 1357, 1358, 1359, 1360, 1401, 1433, 1500, 1521, 1562, 1565, 1704, 1711, 1714, 1726, 1730, 1735, 1738, 1740, 1742, 1743, 1746, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1762, 1764, 1765, 1766, 1767, 1770, 1771, 1772, 1773, 1775, 1782, 1783, 1784, 1788, 1789, 1794, 1795, 1796, 1799, 1800, 1801, 1802, 1803, 1808, 1809, 1817, 1828, 1829, 1832, 1833, 1836, 1837, 1838, 1839, 1842, 1844], "specifii": [1714, 1842], "spectacular": 1757, "spectra": [377, 1781, 1790], "spectral": [324, 874, 1210, 1704, 1706], "spectroscop": [1714, 1777, 1831, 1841, 1842], "spectroscopi": [377, 1734], "spectrum": [0, 1827, 1841], "specul": 1786, "speed": [699, 1206, 1230, 1435, 1436, 1460, 1704, 1706, 1735, 1738, 1755, 1756, 1757, 1798, 1828, 1837, 1838, 1844], "speed_of_light_in_vacuum": 1706, "speedup": [1735, 1837, 1838], "speher": 1754, "spell": [1743, 1776], "spent": 1817, "sphere": [761, 772, 773, 774, 1209, 1231, 1505, 1589, 1598, 1660, 1704, 1754, 1838], "spheric": [8, 81, 103, 657, 691, 763, 764, 766, 776, 970, 1136, 1144, 1206, 1209, 1214, 1221, 1231, 1495, 1496, 1536, 1537, 1544, 1590, 1597, 1635, 1659, 1704, 1711, 1714, 1730, 1743, 1754, 1757, 1810, 1817, 1838, 1842], "sphinx": [373, 391, 1738, 1748, 1777, 1786, 1788, 1808], "sphinx_root": 1738, "sphinxman": [323, 1764, 1785, 1786, 1788, 1804, 1823], "sphinxmini": 1764, "sphinxpdf": 1764, "spicher": 1734, "spin": [0, 2, 13, 90, 103, 150, 286, 291, 295, 298, 314, 329, 337, 341, 348, 390, 436, 437, 449, 450, 458, 459, 601, 614, 654, 658, 659, 662, 664, 669, 677, 681, 690, 692, 693, 694, 695, 835, 884, 885, 921, 922, 923, 936, 937, 938, 939, 1041, 1067, 1068, 1081, 1082, 1199, 1206, 1210, 1213, 1218, 1219, 1225, 1229, 1231, 1283, 1293, 1294, 1432, 1538, 1610, 1669, 1670, 1674, 1675, 1676, 1680, 1684, 1689, 1692, 1704, 1714, 1743, 1750, 1752, 1756, 1766, 1770, 1771, 1776, 1777, 1780, 1781, 1790, 1791, 1828, 1829, 1832, 1833, 1836, 1842, 1844], "spin_adapt": [1229, 1429, 1704], "spin_flip": [0, 1, 403, 1197, 1704], "spin_scale_typ": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "spintyp": 90, "split": [329, 621, 860, 875, 1037, 1047, 1206, 1210, 1218, 1704, 1714, 1756, 1770, 1785, 1837, 1842], "spontan": 1776, "spread": [1231, 1531, 1704], "spring": [1740, 1838], "sprintf": 229, "spuriou": [1757, 1798, 1841], "spurious": 1838, "spw92": [295, 318, 319, 1695, 1698, 1703, 1758, 1766, 1800], "sqrt": [11, 322, 1182, 1222, 1704, 1740, 1759, 1763, 1776, 1829, 1838], "squar": [89, 100, 103, 334, 839, 840, 841, 1210, 1704, 1743, 1752, 1756, 1761, 1776, 1802, 1810, 1838, 1844], "squash": 1786, "sr": [295, 662, 1206, 1229, 1231, 1398, 1511, 1695, 1697, 1698, 1700, 1701, 1704, 1706, 1707, 1731, 1753, 1758, 1766], "sr6": [68, 1759], "srb": [295, 1766], "src": [1738, 1764, 1787, 1801, 1810, 1814, 1823], "ss": [0, 138, 501, 502, 908, 1200, 1212, 1695, 1696, 1697, 1699, 1700, 1701, 1702, 1704, 1756, 1757, 1758, 1771, 1836], "ss_e_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ss_r_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ss_scale": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ss_skip_diag": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ss_vecs_per_root": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ssapt0": [295, 1046, 1064, 1218, 1689, 1704, 1766, 1776, 1837], "ssapt0_scal": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ssd": 1838, "sse": 1839, "ssh": [1714, 1737, 1767, 1842], "sshell": 1817, "ssize": 1817, "st": 1781, "stab": [1714, 1842], "stabil": [84, 145, 640, 681, 751, 752, 753, 754, 755, 756, 757, 1206, 1208, 1649, 1690, 1692, 1704, 1714, 1738, 1752, 1757, 1776, 1790, 1837, 1842], "stability1": [1714, 1842], "stability2": [1714, 1842], "stability3": [1714, 1842], "stability_add_vector": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "stability_analysi": [0, 1, 2, 84, 145, 1555, 1556, 1575, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "stability_augment_space_tol": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "stability_check": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "stability_converg": [0, 1, 2, 755, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "stability_max_space_s": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "stability_n_eigenvalu": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "stability_n_guess_vector": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "stabl": [601, 1206, 1231, 1575, 1649, 1704, 1737, 1748, 1757, 1767, 1781, 1788, 1810, 1828, 1838, 1841], "stack": [1692, 1748, 1752, 1787, 1810], "stackoverflow": 1822, "stage": [2, 284, 1736, 1740, 1743, 1747, 1752, 1767, 1776, 1786, 1814, 1828, 1840], "stage_basi": [284, 1740], "stage_schem": [284, 1740], "stage_wfn": [284, 1740], "stai": 1785, "stall": [729, 1208, 1229, 1231, 1405, 1499, 1704], "stamm": [1734, 1754], "stamp": 1804, "stand": 1730, "standalon": [388, 1808, 1838], "standard": [89, 103, 130, 271, 278, 280, 296, 297, 342, 347, 393, 568, 570, 577, 624, 658, 662, 664, 665, 704, 746, 819, 1101, 1206, 1208, 1210, 1220, 1226, 1229, 1299, 1399, 1704, 1706, 1714, 1738, 1740, 1742, 1743, 1748, 1753, 1754, 1755, 1757, 1763, 1767, 1769, 1770, 1775, 1785, 1790, 1795, 1799, 1810, 1824, 1828, 1829, 1831, 1832, 1833, 1837, 1838, 1841, 1842, 1843, 1844], "standard_acceleration_of_grav": 1706, "standard_atmospher": 1706, "standard_state_pressur": 1706, "stanton": [295, 318, 319, 655, 1206, 1704, 1714, 1734, 1744, 1745, 1766, 1777, 1780, 1800, 1842], "star": [8, 1059, 1218, 1704, 1706, 1733], "start": [0, 2, 81, 258, 260, 279, 300, 301, 302, 335, 448, 616, 635, 652, 672, 736, 783, 804, 816, 833, 851, 856, 857, 881, 895, 896, 994, 1001, 1095, 1182, 1199, 1206, 1208, 1210, 1211, 1215, 1219, 1222, 1226, 1229, 1231, 1305, 1418, 1550, 1561, 1580, 1617, 1648, 1682, 1690, 1704, 1708, 1714, 1735, 1736, 1738, 1742, 1743, 1746, 1748, 1753, 1757, 1759, 1764, 1767, 1768, 1770, 1771, 1772, 1774, 1776, 1781, 1783, 1785, 1786, 1788, 1795, 1798, 1802, 1805, 1808, 1809, 1810, 1817, 1832, 1833, 1838, 1842, 1844], "startswith": 1788, "stat": [268, 277, 342, 356, 390], "stat_pol": [669, 1206, 1704], "state": [0, 1, 2, 13, 84, 86, 106, 162, 169, 286, 298, 314, 321, 326, 327, 328, 337, 348, 351, 352, 357, 370, 371, 378, 403, 410, 418, 420, 422, 476, 488, 490, 494, 495, 526, 528, 531, 576, 603, 608, 609, 610, 613, 635, 652, 662, 672, 679, 783, 784, 823, 827, 828, 865, 887, 992, 1004, 1009, 1181, 1197, 1198, 1200, 1202, 1206, 1210, 1215, 1222, 1224, 1226, 1229, 1231, 1236, 1354, 1373, 1400, 1401, 1412, 1610, 1650, 1655, 1658, 1668, 1673, 1704, 1706, 1713, 1714, 1730, 1733, 1739, 1743, 1746, 1755, 1757, 1770, 1776, 1785, 1786, 1790, 1791, 1792, 1795, 1801, 1805, 1809, 1828, 1829, 1833, 1835, 1837, 1838, 1841, 1842, 1843, 1844], "stateinsteadmedi": 370, "statement": [328, 357, 1730, 1767, 1796, 1801, 1804, 1809], "states_per_irrep": 1840, "static": [8, 29, 68, 80, 86, 87, 88, 92, 97, 98, 100, 106, 115, 131, 138, 147, 150, 329, 539, 669, 673, 1203, 1206, 1704, 1714, 1738, 1742, 1749, 1754, 1757, 1785, 1788, 1803, 1822, 1838, 1842], "static_alpha_hf_h2o_eq_pcmsolv": 1724, "staticdoc": [1764, 1804], "stationari": [617, 1024, 1206, 1217, 1704, 1753, 1771, 1838], "statist": [277, 342, 356, 1752], "statu": [79, 86, 87, 126, 235, 236, 268, 326, 327, 328, 346, 370, 1738, 1786, 1788, 1801], "std": [1767, 1814, 1817, 1819], "stderr": 1788, "stdlib": 1738, "stdout": [2, 202, 265, 1740, 1767, 1788, 1794], "stdsuit": [1738, 1788], "steadi": 1838, "steep": 1763, "steepest": [1225, 1279, 1704, 1798, 1802], "stefan": 1706, "stefan_boltzmann_const": 1706, "steigemann": 1781, "stem": [202, 1757], "stencil": [1768, 1824], "step": [0, 106, 284, 295, 318, 319, 618, 634, 637, 648, 683, 726, 746, 843, 933, 1206, 1208, 1210, 1213, 1225, 1226, 1227, 1231, 1269, 1279, 1301, 1302, 1306, 1323, 1325, 1327, 1333, 1340, 1343, 1348, 1361, 1368, 1376, 1556, 1616, 1617, 1704, 1714, 1738, 1740, 1743, 1748, 1753, 1754, 1756, 1757, 1766, 1767, 1768, 1769, 1771, 1781, 1783, 1785, 1788, 1789, 1798, 1800, 1802, 1803, 1817, 1819, 1828, 1834, 1835, 1837, 1838, 1840, 1842, 1844], "step_typ": [0, 1, 2, 652, 1206, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "stepsiz": [572, 1206, 1704], "stick": [377, 1809], "still": [2, 342, 370, 574, 1206, 1704, 1730, 1737, 1743, 1757, 1767, 1776, 1786, 1789, 1808, 1809, 1810, 1817, 1824, 1828, 1829, 1834, 1837, 1838], "stimul": 1776, "sto": [284, 386, 1694, 1707, 1710, 1713, 1714, 1724, 1729, 1730, 1731, 1732, 1733, 1740, 1749, 1752, 1754, 1757, 1803, 1832, 1838, 1842], "stock": 1738, "stockhold": [1734, 1776, 1790], "stoichiometr": 1752, "stone": [303, 1220, 1681, 1734, 1738, 1777, 1780, 1837], "stop": [106, 257, 261, 570, 680, 838, 1002, 1006, 1007, 1206, 1210, 1215, 1226, 1229, 1231, 1334, 1347, 1426, 1567, 1571, 1704, 1746, 1838], "stopgap": 1782, "storag": [0, 150, 176, 212, 255, 262, 367, 433, 466, 507, 514, 568, 627, 668, 1199, 1200, 1201, 1202, 1206, 1225, 1242, 1704, 1708, 1742, 1743, 1756, 1767, 1771, 1776, 1824, 1841], "store": [0, 2, 11, 73, 87, 106, 112, 150, 255, 326, 327, 329, 342, 352, 356, 430, 433, 466, 488, 502, 504, 505, 507, 514, 627, 710, 734, 735, 814, 815, 822, 863, 991, 1010, 1176, 1199, 1200, 1201, 1202, 1206, 1208, 1210, 1215, 1222, 1225, 1226, 1229, 1231, 1242, 1250, 1251, 1296, 1327, 1408, 1547, 1548, 1550, 1558, 1704, 1714, 1730, 1737, 1738, 1742, 1743, 1746, 1750, 1752, 1767, 1768, 1769, 1772, 1776, 1786, 1788, 1798, 1801, 1808, 1809, 1817, 1828, 1838, 1842, 1844], "stow": 1743, "stp": [300, 301, 302, 390, 1232, 1665, 1667, 1704, 1772, 1843], "str": [2, 7, 8, 9, 11, 13, 15, 16, 18, 21, 27, 29, 31, 32, 33, 34, 38, 40, 41, 42, 44, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 64, 68, 73, 74, 75, 76, 78, 80, 84, 86, 87, 90, 91, 92, 96, 97, 98, 100, 101, 103, 104, 105, 106, 108, 111, 114, 115, 118, 119, 120, 128, 138, 147, 148, 150, 151, 152, 174, 175, 176, 187, 194, 195, 196, 197, 200, 202, 205, 207, 208, 209, 210, 211, 212, 214, 219, 220, 221, 222, 223, 225, 226, 229, 231, 235, 236, 238, 239, 244, 245, 246, 248, 249, 252, 254, 255, 257, 258, 262, 263, 265, 266, 267, 268, 269, 270, 276, 277, 278, 279, 280, 282, 283, 284, 285, 286, 287, 288, 289, 290, 292, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 308, 309, 310, 312, 313, 314, 317, 318, 319, 321, 326, 327, 330, 331, 332, 333, 336, 337, 338, 339, 340, 342, 343, 345, 346, 347, 348, 349, 350, 351, 354, 355, 358, 359, 360, 361, 364, 365, 366, 367, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 386, 388, 389, 390, 391, 392, 395, 396, 397, 399, 1740, 1743, 1752, 1759, 1761, 1764, 1766, 1768, 1769, 1772, 1774, 1775, 1791, 1794, 1797, 1799, 1800, 1826], "straight": 1810, "straightforward": [616, 635, 652, 697, 1206, 1704, 1743, 1782, 1798, 1802, 1834], "strain": [1714, 1755, 1842], "strand": [1692, 1752], "strang": [660, 1206, 1704], "strategi": [377, 575, 652, 1206, 1704, 1734, 1801, 1823, 1824], "stratmann": [356, 1231, 1528, 1704, 1734, 1757, 1841], "stream": [271, 278, 280, 1743], "streamnov": 1735, "strenght": 1841, "strength": [0, 150, 377, 608, 614, 622, 690, 709, 711, 712, 1206, 1668, 1669, 1690, 1704, 1776, 1824, 1837, 1841], "stretch": [1226, 1299, 1337, 1704, 1711, 1714, 1798, 1802, 1842], "strict": [1125, 1221, 1704, 1738, 1771, 1837], "strict_label": [296, 1769], "strictli": [1224, 1238, 1239, 1704, 1736, 1767, 1810], "stride": [1810, 1817], "string": [0, 1, 2, 8, 86, 87, 106, 111, 114, 138, 150, 229, 246, 248, 265, 266, 267, 268, 269, 270, 276, 277, 278, 280, 282, 284, 285, 286, 299, 304, 309, 313, 330, 332, 336, 337, 349, 350, 351, 360, 364, 367, 370, 373, 374, 380, 388, 389, 391, 395, 402, 403, 409, 411, 414, 421, 423, 428, 430, 434, 444, 445, 446, 454, 456, 464, 465, 467, 474, 475, 482, 483, 484, 492, 506, 508, 511, 512, 513, 516, 521, 522, 523, 533, 535, 539, 545, 546, 547, 551, 553, 556, 557, 560, 563, 565, 567, 568, 570, 571, 573, 574, 575, 577, 581, 584, 586, 589, 590, 592, 599, 600, 601, 608, 609, 610, 613, 615, 617, 619, 621, 623, 624, 627, 628, 629, 630, 631, 635, 636, 637, 638, 640, 641, 643, 647, 650, 652, 655, 656, 660, 662, 664, 665, 666, 668, 669, 673, 674, 676, 677, 683, 693, 696, 701, 702, 703, 705, 707, 708, 717, 719, 721, 725, 726, 727, 730, 731, 732, 733, 746, 748, 750, 758, 767, 769, 773, 778, 810, 811, 822, 823, 824, 825, 827, 829, 830, 835, 838, 843, 845, 851, 858, 874, 875, 880, 882, 889, 891, 892, 898, 899, 900, 926, 929, 935, 944, 946, 947, 948, 951, 959, 960, 961, 962, 963, 964, 965, 968, 975, 989, 1000, 1011, 1013, 1015, 1018, 1043, 1046, 1047, 1048, 1049, 1052, 1063, 1070, 1075, 1098, 1100, 1103, 1106, 1107, 1109, 1119, 1120, 1125, 1129, 1130, 1133, 1142, 1146, 1147, 1150, 1154, 1156, 1158, 1163, 1166, 1167, 1169, 1170, 1187, 1194, 1195, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1218, 1219, 1220, 1221, 1222, 1223, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1248, 1279, 1281, 1282, 1284, 1291, 1292, 1293, 1296, 1297, 1304, 1307, 1308, 1309, 1310, 1311, 1313, 1318, 1319, 1320, 1321, 1322, 1324, 1329, 1336, 1338, 1339, 1342, 1346, 1352, 1354, 1357, 1358, 1359, 1360, 1368, 1371, 1375, 1376, 1377, 1383, 1384, 1393, 1394, 1398, 1399, 1402, 1403, 1417, 1423, 1429, 1433, 1437, 1443, 1445, 1446, 1453, 1454, 1470, 1471, 1472, 1475, 1479, 1484, 1485, 1492, 1500, 1501, 1502, 1505, 1507, 1509, 1518, 1524, 1526, 1527, 1528, 1532, 1534, 1537, 1563, 1584, 1589, 1599, 1601, 1609, 1611, 1612, 1615, 1620, 1626, 1628, 1629, 1630, 1631, 1633, 1634, 1649, 1651, 1658, 1662, 1664, 1704, 1708, 1711, 1714, 1738, 1740, 1742, 1743, 1746, 1748, 1749, 1750, 1752, 1754, 1755, 1757, 1759, 1761, 1762, 1764, 1768, 1770, 1771, 1772, 1774, 1775, 1786, 1788, 1789, 1791, 1794, 1796, 1798, 1801, 1802, 1803, 1828, 1832, 1833, 1834, 1836, 1837, 1841, 1842, 1844], "strip": [392, 1757], "strnotoutfil": [282, 332], "strong": [446, 484, 523, 547, 1199, 1200, 1202, 1203, 1704, 1789, 1838], "strongli": [342, 568, 656, 664, 666, 1206, 1230, 1441, 1704, 1738, 1770, 1795, 1805, 1833, 1837], "structur": [0, 2, 106, 318, 319, 329, 342, 356, 619, 635, 652, 1206, 1692, 1704, 1706, 1714, 1734, 1738, 1743, 1752, 1755, 1757, 1759, 1767, 1772, 1777, 1778, 1781, 1786, 1787, 1788, 1790, 1791, 1795, 1796, 1800, 1804, 1808, 1814, 1824, 1831, 1833, 1835, 1836, 1840, 1841, 1842], "stub": 1733, "studi": [1767, 1781, 1828, 1833, 1837, 1838, 1844], "stuff": [1757, 1788, 1833], "style": [2, 282, 285, 287, 295, 318, 319, 332, 336, 338, 1730, 1738, 1740, 1766, 1788, 1800, 1828], "sub": [794, 1210, 1231, 1620, 1704, 1738, 1750, 1810], "subblock": [100, 135, 837, 1210, 1704, 1755], "subchannel": 1748, "subdegen": 20, "subdictionari": 370, "subdir": 1785, "subdirectori": [1743, 1785, 1832, 1842], "subdivis": [1231, 1516, 1704], "subfold": [0, 2], "subgroup": [20, 573, 609, 616, 619, 696, 698, 1206, 1704, 1781, 1833, 1843], "subject": [676, 684, 685, 689, 691, 1125, 1126, 1206, 1221, 1704, 1757, 1771, 1833, 1837], "submatrix": [830, 833, 1210, 1704, 1810], "submit": [1230, 1469, 1704, 1786, 1788, 1828, 1837, 1844], "submitt": 1786, "submodul": 1764, "subn": 20, "subscrib": 1748, "subscript": [1750, 1764, 1798, 1801, 1837], "subsequ": [609, 706, 1206, 1225, 1270, 1704, 1714, 1767, 1776, 1835, 1842], "subset": [150, 284, 626, 628, 1206, 1226, 1371, 1692, 1704, 1711, 1714, 1736, 1740, 1743, 1752, 1767, 1785, 1794, 1796, 1802, 1824, 1833, 1837, 1838, 1842], "subsidiari": 1837, "subspac": [0, 1, 13, 150, 277, 342, 356, 404, 470, 583, 725, 751, 752, 755, 808, 811, 837, 842, 1197, 1200, 1206, 1207, 1208, 1210, 1704, 1714, 1755, 1795, 1841, 1842], "substanti": [0, 575, 1206, 1704, 1760], "substitu": 1770, "substitut": [106, 1232, 1666, 1704, 1738, 1748, 1755, 1756, 1757, 1764, 1770, 1786, 1788, 1810, 1832, 1843], "substract": 100, "subsum": [284, 1692, 1740, 1752], "subsystem": [1748, 1770, 1776, 1781, 1794], "subtaskcomput": [1768, 1777], "subtl": 1797, "subtli": 1810, "subtract": [100, 539, 835, 1203, 1210, 1704, 1742, 1752, 1828, 1844], "succe": 1838, "success": [0, 86, 126, 273, 647, 1002, 1006, 1007, 1008, 1009, 1206, 1215, 1231, 1490, 1704, 1738, 1743, 1746, 1757, 1788, 1794, 1802], "successfulli": [1781, 1788, 1802, 1837], "successor": 1838, "suddenli": 1767, "sudo": 1748, "suffer": [1756, 1798, 1838], "suffic": [1730, 1802, 1833], "suffici": [0, 2, 574, 1206, 1704, 1714, 1738, 1742, 1743, 1753, 1760, 1767, 1771, 1817, 1828, 1837, 1838, 1842, 1844], "suffix": [202, 1738, 1775, 1788, 1838], "suggest": [2, 279, 1230, 1469, 1704, 1736, 1748, 1767, 1788, 1802, 1814, 1833, 1837, 1838], "suit": [400, 586, 1206, 1704, 1738, 1739, 1742, 1743, 1777, 1788, 1814, 1824, 1832, 1840], "suitabl": [2, 8, 285, 287, 336, 338, 373, 386, 389, 391, 1158, 1221, 1704, 1738, 1755, 1756, 1757, 1781, 1829, 1838, 1841], "sulfid": [1692, 1752], "sum": [13, 64, 100, 150, 314, 346, 835, 1101, 1210, 1220, 1226, 1231, 1303, 1341, 1538, 1704, 1740, 1742, 1759, 1771, 1775, 1776, 1791, 1794, 1802, 1833, 1836, 1837, 1838], "sum_": [377, 1742, 1755, 1757, 1759, 1763, 1771, 1776, 1798, 1829, 1838, 1841], "sum_a": [1742, 1755, 1771, 1829], "sum_i": [1755, 1771, 1829], "sum_ia": 11, "sum_k": 1771, "sum_of_squar": 100, "summar": [0, 1730, 1733, 1742, 1743, 1748, 1753, 1771, 1798, 1799, 1817, 1838], "summari": [3, 5, 6, 7, 8, 9, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 26, 27, 29, 30, 61, 62, 63, 64, 66, 68, 70, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 86, 87, 88, 89, 90, 91, 92, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 108, 110, 111, 112, 113, 114, 115, 118, 119, 120, 122, 126, 128, 130, 131, 132, 133, 134, 135, 137, 138, 139, 140, 141, 143, 144, 145, 147, 148, 149, 150, 183, 184, 267, 275, 292, 321, 322, 323, 324, 325, 326, 327, 329, 343, 807, 1210, 1704, 1738, 1739, 1740, 1743, 1757, 1786, 1790, 1828, 1837, 1838, 1843, 1844], "summat": [1228, 1394, 1704, 1753, 1817], "summation_field": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "super_mix": [1714, 1842], "superbuild": 1738, "supercomput": [575, 1206, 1704, 1738], "superfici": [1714, 1842], "superfunct": [84, 147, 1714, 1757, 1827, 1842], "superior": [284, 1740, 1838], "supermatrix": [623, 1206, 1231, 1592, 1704], "supermolecular": [1802, 1837], "superposit": [84, 1714, 1777, 1779, 1781, 1831, 1838, 1842], "supersed": 1767, "supersystem": [1776, 1794], "supplement": [1714, 1842], "supplementari": [1738, 1837], "suppli": [100, 106, 148, 150, 284, 314, 331, 577, 592, 679, 706, 1206, 1704, 1730, 1733, 1738, 1740, 1743, 1748, 1791, 1797, 1801, 1817, 1821, 1838, 1844], "support": [0, 18, 128, 265, 284, 296, 381, 382, 787, 1129, 1210, 1221, 1224, 1231, 1241, 1651, 1692, 1704, 1730, 1735, 1738, 1740, 1742, 1749, 1750, 1752, 1753, 1754, 1756, 1757, 1759, 1761, 1769, 1774, 1775, 1777, 1782, 1790, 1792, 1794, 1797, 1798, 1802, 1803, 1810, 1817, 1823, 1826, 1832, 1833, 1836, 1837, 1838, 1841, 1844], "suppos": [1801, 1828, 1844], "suppress": [1738, 1759, 1794, 1828], "supramolecular": 1794, "sure": [884, 1126, 1210, 1221, 1704, 1714, 1734, 1735, 1738, 1747, 1748, 1753, 1756, 1767, 1774, 1781, 1785, 1788, 1817, 1823, 1833, 1838, 1842], "surfac": [617, 1206, 1704, 1711, 1714, 1750, 1778, 1781, 1802, 1832, 1842], "surpris": [1828, 1844], "surprisingli": [1757, 1844], "surround": [1730, 1844], "survei": 1788, "surviv": 1817, "suscept": [1828, 1837, 1844], "suspect": 1757, "sv": [1231, 1485, 1694, 1704, 1732, 1733], "sv_p_": [1694, 1707, 1731, 1732], "svp": [106, 1694, 1707, 1711, 1731, 1732, 1733, 1740, 1772, 1774, 1794], "svpd": [1694, 1707, 1731, 1732, 1733], "svwn": [295, 318, 319, 1695, 1698, 1703, 1714, 1739, 1757, 1758, 1766, 1781, 1800, 1842], "swap": [1713, 1742], "swear": 1767, "sweep": [1007, 1215, 1704, 1746], "switch": [2, 153, 614, 656, 769, 855, 1101, 1206, 1209, 1210, 1220, 1231, 1510, 1704, 1738, 1748, 1754, 1757, 1775, 1788, 1789, 1802, 1809, 1817, 1838], "sx": [295, 1695, 1697, 1698, 1700, 1701, 1702, 1758, 1766, 1817], "sy": [1767, 1786, 1788, 1817, 1828], "sym": [1714, 1785, 1841, 1842], "sym_check": [697, 1206, 1704], "symbol": [81, 91, 106, 120, 388, 389, 1150, 1221, 1229, 1433, 1704, 1736, 1746, 1764, 1767, 1771, 1808, 1833, 1835], "symemtri": [1714, 1842], "symlink": [1738, 1785, 1788], "symm": [284, 1713, 1740, 1752, 1785], "symm_oper": 17, "symmetr": [0, 1, 2, 13, 100, 103, 106, 300, 301, 302, 387, 573, 574, 575, 603, 656, 681, 697, 726, 881, 1206, 1208, 1210, 1226, 1231, 1301, 1591, 1601, 1649, 1704, 1711, 1714, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "symmetri": [0, 2, 11, 14, 16, 17, 91, 100, 106, 111, 118, 128, 130, 132, 139, 143, 145, 150, 237, 259, 262, 263, 286, 287, 295, 298, 300, 301, 302, 337, 338, 348, 363, 387, 390, 399, 420, 490, 495, 528, 569, 573, 574, 593, 609, 614, 615, 616, 617, 619, 648, 660, 671, 672, 681, 697, 698, 707, 833, 835, 887, 993, 1124, 1150, 1194, 1198, 1200, 1202, 1206, 1210, 1215, 1221, 1222, 1226, 1229, 1230, 1231, 1232, 1308, 1431, 1432, 1433, 1564, 1655, 1666, 1689, 1704, 1708, 1714, 1726, 1730, 1734, 1735, 1742, 1743, 1746, 1749, 1750, 1752, 1753, 1754, 1755, 1763, 1766, 1770, 1772, 1776, 1777, 1782, 1785, 1789, 1790, 1795, 1798, 1802, 1803, 1805, 1810, 1828, 1829, 1832, 1841, 1842, 1843, 1844], "symmetrize_gradi": 100, "symmetry_from_input": 106, "symmetryoper": [17, 1827], "symnorm": 12, "sync": [86, 150, 1786], "synergist": 1828, "synonym": [677, 1206, 1226, 1352, 1704, 1828, 1833], "syntax": [2, 279, 366, 379, 380, 1714, 1730, 1738, 1743, 1757, 1767, 1768, 1774, 1777, 1779, 1799, 1803, 1824, 1828, 1832, 1833, 1842, 1844], "sysadmin": 1738, "sysroot": 1738, "system": [1, 2, 106, 150, 261, 267, 286, 295, 298, 300, 301, 302, 337, 348, 381, 382, 608, 620, 660, 726, 777, 861, 1206, 1208, 1209, 1210, 1224, 1226, 1231, 1237, 1298, 1655, 1692, 1704, 1714, 1722, 1738, 1742, 1743, 1746, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1762, 1763, 1765, 1766, 1767, 1768, 1770, 1771, 1772, 1773, 1775, 1777, 1782, 1783, 1784, 1785, 1794, 1795, 1798, 1802, 1803, 1805, 1808, 1810, 1824, 1826, 1829, 1833, 1835, 1837, 1838, 1839, 1841, 1842], "system_n": 1738, "systemat": [2, 1781, 1837], "sz": [1817, 1821], "szabo": [1734, 1757], "szalai": [655, 1206, 1704], "szalewicz": [1714, 1734, 1759, 1781, 1828, 1837, 1842, 1844], "t": [0, 1, 2, 8, 11, 75, 76, 84, 103, 153, 167, 190, 279, 284, 295, 300, 301, 302, 318, 319, 346, 356, 367, 370, 384, 389, 390, 509, 568, 586, 603, 605, 635, 647, 652, 659, 664, 665, 697, 700, 786, 799, 819, 843, 846, 847, 848, 882, 961, 1070, 1075, 1083, 1084, 1085, 1088, 1106, 1201, 1205, 1206, 1210, 1213, 1219, 1221, 1226, 1229, 1230, 1354, 1399, 1406, 1411, 1420, 1428, 1429, 1455, 1480, 1669, 1670, 1675, 1680, 1683, 1689, 1692, 1694, 1695, 1697, 1698, 1700, 1702, 1703, 1704, 1706, 1707, 1711, 1714, 1717, 1720, 1723, 1730, 1731, 1732, 1733, 1734, 1735, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1777, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1828, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1844], "t1": [11, 641, 1206, 1669, 1680, 1692, 1704, 1708, 1752, 1776, 1781], "t1_diagnost": 11, "t2": [429, 641, 1199, 1206, 1230, 1459, 1461, 1704, 1708, 1837], "t2_coupl": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "t3": [699, 1206, 1704], "t3_ws_incor": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "t_": [1742, 1757, 1763, 1771, 1829, 1836], "t_1": [432, 452, 457, 1199, 1704, 1742, 1771], "t_1t_2": 1771, "t_2": [452, 457, 1199, 1704, 1742, 1771], "t_amp": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "t_cut_clmo": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "t_cut_cpao": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "t_cut_do": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "t_cut_do_ij": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "t_cut_do_pr": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "t_cut_mkn": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "t_cut_pno": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "t_cut_pr": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "t_i": [1742, 1771, 1829], "t_ia": 11, "ta": [1707, 1731], "tabl": [0, 17, 20, 86, 268, 284, 292, 318, 319, 343, 373, 391, 439, 473, 586, 737, 818, 850, 924, 1079, 1166, 1199, 1200, 1206, 1208, 1210, 1213, 1219, 1221, 1224, 1225, 1226, 1229, 1231, 1233, 1236, 1257, 1324, 1410, 1497, 1521, 1552, 1704, 1714, 1730, 1733, 1739, 1740, 1742, 1746, 1752, 1753, 1755, 1756, 1757, 1759, 1760, 1764, 1771, 1777, 1779, 1781, 1788, 1789, 1792, 1794, 1798, 1799, 1800, 1801, 1802, 1817, 1828, 1833, 1834, 1838, 1842, 1844], "tabul": [1714, 1743, 1752, 1754, 1759, 1832, 1842], "tack": [1743, 1767], "tackl": 0, "tag": [265, 284, 1738, 1740, 1757, 1767, 1785, 1787, 1794, 1804, 1814], "tagl": 1835, "taglin": [267, 1759], "tailor": [1738, 1808], "tajti": [655, 1206, 1704], "takatani": [1692, 1752], "take": [2, 100, 148, 335, 609, 749, 1206, 1208, 1225, 1232, 1279, 1296, 1666, 1704, 1714, 1735, 1737, 1738, 1743, 1747, 1748, 1750, 1752, 1753, 1756, 1757, 1759, 1762, 1764, 1767, 1770, 1775, 1783, 1788, 1795, 1797, 1798, 1799, 1801, 1802, 1809, 1810, 1822, 1824, 1828, 1833, 1837, 1838, 1842, 1843], "taken": [0, 2, 8, 84, 150, 285, 287, 336, 338, 346, 374, 395, 474, 573, 639, 1200, 1206, 1228, 1231, 1382, 1616, 1617, 1692, 1704, 1714, 1735, 1742, 1749, 1752, 1759, 1770, 1782, 1797, 1802, 1817, 1833, 1838, 1842], "takeshita": 1734, "tamm": [1231, 1656, 1704, 1841], "tamp": 1721, "tang": [1013, 1018, 1216, 1692, 1704, 1752], "tar": [1759, 1788], "tarbal": [1736, 1738, 1759, 1767, 1774], "target": [0, 8, 265, 268, 284, 288, 295, 299, 300, 301, 302, 312, 318, 319, 329, 339, 349, 378, 381, 382, 827, 992, 1158, 1210, 1215, 1221, 1229, 1231, 1400, 1401, 1412, 1433, 1485, 1704, 1714, 1738, 1740, 1746, 1754, 1764, 1766, 1768, 1770, 1772, 1781, 1785, 1788, 1792, 1794, 1795, 1800, 1808, 1815, 1826, 1837, 1842], "task": [92, 111, 265, 715, 1112, 1207, 1221, 1704, 1740, 1743, 1767, 1768, 1770, 1772, 1776, 1781, 1794, 1804, 1823, 1824, 1828, 1831, 1832, 1840, 1844], "task_bas": [1740, 1768, 1772, 1794, 1827], "task_list": [1740, 1772, 1794], "task_plann": [1768, 1777], "taskcomput": [1768, 1777], "tast": 1738, "tau": [295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1706, 1753, 1758, 1766, 1800, 1802], "tau_": 1757, "tau_compton_wavelength": 1706, "tau_compton_wavelength_over_2_pi": 1706, "tau_electron_mass_ratio": 1706, "tau_mass": 1706, "tau_mass_energy_equival": 1706, "tau_mass_energy_equivalent_in_mev": 1706, "tau_mass_in_u": 1706, "tau_molar_mass": 1706, "tau_muon_mass_ratio": 1706, "tau_neutron_mass_ratio": 1706, "tau_p": 1753, "tau_proton_mass_ratio": 1706, "taub": [1229, 1427, 1704, 1734], "tb": [650, 1206, 1704], "tc": [1707, 1731], "tcc": 1802, "tcscf": [569, 593, 676, 1206, 1222, 1682, 1704, 1714, 1781, 1829, 1842], "tcsh": [1738, 1748, 1767], "tcshrc": [1738, 1748, 1767], "td": [106, 295, 662, 1206, 1232, 1666, 1690, 1698, 1704, 1714, 1749, 1754, 1766, 1776, 1795, 1803, 1841, 1842, 1843], "tda": [608, 1206, 1231, 1656, 1704, 1714, 1841, 1842], "tddft": [295, 1698, 1757, 1766, 1781, 1841], "tdm": [0, 1, 2, 1704, 1714, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "tdscf": [277, 1652, 1653, 1704, 1714, 1724, 1777, 1790, 1842], "tdscf_coeff_cutoff": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1843, 1844], "tdscf_excit": 1841, "tdscf_guess": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1843, 1844], "tdscf_maxit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1843, 1844], "tdscf_print": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1843, 1844], "tdscf_r_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1843, 1844], "tdscf_state": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1843, 1844], "tdscf_tda": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1843, 1844], "tdscf_tdm_print": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1843, 1844], "tdscf_triplet": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1843, 1844], "tdscfconvergenceerror": 1827, "te": [1707, 1731], "te_integr": 1785, "team": [1757, 1777, 1780], "tear_down": 1788, "tech": [1692, 1752], "technic": [130, 1777, 1796, 1798], "techniqu": [441, 478, 517, 1199, 1200, 1202, 1229, 1688, 1704, 1742, 1753, 1757, 1771, 1775, 1781, 1798, 1824, 1828, 1838, 1844], "technologi": [1757, 1818, 1838], "tei": [103, 415, 740, 905, 1053, 1198, 1208, 1212, 1218, 1224, 1231, 1234, 1569, 1704, 1785], "tell": [284, 611, 627, 682, 1206, 1704, 1738, 1740, 1767, 1801, 1808, 1828, 1832, 1833, 1844], "teller": 1759, "temp": [288, 289, 339, 340, 386, 1772], "temperatur": [390, 701, 1206, 1232, 1667, 1704, 1706, 1714, 1754, 1776, 1842, 1843], "templat": [2, 290, 1738, 1770, 1808, 1821], "tempor": 1804, "temporari": [2, 84, 87, 1708, 1738, 1740, 1767, 1770], "temporarili": [1740, 1748, 1757, 1786, 1788], "ten": 1838, "tend": [1837, 1838], "tensor": [0, 92, 94, 100, 106, 539, 598, 669, 673, 695, 915, 916, 1072, 1203, 1206, 1213, 1219, 1230, 1231, 1444, 1486, 1669, 1704, 1708, 1738, 1742, 1756, 1757, 1767, 1771, 1776, 1824, 1837, 1838], "tent": [1738, 1788], "term": [0, 92, 295, 411, 430, 513, 557, 568, 575, 660, 693, 727, 745, 951, 1012, 1014, 1016, 1017, 1019, 1020, 1022, 1029, 1198, 1199, 1202, 1204, 1206, 1208, 1213, 1216, 1218, 1225, 1229, 1230, 1283, 1294, 1403, 1404, 1442, 1448, 1449, 1450, 1454, 1464, 1465, 1466, 1704, 1714, 1730, 1733, 1735, 1738, 1742, 1748, 1753, 1756, 1757, 1759, 1766, 1770, 1771, 1776, 1781, 1785, 1786, 1788, 1790, 1792, 1793, 1798, 1801, 1802, 1810, 1817, 1823, 1828, 1829, 1831, 1832, 1833, 1836, 1838, 1842, 1844], "termin": [616, 632, 656, 755, 883, 1206, 1208, 1210, 1231, 1516, 1704, 1738, 1743, 1748, 1767, 1838], "ters": 1801, "tertiari": [1714, 1842], "tesla": 1706, "test": [100, 106, 138, 283, 285, 286, 333, 336, 337, 400, 647, 665, 719, 882, 1096, 1206, 1207, 1210, 1219, 1226, 1369, 1370, 1692, 1704, 1710, 1711, 1713, 1714, 1718, 1720, 1721, 1722, 1724, 1725, 1726, 1727, 1729, 1730, 1735, 1743, 1748, 1752, 1755, 1757, 1759, 1760, 1764, 1767, 1772, 1777, 1781, 1787, 1799, 1802, 1803, 1809, 1814, 1815, 1828, 1832, 1837, 1838, 1840, 1843, 1844], "test_": 2, "test_addon": 1738, "test_b": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "test_cfour": 1738, "test_chemps2": 1738, "test_ci_properti": 2, "test_derivative_b": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "test_dftd3": 1738, "test_dkh": 1738, "test_funct": 138, "test_gdma": 1738, "test_grimme_3c": 1738, "test_json": 1738, "test_libefp": 1738, "test_mp2": 2, "test_mrcc": 1738, "test_name_frag": 2, "test_pcmsolv": 1738, "test_psi4": 1738, "test_psi4_bas": 1738, "test_psi4_ca": 1738, "test_psi4_cc": 1738, "test_psi4_dfmp2": 1738, "test_psi4_sapt": 1738, "test_psi4_scfproperti": 1738, "test_simint": 1738, "test_v2rdm_casscf": 1738, "test_vibanalysi": [1772, 1843], "testcomparisonerror": 1827, "tester": 106, "testfunct": 1808, "testingmacro": 2, "testlabel": 1738, "testnam": 1738, "testplugin": 1808, "teter93": [295, 318, 319, 1695, 1698, 1703, 1758, 1766, 1800], "tetrahedr": 1757, "tetram": [1714, 1842], "tetrod": 1706, "texa": 1743, "text": [87, 194, 245, 271, 282, 283, 284, 332, 333, 366, 379, 380, 386, 864, 1130, 1170, 1210, 1221, 1704, 1738, 1740, 1741, 1759, 1768, 1772, 1776, 1791, 1798, 1808, 1828, 1829, 1836], "textbf": [284, 1740, 1741], "textrm": 1829, "textsf": 1776, "textsl": 1776, "tga": 1750, "th": [0, 8, 17, 81, 91, 295, 318, 319, 681, 1206, 1695, 1698, 1699, 1703, 1704, 1755, 1758, 1766, 1799, 1800], "th1": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "th2": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "th3": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "th4": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "than": [0, 2, 8, 106, 138, 150, 192, 193, 203, 204, 285, 287, 314, 329, 336, 338, 388, 550, 582, 596, 608, 666, 671, 684, 710, 794, 808, 852, 863, 867, 875, 881, 1001, 1065, 1085, 1087, 1102, 1203, 1206, 1210, 1215, 1219, 1221, 1224, 1226, 1236, 1303, 1341, 1362, 1692, 1704, 1708, 1714, 1730, 1736, 1740, 1742, 1743, 1746, 1748, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1761, 1763, 1764, 1767, 1768, 1770, 1771, 1774, 1783, 1785, 1789, 1791, 1794, 1795, 1798, 1801, 1802, 1809, 1810, 1817, 1821, 1822, 1824, 1828, 1829, 1833, 1837, 1838, 1841, 1842, 1844], "thank": [1757, 1837], "thanthiriwatt": [1692, 1752], "thc": [94, 1131, 1132, 1133, 1134, 1136, 1137, 1221, 1704], "thei": [0, 2, 284, 285, 300, 301, 302, 336, 579, 614, 616, 682, 935, 1124, 1127, 1128, 1206, 1213, 1221, 1230, 1464, 1465, 1466, 1704, 1714, 1738, 1740, 1747, 1755, 1757, 1761, 1767, 1770, 1772, 1779, 1785, 1788, 1798, 1801, 1802, 1806, 1808, 1810, 1813, 1817, 1822, 1828, 1832, 1833, 1835, 1837, 1838, 1842, 1843, 1844], "them": [2, 112, 327, 329, 346, 1065, 1129, 1219, 1221, 1704, 1714, 1737, 1738, 1740, 1743, 1747, 1748, 1757, 1759, 1767, 1768, 1770, 1772, 1779, 1785, 1788, 1794, 1801, 1802, 1804, 1808, 1809, 1810, 1815, 1817, 1822, 1823, 1824, 1832, 1835, 1837, 1842, 1844], "theme": 1738, "themselv": [1757, 1817, 1841, 1843], "theor": [1734, 1740, 1781], "theorem": [925, 1213, 1225, 1259, 1260, 1704, 1757, 1781, 1798], "theoret": [1734, 1757, 1764, 1777, 1795], "theori": [0, 84, 140, 150, 165, 173, 237, 268, 269, 295, 296, 300, 301, 302, 308, 318, 319, 352, 356, 377, 378, 381, 382, 446, 484, 677, 957, 1199, 1200, 1206, 1208, 1213, 1225, 1229, 1230, 1231, 1289, 1423, 1479, 1671, 1673, 1688, 1689, 1690, 1695, 1696, 1697, 1698, 1700, 1703, 1704, 1714, 1715, 1730, 1733, 1734, 1743, 1744, 1745, 1746, 1754, 1758, 1761, 1766, 1769, 1770, 1772, 1776, 1777, 1780, 1782, 1790, 1792, 1794, 1799, 1800, 1806, 1826, 1828, 1833, 1842, 1844], "theoryfs2": 1738, "thereaft": 1743, "thereat": 1833, "therebi": [1757, 1759, 1838], "therefor": [2, 573, 890, 1206, 1210, 1704, 1739, 1743, 1757, 1763, 1767, 1776, 1798, 1817, 1824, 1828, 1833, 1837, 1838, 1844], "thereof": [1714, 1748, 1833, 1842], "thermal": [1691, 1776, 1843], "thermo": [300, 301, 302, 307, 400, 1704, 1705, 1709, 1714, 1772, 1842, 1843], "thermochem": [307, 390, 399, 1752, 1757, 1772, 1777, 1790], "thermochemistri": [390, 1757, 1781], "thermodynam": [701, 1206, 1232, 1665, 1666, 1667, 1704, 1714, 1828, 1842, 1843, 1844], "thesi": 1770, "theta": [100, 139, 855, 1210, 1228, 1396, 1704, 1789], "theta_a": [1759, 1802], "theta_b": [1759, 1802], "theta_c": 1759, "theta_point": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "theta_vib": [386, 1772], "thi": [0, 1, 2, 8, 9, 18, 73, 81, 84, 86, 87, 88, 98, 100, 106, 115, 132, 137, 138, 148, 150, 183, 184, 208, 209, 210, 235, 236, 247, 265, 277, 283, 284, 285, 295, 296, 297, 303, 314, 318, 319, 322, 325, 329, 331, 333, 335, 336, 342, 347, 356, 368, 369, 370, 377, 380, 381, 382, 389, 393, 399, 401, 404, 406, 407, 430, 470, 476, 539, 561, 574, 599, 603, 606, 608, 609, 610, 611, 616, 619, 620, 621, 623, 625, 627, 628, 629, 630, 631, 632, 633, 634, 635, 637, 639, 640, 641, 643, 644, 645, 648, 652, 656, 657, 658, 660, 661, 664, 665, 670, 671, 672, 675, 679, 681, 694, 695, 699, 701, 708, 709, 711, 712, 738, 755, 799, 810, 811, 823, 827, 833, 842, 852, 874, 881, 882, 884, 887, 888, 890, 891, 930, 949, 958, 1001, 1065, 1070, 1076, 1084, 1085, 1088, 1095, 1096, 1101, 1125, 1126, 1127, 1128, 1129, 1148, 1158, 1170, 1197, 1199, 1200, 1203, 1204, 1206, 1208, 1210, 1213, 1215, 1219, 1220, 1221, 1224, 1225, 1226, 1229, 1230, 1231, 1232, 1233, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1244, 1266, 1290, 1293, 1299, 1303, 1326, 1341, 1362, 1441, 1442, 1480, 1485, 1500, 1507, 1521, 1564, 1619, 1644, 1655, 1666, 1688, 1690, 1692, 1704, 1713, 1714, 1723, 1726, 1730, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1746, 1747, 1748, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1762, 1763, 1764, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1774, 1775, 1776, 1779, 1781, 1782, 1785, 1786, 1788, 1789, 1790, 1791, 1792, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1808, 1809, 1810, 1817, 1820, 1821, 1824, 1826, 1828, 1829, 1831, 1832, 1833, 1834, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "thibeault": 1734, "thick": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "thiessen": 1734, "thing": [603, 884, 1206, 1210, 1704, 1757, 1801, 1804, 1817, 1828], "think": [1230, 1480, 1704, 1737, 1813, 1824, 1837], "thiophen": [1692, 1752, 1802], "third": [106, 115, 150, 259, 295, 314, 318, 319, 381, 382, 592, 616, 630, 640, 671, 1125, 1206, 1221, 1230, 1449, 1452, 1704, 1730, 1734, 1738, 1740, 1753, 1755, 1766, 1770, 1771, 1781, 1782, 1788, 1791, 1798, 1800, 1802, 1826, 1833, 1835, 1837, 1838], "thirdli": 1743, "thisenergi": 2, "thole": [1228, 1385, 1386, 1387, 1388, 1704], "thompson": [1734, 1838], "thomson": 1706, "thomson_cross_sect": 1706, "thorough": [2, 1788, 1837], "thoroughli": 1788, "those": [2, 87, 371, 574, 616, 664, 665, 672, 681, 697, 1093, 1206, 1219, 1229, 1230, 1434, 1455, 1692, 1704, 1711, 1730, 1735, 1738, 1743, 1746, 1748, 1752, 1753, 1755, 1757, 1761, 1767, 1770, 1795, 1796, 1798, 1799, 1801, 1802, 1804, 1809, 1815, 1817, 1824, 1828, 1829, 1833, 1834, 1835, 1837, 1838, 1844], "though": [1714, 1737, 1738, 1740, 1743, 1748, 1757, 1759, 1764, 1767, 1774, 1785, 1786, 1808, 1810, 1821, 1832, 1838, 1842], "thousand": 1838, "thrash": 1756, "thread": [199, 251, 435, 469, 564, 661, 806, 901, 1199, 1200, 1205, 1206, 1210, 1212, 1224, 1229, 1230, 1231, 1240, 1397, 1435, 1436, 1508, 1704, 1726, 1737, 1738, 1756, 1763, 1777, 1781, 1786, 1788, 1804, 1817, 1832, 1837, 1838], "three": [2, 100, 141, 149, 259, 282, 284, 332, 608, 609, 640, 758, 902, 1206, 1208, 1212, 1230, 1231, 1455, 1462, 1481, 1586, 1671, 1704, 1708, 1711, 1714, 1730, 1738, 1740, 1743, 1747, 1752, 1753, 1756, 1763, 1767, 1770, 1776, 1780, 1781, 1782, 1795, 1802, 1817, 1829, 1832, 1833, 1835, 1837, 1838, 1842], "three_particl": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "threecenteroverlapint": [89, 1817, 1827], "threshold": [0, 1, 138, 408, 415, 588, 606, 626, 645, 704, 722, 740, 752, 905, 972, 977, 978, 979, 980, 981, 982, 983, 984, 985, 1053, 1197, 1198, 1206, 1207, 1208, 1212, 1214, 1218, 1224, 1226, 1228, 1230, 1231, 1234, 1312, 1389, 1455, 1498, 1506, 1567, 1569, 1603, 1638, 1644, 1654, 1704, 1749, 1753, 1757, 1768, 1770, 1771, 1785, 1837, 1838, 1841], "through": [2, 8, 94, 96, 106, 247, 275, 284, 295, 300, 301, 302, 342, 356, 575, 601, 611, 632, 633, 634, 652, 656, 1130, 1206, 1215, 1216, 1221, 1232, 1666, 1677, 1678, 1704, 1710, 1714, 1715, 1716, 1726, 1737, 1738, 1739, 1740, 1742, 1743, 1748, 1749, 1752, 1755, 1756, 1757, 1759, 1762, 1764, 1765, 1766, 1767, 1768, 1773, 1774, 1775, 1776, 1777, 1780, 1781, 1782, 1783, 1784, 1785, 1788, 1792, 1793, 1794, 1797, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1814, 1817, 1828, 1829, 1832, 1833, 1834, 1837, 1838, 1839, 1842, 1843, 1844], "throughout": [641, 1206, 1704, 1757, 1821, 1832, 1837, 1838], "throughput": [1734, 1781], "throw": [106, 1721, 1837], "throw_if_neg": 100, "thrown": [115, 1797, 1837, 1838], "thu": [0, 568, 584, 1206, 1704, 1735, 1738, 1742, 1743, 1754, 1755, 1757, 1763, 1774, 1798, 1829, 1833, 1835, 1837, 1838, 1840, 1841], "thymin": [1692, 1752, 1837], "thz": 377, "ti": [1707, 1731, 1838], "tia": 11, "tick": 1788, "ticket": 1804, "tidi": 1764, "tight": [2, 699, 975, 1206, 1214, 1704, 1733, 1757, 1763, 1838], "tighten": [1756, 1838], "tighter": [1757, 1824, 1838], "tightli": 1802, "tijab": 11, "tikhonow": [1229, 1426, 1428, 1704, 1785], "tikhonow_max": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "tikhonow_omega": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "tikhonow_tripl": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "tikonow_omega": 1785, "tild": [1743, 1763, 1802, 1836], "tile": [1231, 1661, 1704], "tile_sz": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "time": [0, 2, 5, 106, 183, 184, 261, 270, 276, 277, 279, 342, 356, 368, 369, 370, 377, 572, 575, 608, 614, 622, 647, 680, 690, 709, 711, 712, 833, 837, 1069, 1206, 1210, 1219, 1226, 1230, 1231, 1299, 1476, 1477, 1565, 1629, 1692, 1704, 1706, 1726, 1738, 1739, 1748, 1752, 1755, 1756, 1757, 1763, 1764, 1767, 1768, 1769, 1771, 1777, 1781, 1782, 1786, 1788, 1790, 1792, 1801, 1802, 1808, 1809, 1817, 1821, 1828, 1832, 1833, 1837, 1838, 1840, 1844], "timer": [170, 188, 213, 257, 258, 260, 261, 1813], "timer_off": 258, "tini": [1714, 1832, 1842], "tion": 106, "tip": [0, 1817], "tip3p": [1714, 1838, 1842], "titl": [111, 265, 317, 365, 1738, 1740, 1756, 1764, 1768, 1772, 1788, 1794, 1799, 1804, 1834, 1838], "tl": [1707, 1731, 1788], "tlaplacedenomin": 1827, "tmp": [288, 289, 339, 340, 1738, 1748, 1767], "tmp_path_factori": 1788, "tn": [1734, 1841], "to_arrai": [11, 100, 106, 148, 1797], "to_dict": [2, 106], "to_fil": [150, 1767, 1838], "to_schema": 106, "to_seri": [100, 148], "to_str": 106, "to_tupl": [64, 100, 148, 331, 1797], "toc": [86, 100, 1764], "tocclean": 86, "tocentri": 100, "tocentry_exist": 86, "tocprint": 86, "tocscan": 86, "tocwrit": 86, "todo": [106, 284, 1740, 1747, 1808], "toenni": [1013, 1018, 1216, 1704], "togeth": [84, 92, 100, 115, 692, 694, 1206, 1704, 1738, 1750, 1753, 1756, 1757, 1764, 1770, 1785, 1788, 1798, 1817, 1837, 1838, 1841, 1844], "toggl": [1, 1735, 1738, 1746, 1749, 1754, 1762, 1765, 1775, 1782, 1803, 1839], "token": 1788, "tol": [2, 106, 383, 1224, 1233, 1704, 1785], "toldict": [2, 383], "toler": [0, 1, 2, 106, 115, 285, 287, 336, 338, 342, 356, 383, 401, 472, 601, 609, 660, 710, 777, 916, 1005, 1072, 1135, 1197, 1200, 1206, 1209, 1213, 1215, 1219, 1221, 1226, 1230, 1231, 1301, 1335, 1440, 1486, 1538, 1572, 1600, 1704, 1743, 1746, 1754, 1757, 1771, 1785, 1795, 1838, 1841], "tomasi": [1734, 1754, 1803], "toml": 1788, "too": [370, 374, 395, 1738, 1743, 1748, 1750, 1756, 1757, 1770, 1785, 1810, 1838], "tooclos": [106, 1768], "took": [1817, 1833], "tool": [1736, 1748, 1767, 1769, 1777, 1786, 1814, 1824, 1827, 1829, 1833], "toolchain": [1746, 1747], "toolkit": 1781, "top": [2, 383, 573, 1206, 1704, 1736, 1738, 1748, 1764, 1767, 1770, 1783, 1787, 1788, 1801, 1805, 1806, 1817, 1828, 1832, 1837, 1842, 1844], "topic": [1743, 1779, 1804], "toro": 1734, "torqu": [1678, 1722, 1776], "torsion": [1714, 1802, 1842], "tot": 1843, "tot_result": 1775, "total": [0, 2, 8, 81, 105, 106, 147, 261, 277, 284, 286, 291, 294, 295, 296, 300, 301, 302, 305, 306, 307, 318, 319, 337, 341, 342, 345, 353, 356, 374, 395, 573, 574, 603, 609, 656, 681, 697, 881, 1099, 1125, 1206, 1210, 1220, 1221, 1227, 1231, 1376, 1490, 1649, 1655, 1658, 1669, 1670, 1671, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1688, 1689, 1690, 1704, 1714, 1740, 1741, 1743, 1750, 1752, 1756, 1757, 1759, 1764, 1766, 1767, 1769, 1770, 1771, 1772, 1774, 1775, 1776, 1781, 1794, 1795, 1800, 1802, 1803, 1810, 1828, 1829, 1832, 1833, 1834, 1836, 1837, 1838, 1841, 1842, 1843, 1844], "total_index": 11, "totalenergi": 1724, "touch": [150, 208, 209, 210, 235, 236, 1764, 1801], "toward": [1738, 1743, 1768, 1802, 1808, 1837], "tpdm": [0, 1, 2, 13, 61, 1225, 1296, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "tpdm_abcd_typ": [0, 1, 2, 1244, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "tpss": [295, 318, 319, 1695, 1697, 1698, 1702, 1703, 1758, 1766, 1800], "tpssh": [295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "tpsslyp1w": [295, 318, 319, 1695, 1698, 1702, 1703, 1758, 1766, 1800], "tq": [284, 860, 875, 1210, 1704, 1714, 1733, 1740, 1741, 1743, 1842], "tq5": [284, 1733, 1740], "tq56": 1733, "tr": [384, 386, 1772], "trace": [100, 139, 767, 1209, 1704, 1738, 1754, 1799], "traceless": [89, 103, 142, 1714, 1799, 1817, 1842], "tracelessquadrupoleint": [1817, 1827], "track": [87, 1776, 1786, 1834], "tractabl": [1730, 1756, 1781], "tradeoff": [1714, 1755, 1842], "tradit": [295, 1766], "tradition": 1764, "trail": 1757, "train": 1764, "trajectori": [1226, 1356, 1374, 1704], "tran": [100, 1734, 1841, 1843], "transa": [100, 182, 259], "transb": [100, 182, 259], "transc": [100, 259], "transcrib": 1828, "transfer": [295, 1692, 1714, 1752, 1757, 1766, 1776, 1781, 1785, 1790, 1842], "transform": [13, 16, 27, 90, 98, 100, 103, 106, 115, 118, 132, 139, 150, 163, 166, 284, 295, 314, 342, 356, 474, 559, 596, 616, 664, 679, 697, 708, 710, 727, 1200, 1204, 1206, 1208, 1226, 1230, 1306, 1443, 1704, 1714, 1726, 1730, 1740, 1752, 1753, 1762, 1763, 1766, 1791, 1836, 1837, 1842], "transform_ci_integr": 13, "transform_mcscf_integr": 13, "transform_tei": 90, "transform_tei_first_half": 90, "transform_tei_second_half": 90, "transfrom": 103, "transit": [0, 13, 279, 329, 368, 369, 377, 495, 574, 603, 608, 610, 635, 652, 685, 887, 1200, 1206, 1210, 1226, 1231, 1354, 1657, 1668, 1669, 1690, 1704, 1714, 1738, 1742, 1755, 1776, 1779, 1788, 1790, 1795, 1798, 1817, 1824, 1835, 1841, 1842], "transition_dipol": [381, 382, 1826], "transition_quadrupol": [381, 382, 1826], "translat": [0, 8, 106, 284, 384, 386, 399, 676, 684, 685, 689, 691, 701, 702, 713, 1157, 1206, 1221, 1231, 1497, 1498, 1577, 1599, 1704, 1711, 1740, 1741, 1743, 1746, 1750, 1764, 1767, 1772, 1775, 1776, 1801, 1802, 1809, 1817, 1835], "translate_psi4": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "transmit": 1840, "transpar": [1735, 1739, 1759, 1767], "transpos": [27, 100, 139, 182, 259, 1756, 1810], "transpose_thi": 100, "transposit": [139, 1810], "transqt2": [561, 1204, 1704, 1738, 1809], "trap": [279, 1743], "travers": [154, 155, 156, 1714, 1779, 1810, 1842], "treat": [106, 284, 446, 484, 523, 547, 703, 704, 972, 981, 985, 1101, 1125, 1199, 1200, 1202, 1203, 1206, 1214, 1220, 1221, 1226, 1313, 1704, 1740, 1748, 1757, 1763, 1767, 1771, 1775, 1794, 1795, 1802, 1806, 1808, 1833, 1836, 1837, 1838], "treatment": [0, 284, 446, 484, 523, 547, 574, 613, 625, 626, 662, 665, 677, 693, 704, 1199, 1200, 1202, 1203, 1206, 1704, 1739, 1740, 1756, 1760, 1768, 1782, 1790, 1794, 1836, 1837], "tree": [1692, 1735, 1737, 1752, 1764, 1782, 1785, 1786, 1808], "tree_expansion_ord": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "tree_theta": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "trent": 106, "treutler": [968, 1214, 1231, 1528, 1532, 1534, 1631, 1633, 1704, 1757, 1838], "tri": 1838, "trial": [329, 342, 356, 823, 1210, 1704, 1743, 1788, 1841], "triangl": [100, 1759], "triangular": 1810, "tric": 1802, "trickier": 1817, "trigger": [2, 273, 383, 1738, 1743, 1788, 1802], "trimer": [1708, 1714, 1715, 1759, 1842], "trimethoxi": 1833, "trip": 1785, "tripl": [140, 284, 295, 318, 319, 451, 486, 605, 607, 662, 665, 1073, 1074, 1095, 1199, 1200, 1205, 1206, 1219, 1229, 1230, 1430, 1460, 1704, 1714, 1740, 1741, 1743, 1744, 1745, 1763, 1766, 1770, 1771, 1776, 1781, 1785, 1792, 1793, 1798, 1800, 1828, 1829, 1837, 1842], "triples_algorithm": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "triples_dii": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "triples_iabc_typ": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "triples_low_memori": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "triplet": [0, 1, 92, 100, 128, 277, 295, 314, 403, 494, 1197, 1200, 1224, 1231, 1239, 1658, 1669, 1680, 1704, 1714, 1727, 1755, 1766, 1776, 1785, 1791, 1828, 1829, 1837, 1838, 1841, 1842, 1844], "tripli": [697, 1206, 1704], "tritium": 1833, "triton": 1706, "triton_electron_mass_ratio": 1706, "triton_g_factor": 1706, "triton_mag_mom": 1706, "triton_mag_mom_to_bohr_magneton_ratio": 1706, "triton_mag_mom_to_nuclear_magneton_ratio": 1706, "triton_mass": 1706, "triton_mass_energy_equival": 1706, "triton_mass_energy_equivalent_in_mev": 1706, "triton_mass_in_u": 1706, "triton_molar_mass": 1706, "triton_proton_mass_ratio": 1706, "trivial": [1692, 1752, 1753, 1754, 1786, 1817], "trofimov": [0, 1734, 1781], "troublesom": [685, 1206, 1704, 1757], "trove": [1740, 1794], "truck": 1734, "true": [2, 8, 11, 13, 81, 89, 100, 103, 106, 119, 138, 148, 150, 265, 282, 283, 288, 289, 291, 295, 296, 297, 300, 301, 302, 303, 306, 307, 314, 317, 323, 332, 333, 339, 340, 341, 347, 365, 370, 374, 383, 386, 388, 389, 393, 395, 399, 418, 438, 451, 457, 461, 470, 480, 481, 486, 497, 515, 520, 526, 538, 554, 559, 561, 566, 596, 642, 675, 688, 691, 697, 698, 706, 713, 762, 795, 799, 809, 812, 821, 822, 823, 833, 836, 844, 849, 859, 860, 861, 862, 864, 865, 875, 884, 910, 919, 920, 921, 922, 945, 954, 991, 994, 1004, 1010, 1012, 1014, 1016, 1017, 1019, 1020, 1024, 1038, 1039, 1042, 1045, 1074, 1084, 1085, 1095, 1121, 1125, 1132, 1145, 1157, 1175, 1183, 1186, 1198, 1199, 1200, 1202, 1203, 1204, 1205, 1206, 1209, 1210, 1212, 1213, 1215, 1216, 1217, 1218, 1219, 1221, 1222, 1225, 1226, 1229, 1230, 1231, 1252, 1253, 1279, 1280, 1288, 1295, 1298, 1330, 1331, 1332, 1404, 1406, 1413, 1418, 1420, 1422, 1431, 1432, 1434, 1441, 1451, 1453, 1454, 1459, 1460, 1461, 1467, 1468, 1480, 1485, 1491, 1500, 1510, 1535, 1546, 1549, 1554, 1557, 1560, 1565, 1606, 1610, 1704, 1735, 1738, 1740, 1742, 1743, 1746, 1748, 1749, 1750, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1763, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1774, 1775, 1786, 1788, 1791, 1792, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1817, 1828, 1829, 1832, 1837, 1838, 1841, 1844], "true_atomic_numb": 106, "truhlar": [1692, 1730, 1733, 1734, 1740, 1752], "truli": [590, 1206, 1704, 1785], "trump": [8, 106, 1127, 1128, 1148, 1221, 1704, 1743, 1755, 1759, 1767], "truncat": [106, 882, 1083, 1084, 1210, 1219, 1230, 1460, 1462, 1704, 1730, 1742, 1755, 1763, 1767, 1768, 1771, 1781, 1828, 1837, 1844], "trust": [1226, 1344, 1345, 1704, 1802], "trv": [384, 386, 1772], "try": [277, 296, 318, 319, 827, 1210, 1704, 1738, 1750, 1756, 1757, 1769, 1785, 1786, 1788, 1800, 1802, 1823, 1828, 1838], "tschumper": 1734, "tt": [1013, 1018, 1216, 1704], "tu1": [1714, 1738, 1842, 1844], "tu2": [1714, 1842, 1844], "tu3": [1714, 1842, 1844], "tu4": [1714, 1842, 1844], "tu5": [1714, 1842], "tu6": [1714, 1842, 1844], "tune": [295, 1231, 1576, 1695, 1698, 1700, 1701, 1704, 1737, 1738, 1757, 1758, 1766, 1768, 1838], "tupl": [2, 26, 27, 64, 73, 75, 84, 89, 96, 100, 103, 106, 147, 148, 150, 295, 300, 301, 302, 318, 319, 331, 1714, 1740, 1759, 1760, 1766, 1768, 1772, 1774, 1794, 1797, 1800, 1842], "turbomol": [1226, 1324, 1704, 1802], "turn": [0, 1, 2, 106, 295, 359, 386, 468, 476, 561, 596, 599, 702, 823, 848, 882, 1022, 1024, 1095, 1200, 1204, 1206, 1210, 1216, 1217, 1219, 1230, 1231, 1441, 1480, 1485, 1500, 1508, 1520, 1704, 1738, 1742, 1748, 1757, 1766, 1770, 1771, 1772, 1776, 1782, 1785, 1789, 1802, 1808, 1828, 1837, 1838], "turn_on_actv": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "turnei": [1734, 1757, 1762, 1768, 1781, 1786, 1791, 1792, 1838], "tutori": [1749, 1770, 1777, 1781, 1824, 1832], "tuxfamili": 1738, "tw": [2, 285, 296, 336, 1769], "tweak": [0, 96, 138, 1737, 1757, 1770, 1787, 1837], "tweet": 1788, "twice": [0, 608, 1206, 1704, 1757, 1838], "two": [0, 2, 13, 20, 69, 84, 90, 94, 100, 112, 113, 115, 128, 143, 144, 148, 149, 150, 182, 284, 286, 291, 294, 295, 297, 309, 314, 327, 329, 337, 341, 345, 346, 347, 356, 360, 383, 416, 433, 466, 507, 514, 559, 574, 576, 589, 608, 609, 616, 627, 641, 660, 662, 666, 676, 693, 726, 727, 823, 826, 828, 843, 855, 858, 884, 888, 1167, 1182, 1198, 1199, 1200, 1201, 1202, 1204, 1206, 1208, 1210, 1221, 1222, 1225, 1230, 1242, 1459, 1461, 1690, 1704, 1708, 1713, 1714, 1734, 1735, 1738, 1740, 1742, 1750, 1752, 1753, 1754, 1756, 1757, 1759, 1763, 1764, 1766, 1770, 1771, 1774, 1775, 1776, 1781, 1782, 1783, 1785, 1786, 1788, 1789, 1791, 1792, 1795, 1797, 1798, 1799, 1801, 1802, 1803, 1806, 1809, 1817, 1821, 1823, 1824, 1828, 1829, 1832, 1833, 1835, 1836, 1837, 1838, 1842, 1844], "twobodyaoint": [69, 89, 144, 1817, 1827], "twocon": [1187, 1222, 1704, 1829], "twoel_hx": 84, "twoel_hx_ful": 128, "twoelectronint": 1827, "twopdm": 1708, "twostep": [726, 727, 746, 749, 750, 1208, 1704, 1753], "tx": [1750, 1836], "txt": [1738, 1764, 1783, 1785, 1788, 1804, 1808, 1823, 1839], "ty": [1750, 1757], "type": [0, 1, 2, 8, 11, 13, 14, 64, 68, 84, 92, 100, 106, 128, 130, 145, 147, 148, 150, 158, 176, 212, 255, 259, 262, 263, 265, 266, 267, 268, 270, 276, 282, 290, 292, 294, 298, 299, 300, 301, 302, 304, 305, 308, 309, 310, 311, 313, 318, 319, 321, 322, 324, 325, 328, 329, 330, 331, 332, 334, 335, 342, 343, 344, 345, 348, 349, 350, 351, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 380, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 395, 396, 397, 399, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1673, 1692, 1704, 1711, 1714, 1727, 1730, 1733, 1735, 1738, 1740, 1743, 1746, 1749, 1750, 1752, 1754, 1755, 1759, 1761, 1762, 1768, 1770, 1772, 1775, 1786, 1789, 1791, 1794, 1795, 1796, 1797, 1800, 1801, 1802, 1803, 1804, 1808, 1809, 1814, 1817, 1819, 1822, 1823, 1824, 1828, 1829, 1832, 1833, 1836, 1837, 1841, 1842, 1843, 1844], "typic": [0, 284, 1740, 1749, 1755, 1757, 1767, 1785, 1789, 1798, 1803, 1810, 1824, 1838], "tyrosin": 1802, "tz": [295, 318, 319, 1695, 1698, 1699, 1703, 1707, 1731, 1733, 1738, 1750, 1758, 1766, 1800], "tz2p": [1694, 1707, 1731, 1732, 1733], "tz2pf": [1694, 1707, 1731, 1732, 1733], "tzvp": [1694, 1707, 1730, 1731, 1732, 1733], "tzvpd": [1694, 1707, 1731, 1732, 1733], "tzvpp": [1694, 1707, 1714, 1731, 1732, 1733, 1842], "tzvppd": [1694, 1707, 1731, 1732, 1733], "u": [97, 106, 111, 386, 389, 390, 394, 979, 980, 982, 1214, 1230, 1470, 1679, 1689, 1692, 1704, 1706, 1734, 1738, 1743, 1748, 1752, 1757, 1764, 1772, 1776, 1781, 1785, 1786, 1797, 1798, 1828, 1833, 1836, 1837, 1838, 1841, 1844], "ubiquit": [1757, 1781], "ubuntu": [1737, 1738, 1746, 1748, 1749, 1762, 1773, 1775, 1781, 1782, 1784, 1803, 1806, 1807, 1808, 1839], "uff": [773, 1209, 1704, 1754, 1803], "ufh": [1714, 1842], "ugc": 1832, "ugur": 1798, "uhf": [0, 1, 2, 11, 286, 298, 300, 301, 302, 337, 348, 376, 381, 382, 397, 409, 448, 456, 475, 492, 562, 597, 601, 640, 662, 664, 672, 676, 681, 694, 748, 1154, 1187, 1197, 1199, 1200, 1204, 1206, 1208, 1212, 1221, 1222, 1564, 1599, 1614, 1662, 1674, 1682, 1704, 1708, 1710, 1711, 1714, 1724, 1739, 1742, 1743, 1749, 1753, 1754, 1756, 1757, 1768, 1771, 1772, 1776, 1781, 1798, 1803, 1809, 1826, 1827, 1828, 1832, 1833, 1837, 1838, 1842, 1844], "uhf_noon": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "uhfl": [1714, 1842], "uiuc": 1750, "uk": [1564, 1599, 1704, 1714, 1739, 1756, 1757, 1768, 1781, 1798, 1838, 1842], "uksfunct": 1827, "uli": 1810, "ultim": [1788, 1802, 1808], "ultrafin": [1231, 1636, 1704], "um": 1706, "umcn": [2, 287, 338, 1791], "umn": [1692, 1752], "ump2": 1756, "un": [386, 389, 1752, 1772], "unabl": [1743, 1759, 1774, 1782, 1792], "unaccept": [374, 395], "unaffect": [389, 1232, 1666, 1704, 1743, 1748, 1843], "unalt": [628, 1206, 1704], "unapp": [1828, 1844], "unavail": [652, 679, 1206, 1704, 1771, 1838], "unawar": 1804, "unbecom": 387, "uncertain": [355, 358], "uncertainti": 1706, "unchang": [370, 1226, 1318, 1319, 1320, 1321, 1322, 1704, 1743, 1759, 1760], "uncheck": 1788, "unclassifi": [386, 1772], "uncom": [2, 1788], "uncompil": 1738, "uncompress": [100, 148], "uncondition": [596, 1206, 1704], "uncontract": [590, 1206, 1704, 1714, 1836, 1842], "uncoupl": [75, 1837], "uncp": [1752, 1776], "undefin": [1692, 1736, 1752, 1767, 1787, 1788, 1808], "under": [2, 100, 111, 148, 283, 333, 390, 1737, 1738, 1770, 1771, 1781, 1785, 1788, 1795, 1802, 1806, 1833, 1838], "underbrac": 1838, "undergon": 1824, "underli": [2, 8, 1230, 1471, 1704, 1757, 1763, 1770, 1776, 1781, 1797, 1817, 1837], "underlin": 1809, "underneath": 1810, "underscor": [2, 96, 373, 376, 391, 397, 1730, 1764, 1785], "understand": [620, 681, 1206, 1704, 1739, 1770, 1803, 1817, 1828, 1844], "understood": 1754, "undertak": 1779, "undertaken": 1838, "undesir": 111, "undisplac": [1150, 1221, 1704, 1772], "undo": 1748, "unexpect": [2, 1738, 1782], "unfamiliar": 1844, "unfinish": [680, 1206, 1704], "unfit": 1708, "unfortun": [1753, 1757, 1810], "unfound": 1738, "unfrag": 1768, "unfreez": [1226, 1371, 1704], "unfreeze_dihedr": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "unfrozen": [1125, 1221, 1704, 1771, 1802, 1837], "unfulfil": 1802, "ungainli": [284, 1740, 1741], "uni": [106, 1759, 1774], "unif": [267, 1759], "unifi": [76, 1706, 1764, 1824], "unified_atomic_mass_unit": 1706, "uniform": [2, 1838], "uniformli": 1838, "unify_part2": 76, "unimport": 1771, "uniniti": [92, 1821], "uninstal": 1748, "unintend": 1821, "union": [2, 8, 64, 100, 106, 148, 150, 255, 263, 265, 267, 285, 287, 308, 322, 325, 331, 336, 338, 346, 350, 367, 370, 374, 377, 388, 395, 399, 1740, 1752, 1754, 1759, 1768, 1774, 1794, 1797], "uniq": [106, 1767], "uniqu": [98, 106, 115, 150, 352, 521, 523, 545, 547, 1202, 1203, 1704, 1743, 1756, 1759, 1776, 1794, 1810, 1817, 1828, 1833, 1837, 1838], "unit": [2, 70, 83, 86, 106, 139, 149, 288, 289, 339, 340, 368, 369, 374, 377, 386, 388, 390, 395, 399, 550, 650, 651, 705, 771, 781, 830, 861, 881, 994, 1098, 1203, 1206, 1209, 1210, 1215, 1220, 1226, 1228, 1231, 1349, 1351, 1364, 1365, 1383, 1586, 1704, 1706, 1734, 1742, 1743, 1746, 1749, 1754, 1755, 1757, 1767, 1768, 1770, 1772, 1775, 1776, 1782, 1799, 1802, 1803, 1821, 1828, 1829, 1832, 1833, 1837, 1838, 1841, 1844], "unitari": [994, 1010, 1215, 1704, 1734, 1746, 1781, 1798, 1838], "uniti": [635, 652, 1206, 1704, 1817], "unitless": 1776, "univ": [1692, 1752], "univers": [1694, 1706, 1707, 1731, 1732, 1734, 1757, 1791, 1794, 1832, 1837, 1839], "unix": 1781, "unknown": 1730, "unlabel": [284, 295, 300, 301, 302, 318, 319, 381, 382, 1730, 1740, 1743, 1752, 1766, 1772, 1800, 1826], "unless": [2, 8, 284, 295, 380, 457, 664, 676, 684, 685, 689, 691, 1199, 1206, 1226, 1324, 1692, 1704, 1730, 1738, 1740, 1742, 1743, 1752, 1755, 1756, 1764, 1766, 1767, 1768, 1776, 1785, 1786, 1801, 1802, 1804, 1808, 1832, 1838], "unlik": [0, 106, 367, 1759, 1810, 1817, 1833, 1838], "unmet": 1743, "unnam": 1799, "unnecessari": [106, 284, 1740, 1743, 1798, 1817], "unneed": 1738, "unnorm": [81, 122], "uno": 106, "uno_cutoff": 106, "unoccupi": [150, 314, 589, 671, 1102, 1128, 1145, 1165, 1206, 1221, 1704, 1750, 1755, 1771, 1789, 1791, 1810, 1829, 1838], "unoptim": 1738, "unorthogon": 115, "unpack": [1737, 1759, 1774, 1788], "unpair": [1828, 1833, 1844], "unperturb": [665, 1206, 1704], "unphys": [1770, 1789, 1798, 1802, 1838], "unpolar": 138, "unpredict": 1738, "unprovid": 1833, "unprun": 1757, "unpublish": [1692, 1752], "unreason": 1838, "unreconcil": 1743, "unrelax": [526, 600, 608, 665, 674, 1202, 1206, 1704, 1771], "unresolv": [1746, 1764], "unrestrict": [0, 2, 286, 298, 337, 348, 352, 676, 1206, 1229, 1231, 1429, 1564, 1704, 1714, 1739, 1742, 1753, 1756, 1757, 1771, 1781, 1798, 1799, 1828, 1838, 1842, 1844], "unscal": [148, 1230, 1470, 1704, 1776, 1832, 1837], "unset": [1231, 1654, 1704, 1738, 1767, 1841], "unsetenv": [1738, 1767], "unsign": [1810, 1821], "unsort": 1838, "unsound": 1837, "unspecifi": [106, 150, 346, 1711, 1714, 1774, 1809, 1842], "unsplit": [1036, 1218, 1704, 1770], "unstabl": [601, 1206, 1704, 1798, 1838], "unsupport": 1735, "untest": [271, 1774, 1822], "unthread": 1738, "until": [2, 247, 606, 645, 1206, 1226, 1231, 1341, 1498, 1663, 1704, 1752, 1753, 1757, 1781, 1788, 1802, 1838, 1841], "untouch": 2, "untweak": [267, 1759, 1776], "unus": [106, 1231, 1521, 1704, 1774], "unusu": [1756, 1844], "unvalid": 106, "unwant": [1746, 1762, 1765, 1773, 1775, 1782, 1783, 1784, 1839], "unzip": 1737, "uocc": 1810, "up": [0, 1, 2, 8, 84, 86, 92, 106, 111, 154, 155, 156, 157, 158, 226, 284, 323, 393, 433, 440, 466, 507, 514, 568, 699, 1124, 1126, 1199, 1200, 1201, 1202, 1206, 1221, 1224, 1225, 1230, 1231, 1235, 1242, 1435, 1436, 1460, 1483, 1490, 1555, 1704, 1714, 1723, 1735, 1736, 1737, 1740, 1742, 1743, 1748, 1754, 1755, 1757, 1759, 1762, 1764, 1767, 1768, 1770, 1771, 1776, 1777, 1782, 1783, 1786, 1788, 1794, 1798, 1799, 1801, 1802, 1804, 1806, 1809, 1810, 1814, 1817, 1818, 1823, 1828, 1832, 1837, 1838, 1842, 1844], "upcast": [1714, 1842], "upcom": [1786, 1788, 1801], "updat": [0, 1, 2, 84, 133, 143, 329, 457, 706, 726, 729, 744, 746, 747, 749, 759, 799, 845, 1001, 1199, 1206, 1208, 1215, 1229, 1231, 1328, 1329, 1330, 1331, 1332, 1333, 1405, 1419, 1499, 1704, 1711, 1714, 1715, 1724, 1730, 1733, 1734, 1735, 1737, 1739, 1740, 1742, 1743, 1746, 1747, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1828, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "update_dens": [143, 1817], "update_geometri": [106, 323, 1759, 1774, 1833], "update_orbit": 90, "upgrad": [2, 1771, 1817, 1828], "upgradehelp": 1827, "uphil": [603, 1206, 1704], "upload": 1788, "upon": [0, 2, 106, 188, 213, 295, 1226, 1367, 1704, 1738, 1742, 1743, 1755, 1759, 1766, 1771, 1773, 1783, 1784, 1786, 1788, 1796, 1802, 1831, 1832, 1835, 1838], "upper": [81, 100, 1226, 1344, 1704, 1801, 1802, 1838], "upper_bound": 1802, "uppercas": 1835, "upstream": [1, 106, 1737, 1738, 1746, 1749, 1754, 1759, 1762, 1765, 1773, 1775, 1782, 1783, 1784, 1785, 1786, 1788, 1803, 1839], "uremp": 1734, "urg": 1781, "url": 1788, "us": [0, 1, 2, 8, 11, 13, 14, 18, 62, 64, 83, 84, 87, 88, 92, 100, 103, 106, 110, 115, 128, 130, 132, 145, 148, 150, 153, 154, 155, 156, 157, 166, 192, 193, 195, 197, 199, 200, 203, 204, 205, 229, 235, 236, 243, 251, 265, 267, 271, 274, 279, 281, 284, 296, 297, 300, 301, 302, 303, 304, 312, 314, 318, 319, 322, 324, 325, 326, 327, 329, 331, 335, 342, 347, 350, 351, 352, 356, 366, 368, 369, 370, 375, 376, 377, 379, 389, 396, 397, 404, 407, 411, 414, 416, 427, 428, 430, 434, 438, 443, 446, 451, 457, 465, 467, 477, 479, 483, 484, 486, 488, 498, 510, 512, 513, 515, 519, 534, 535, 538, 543, 557, 561, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 580, 583, 584, 586, 590, 592, 593, 597, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 614, 615, 616, 617, 618, 619, 620, 622, 623, 624, 626, 627, 628, 632, 633, 634, 635, 636, 637, 638, 641, 643, 647, 648, 651, 652, 655, 656, 658, 660, 661, 664, 665, 666, 667, 669, 670, 672, 679, 681, 686, 688, 690, 691, 693, 694, 696, 697, 698, 702, 704, 705, 706, 707, 709, 711, 712, 726, 727, 732, 746, 750, 752, 757, 760, 762, 764, 765, 768, 770, 771, 775, 776, 778, 779, 780, 781, 786, 792, 801, 811, 812, 816, 819, 823, 827, 828, 830, 831, 833, 835, 837, 839, 860, 864, 865, 867, 870, 874, 875, 884, 886, 897, 906, 911, 912, 929, 930, 931, 935, 943, 946, 949, 956, 958, 961, 990, 993, 1000, 1004, 1055, 1061, 1070, 1076, 1083, 1084, 1085, 1088, 1095, 1096, 1099, 1100, 1101, 1102, 1105, 1106, 1107, 1120, 1125, 1126, 1129, 1132, 1146, 1147, 1150, 1154, 1157, 1166, 1167, 1170, 1173, 1175, 1179, 1180, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1206, 1208, 1209, 1210, 1211, 1212, 1213, 1215, 1218, 1219, 1220, 1221, 1222, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1235, 1238, 1240, 1244, 1266, 1281, 1290, 1299, 1300, 1304, 1314, 1333, 1337, 1339, 1352, 1356, 1371, 1376, 1392, 1398, 1411, 1428, 1429, 1430, 1431, 1432, 1435, 1436, 1441, 1456, 1458, 1459, 1461, 1470, 1471, 1475, 1481, 1485, 1500, 1501, 1510, 1520, 1546, 1549, 1555, 1556, 1557, 1564, 1568, 1570, 1572, 1575, 1588, 1589, 1609, 1610, 1611, 1613, 1615, 1619, 1623, 1637, 1643, 1655, 1656, 1672, 1681, 1688, 1704, 1708, 1711, 1714, 1723, 1725, 1726, 1727, 1730, 1736, 1737, 1740, 1742, 1743, 1746, 1747, 1750, 1752, 1753, 1755, 1756, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1804, 1805, 1806, 1807, 1809, 1812, 1813, 1814, 1818, 1819, 1823, 1829, 1832, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843], "usa": 1734, "usabl": 1843, "usag": [106, 195, 197, 283, 314, 333, 586, 664, 1097, 1206, 1220, 1704, 1748, 1750, 1754, 1767, 1775, 1790, 1791, 1832, 1837, 1838], "usapt": [1714, 1842], "use_batch": 1817, "use_df_int": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "use_dii": 1785, "use_libxc": 1757, "use_natur": 150, "use_shell_pair": [89, 1817], "use_spin_sym": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "use_spin_symmetri": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "useabl": 1738, "user": [0, 2, 8, 106, 208, 209, 210, 235, 236, 261, 267, 279, 281, 295, 304, 318, 319, 351, 359, 380, 457, 474, 644, 660, 823, 829, 881, 930, 949, 958, 964, 1065, 1097, 1124, 1125, 1199, 1200, 1206, 1210, 1213, 1214, 1219, 1220, 1221, 1224, 1225, 1226, 1229, 1231, 1232, 1235, 1266, 1290, 1312, 1521, 1666, 1688, 1704, 1714, 1726, 1736, 1737, 1738, 1740, 1742, 1748, 1750, 1751, 1753, 1755, 1759, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1774, 1775, 1777, 1780, 1781, 1782, 1785, 1786, 1788, 1790, 1791, 1794, 1795, 1798, 1799, 1800, 1801, 1803, 1808, 1809, 1810, 1815, 1816, 1817, 1821, 1823, 1824, 1827, 1828, 1829, 1831, 1832, 1833, 1834, 1836, 1837, 1838, 1840, 1842, 1843, 1844], "userprofil": 1748, "using_": 1785, "using_addon": 1785, "using_chemps2": 1785, "using_v2rdm_casscf": 1785, "uso": [1810, 1838], "usr": [1736, 1767, 1786, 1808, 1828], "usual": [0, 2, 84, 96, 284, 288, 289, 295, 300, 301, 302, 310, 318, 319, 329, 339, 340, 361, 367, 381, 382, 539, 575, 592, 599, 609, 616, 628, 658, 660, 662, 664, 726, 761, 774, 799, 835, 1203, 1206, 1208, 1209, 1210, 1231, 1620, 1704, 1730, 1735, 1738, 1740, 1742, 1743, 1752, 1753, 1754, 1755, 1757, 1760, 1766, 1772, 1776, 1785, 1786, 1794, 1796, 1798, 1800, 1801, 1802, 1806, 1808, 1810, 1817, 1823, 1826, 1828, 1829, 1832, 1833, 1835, 1837, 1838, 1843, 1844], "util": [2, 843, 1210, 1704, 1708, 1738, 1743, 1746, 1747, 1750, 1754, 1755, 1756, 1767, 1769, 1781, 1789, 1792, 1799, 1810, 1827, 1833, 1837, 1838], "utterli": 1783, "uus": 2, "v": [2, 76, 84, 100, 103, 147, 259, 295, 318, 319, 386, 1230, 1231, 1459, 1461, 1582, 1695, 1697, 1698, 1700, 1701, 1702, 1703, 1704, 1706, 1707, 1714, 1717, 1720, 1725, 1729, 1731, 1738, 1742, 1750, 1757, 1758, 1759, 1764, 1766, 1767, 1771, 1772, 1778, 1786, 1788, 1799, 1800, 1809, 1821, 1836, 1837, 1838, 1841, 1842], "v0": 1770, "v1": [96, 1017, 1018, 1019, 1020, 1147, 1216, 1221, 1230, 1231, 1445, 1548, 1704, 1736, 1737, 1738, 1740, 1748, 1757, 1759, 1770, 1774, 1783, 1786, 1787, 1798, 1814, 1828, 1837, 1838], "v182": 1788, "v2": 1783, "v2rdm1": 1729, "v2rdm2": 1729, "v2rdm3": 1729, "v2rdm4": 1729, "v2rdm5": 1729, "v2rdm6": 1729, "v2rdm7": 1729, "v2rdm_casscf": [400, 1738, 1748, 1777, 1780, 1785, 1842], "v_": [1757, 1771, 1836], "v_potenti": 84, "va": 84, "vacuum": 1706, "vagu": [329, 1804], "val": [61, 64, 88, 100, 138, 148, 150, 255, 277, 342, 356, 367, 1785], "val_ex_level": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "vale": 1722, "valeev": [1734, 1777, 1780, 1781, 1786], "valenc": [0, 295, 476, 625, 800, 1125, 1200, 1206, 1210, 1221, 1685, 1704, 1756, 1763, 1766, 1771, 1776, 1785, 1799, 1837], "valid": [2, 106, 114, 150, 219, 265, 267, 279, 284, 297, 314, 318, 319, 347, 377, 380, 715, 761, 774, 811, 874, 885, 1112, 1207, 1209, 1210, 1221, 1225, 1226, 1231, 1244, 1258, 1261, 1262, 1264, 1372, 1655, 1658, 1692, 1704, 1714, 1718, 1733, 1737, 1740, 1750, 1752, 1754, 1755, 1757, 1759, 1768, 1771, 1772, 1779, 1785, 1791, 1794, 1797, 1800, 1808, 1833, 1838, 1841, 1842, 1843, 1844], "valid_method": 111, "validate_dii": 84, "validate_opt": 114, "validationerror": [84, 150, 255, 297, 347, 374, 395, 1714, 1827, 1842], "valiron": 1794, "valu": [0, 1, 2, 5, 8, 62, 63, 64, 79, 82, 83, 84, 88, 96, 100, 103, 106, 110, 122, 126, 135, 138, 147, 148, 150, 195, 197, 200, 208, 209, 210, 235, 236, 244, 246, 248, 249, 254, 265, 267, 268, 272, 278, 285, 287, 295, 310, 316, 318, 319, 321, 322, 323, 325, 326, 327, 328, 335, 336, 338, 346, 359, 361, 370, 371, 374, 376, 377, 383, 389, 395, 397, 402, 403, 404, 407, 408, 409, 411, 415, 428, 430, 433, 434, 436, 437, 442, 443, 444, 445, 446, 449, 450, 454, 456, 465, 466, 467, 474, 475, 479, 482, 483, 484, 492, 496, 506, 507, 513, 514, 518, 519, 523, 539, 542, 543, 547, 551, 557, 568, 570, 571, 572, 573, 574, 575, 582, 584, 586, 589, 590, 592, 596, 599, 600, 606, 608, 609, 610, 613, 614, 615, 617, 619, 620, 622, 623, 624, 627, 632, 635, 636, 637, 638, 640, 641, 643, 644, 645, 647, 650, 652, 655, 656, 661, 662, 664, 665, 666, 667, 668, 669, 671, 673, 674, 676, 677, 681, 683, 684, 685, 689, 690, 691, 693, 696, 701, 702, 703, 704, 705, 707, 708, 709, 711, 712, 717, 719, 721, 725, 726, 727, 729, 730, 731, 732, 733, 736, 740, 746, 748, 750, 752, 758, 761, 764, 769, 773, 774, 787, 810, 811, 821, 830, 835, 837, 842, 843, 845, 851, 852, 858, 874, 880, 884, 889, 891, 892, 898, 899, 900, 905, 918, 923, 926, 927, 929, 930, 935, 936, 937, 938, 939, 944, 946, 947, 948, 949, 951, 958, 959, 960, 961, 963, 964, 965, 967, 968, 975, 989, 1000, 1001, 1011, 1013, 1015, 1018, 1047, 1048, 1049, 1053, 1070, 1075, 1076, 1088, 1096, 1098, 1101, 1106, 1107, 1110, 1119, 1120, 1125, 1129, 1131, 1146, 1147, 1153, 1158, 1163, 1166, 1167, 1168, 1187, 1195, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1234, 1240, 1241, 1242, 1248, 1249, 1256, 1266, 1279, 1281, 1282, 1284, 1290, 1291, 1292, 1293, 1296, 1297, 1313, 1324, 1329, 1331, 1332, 1338, 1339, 1341, 1342, 1346, 1352, 1354, 1357, 1358, 1359, 1360, 1366, 1368, 1375, 1376, 1383, 1384, 1394, 1398, 1399, 1402, 1403, 1405, 1417, 1429, 1437, 1438, 1443, 1445, 1446, 1453, 1454, 1455, 1469, 1470, 1472, 1475, 1479, 1484, 1485, 1487, 1497, 1499, 1500, 1501, 1502, 1505, 1507, 1509, 1518, 1520, 1521, 1522, 1523, 1525, 1527, 1528, 1534, 1537, 1555, 1556, 1563, 1569, 1589, 1599, 1601, 1609, 1615, 1616, 1617, 1620, 1621, 1626, 1628, 1629, 1630, 1631, 1633, 1634, 1644, 1649, 1658, 1664, 1665, 1667, 1695, 1698, 1699, 1703, 1704, 1706, 1713, 1714, 1715, 1724, 1726, 1730, 1733, 1738, 1739, 1740, 1742, 1743, 1746, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1762, 1766, 1767, 1768, 1770, 1771, 1772, 1774, 1775, 1776, 1777, 1781, 1785, 1788, 1789, 1792, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1808, 1809, 1810, 1817, 1823, 1828, 1829, 1833, 1835, 1836, 1837, 1838, 1841, 1842, 1843, 1844], "valuabl": 1785, "valuehi": 1740, "valuelo": 1740, "valuemd": 1740, "vamp": 1804, "van": [106, 1759, 1781, 1832, 1837], "var": 1788, "varepsilon": [377, 709, 711, 712, 1206, 1704], "vari": [267, 1753, 1757, 1759, 1776, 1828, 1838, 1844], "variabl": [0, 1, 2, 11, 106, 111, 150, 151, 152, 192, 193, 203, 204, 238, 239, 255, 268, 284, 295, 318, 319, 346, 352, 399, 635, 661, 1206, 1224, 1225, 1240, 1283, 1294, 1704, 1711, 1714, 1730, 1736, 1738, 1740, 1742, 1743, 1746, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1762, 1763, 1764, 1765, 1766, 1768, 1770, 1771, 1773, 1774, 1775, 1777, 1780, 1782, 1783, 1784, 1785, 1788, 1789, 1790, 1792, 1798, 1799, 1800, 1803, 1809, 1810, 1821, 1823, 1828, 1829, 1833, 1834, 1835, 1837, 1838, 1839, 1841, 1842, 1843, 1844], "variable_valu": 1823, "variables_": 1764, "variant": [0, 267, 295, 694, 1206, 1692, 1704, 1714, 1738, 1752, 1757, 1766, 1770, 1771, 1776, 1781, 1792, 1798, 1837, 1838, 1842], "variat": [2, 801, 1210, 1704, 1753, 1771, 1798, 1807, 1833, 1838], "variation": [739, 1208, 1704, 1753, 1755, 1763, 1789], "varieti": [2, 1711, 1714, 1737, 1743, 1757, 1767, 1781, 1840, 1842], "variou": [381, 382, 605, 669, 680, 1206, 1210, 1673, 1704, 1708, 1711, 1714, 1715, 1716, 1726, 1738, 1742, 1755, 1757, 1770, 1771, 1781, 1789, 1797, 1798, 1802, 1817, 1823, 1826, 1828, 1829, 1842, 1844], "varnam": 1764, "vast": 1808, "vaughn": 1829, "vb": 84, "vbase": [84, 1827], "vcc": [586, 1206, 1704, 1743], "vdot": [12, 1838], "vdw": [295, 1684, 1759, 1766, 1776, 1798], "vdz": [1714, 1842], "vdzp": [1694, 1707, 1731, 1732, 1774], "ve": [2, 1737, 1738, 1748, 1757, 1770, 1785, 1828, 1838, 1844], "vec": [1757, 1797, 1838], "vecs_cc3": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "vecs_per_root": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "vector": [0, 1, 2, 6, 9, 13, 16, 19, 22, 23, 24, 25, 31, 32, 34, 35, 37, 39, 43, 44, 45, 46, 47, 49, 50, 51, 54, 55, 56, 58, 60, 70, 73, 76, 80, 84, 85, 88, 100, 103, 104, 106, 110, 114, 115, 119, 128, 137, 138, 149, 150, 277, 321, 329, 331, 335, 342, 356, 404, 407, 410, 457, 470, 474, 491, 496, 500, 502, 504, 505, 575, 583, 594, 595, 607, 641, 644, 647, 679, 681, 734, 735, 736, 747, 751, 752, 757, 802, 803, 808, 811, 814, 815, 823, 829, 830, 835, 836, 837, 839, 842, 845, 847, 863, 867, 870, 874, 876, 881, 883, 884, 889, 911, 912, 931, 949, 1077, 1176, 1197, 1199, 1200, 1206, 1208, 1213, 1219, 1222, 1225, 1226, 1229, 1230, 1231, 1250, 1251, 1285, 1361, 1408, 1409, 1456, 1458, 1547, 1548, 1550, 1640, 1654, 1704, 1708, 1714, 1740, 1742, 1753, 1755, 1771, 1782, 1785, 1797, 1798, 1810, 1817, 1821, 1827, 1838, 1839, 1841, 1842], "vector3": [8, 106, 1827], "vector_axpi": 329, "vector_copi": 329, "vector_dot": [100, 148, 329], "vector_multipli": 12, "vector_scal": 329, "vel": [1668, 1669, 1690, 1776], "veloc": [402, 539, 677, 1197, 1203, 1206, 1231, 1657, 1704, 1706, 1742, 1776, 1841], "ventur": 1786, "ver": 1738, "verbos": [2, 106, 342, 346, 356, 376, 383, 397, 701, 1206, 1231, 1653, 1704, 1738, 1740, 1759, 1767, 1768, 1774, 1794, 1817, 1821, 1841], "verdet": [669, 1206, 1704], "vergil": [1748, 1788], "veri": [2, 342, 510, 575, 635, 641, 652, 833, 842, 882, 1153, 1201, 1206, 1210, 1221, 1231, 1629, 1704, 1714, 1738, 1742, 1748, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1763, 1764, 1767, 1770, 1771, 1781, 1788, 1797, 1798, 1804, 1817, 1824, 1828, 1832, 1833, 1835, 1837, 1838, 1841, 1842, 1844], "verifi": [1714, 1718, 1738, 1747, 1838, 1842], "verma": [1734, 1781, 1786, 1836], "versa": [1736, 1767], "versatil": 1781, "version": [96, 100, 138, 150, 192, 193, 203, 204, 206, 253, 279, 291, 295, 296, 303, 314, 341, 372, 375, 396, 701, 704, 706, 765, 906, 1206, 1209, 1212, 1704, 1714, 1715, 1730, 1733, 1735, 1736, 1737, 1743, 1748, 1750, 1754, 1755, 1757, 1759, 1762, 1764, 1766, 1767, 1769, 1771, 1775, 1777, 1781, 1785, 1787, 1788, 1791, 1792, 1798, 1802, 1804, 1808, 1809, 1810, 1817, 1819, 1824, 1828, 1829, 1836, 1837, 1842], "version_formatt": 1786, "versionlong": 1786, "verstraelen": [1734, 1799], "versu": 1757, "vert": [641, 708, 1206, 1704], "vert_": 1740, "vertic": [1714, 1803, 1842], "vi": [1736, 1767, 1786, 1788, 1814], "via": [0, 2, 76, 106, 267, 335, 577, 651, 655, 665, 677, 685, 1206, 1225, 1226, 1296, 1313, 1704, 1714, 1738, 1748, 1750, 1755, 1756, 1757, 1759, 1763, 1767, 1768, 1772, 1774, 1781, 1789, 1798, 1801, 1802, 1810, 1817, 1828, 1829, 1833, 1838, 1842, 1844], "vib": [2, 150, 383, 384, 385, 386, 387, 388, 389, 390, 1831, 1843], "vibinfo": [384, 386, 388, 389, 390, 399], "vibonli": 386, "vibrat": [2, 150, 300, 301, 302, 383, 384, 386, 388, 389, 390, 399, 574, 616, 619, 679, 701, 707, 1206, 1217, 1226, 1704, 1714, 1761, 1769, 1776, 1777, 1778, 1781, 1790, 1798, 1801, 1831, 1833, 1840, 1842], "vibrec": 399, "vibrot": [570, 573, 574, 1206, 1704], "vice": [1736, 1767], "video": 1770, "view": [12, 100, 148, 1735, 1764, 1770, 1771, 1780, 1782, 1788], "viewpoint": [0, 1804], "vim": 1786, "vimrc": 1738, "vint": 1817, "violat": 1798, "vir": [13, 98, 150, 1742, 1755, 1771, 1829], "virial": [1669, 1690, 1776], "virtual": [0, 11, 84, 95, 140, 150, 430, 433, 466, 507, 514, 589, 601, 626, 627, 664, 671, 727, 860, 1065, 1083, 1084, 1085, 1149, 1172, 1199, 1200, 1201, 1202, 1206, 1208, 1210, 1219, 1221, 1222, 1225, 1230, 1242, 1259, 1460, 1462, 1704, 1714, 1742, 1750, 1753, 1756, 1763, 1771, 1781, 1789, 1808, 1810, 1819, 1829, 1837, 1838, 1841, 1842], "virut": [875, 1210, 1704], "visibl": [1828, 1838, 1844], "visscher": 1734, "visual": [323, 1226, 1356, 1704, 1777, 1790, 1791, 1810, 1828, 1831, 1833, 1840, 1844], "vital": [2, 170, 1738], "viz": [1832, 1833], "vmd": [1777, 1831], "vmd_cube": 1750, "vmdpath": 1750, "vmfc": [1714, 1794, 1842], "vmfc_energy_body_dict": 1794, "vmfc_gradient_body_dict": 1794, "vmfc_hessian_body_dict": 1794, "vmol": [643, 1206, 1704], "vod": [1734, 1798], "void": 1810, "vol": [1225, 1256, 1271, 1704, 1734, 1781], "volt": 1706, "volum": [352, 376, 397, 1685, 1706, 1734, 1740, 1776, 1799], "volumetr": 2, "von": 1706, "von_klitzing_const": 1706, "voxel": 2, "vpt2": [570, 573, 574, 1206, 1704], "vsxc": [295, 318, 319, 1695, 1698, 1702, 1703, 1758, 1766, 1800], "vt": 1781, "vv": [411, 430, 513, 557, 727, 1198, 1199, 1202, 1204, 1208, 1704, 1738, 1753, 1801], "vv10": [138, 295, 318, 319, 1231, 1539, 1540, 1541, 1542, 1543, 1544, 1690, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1710, 1714, 1757, 1758, 1759, 1760, 1766, 1776, 1800, 1841, 1842], "vv10_b": 138, "vv10_c": 138, "vval": [111, 1799], "vvvv": [1225, 1296, 1704, 1798], "vw": 1837, "vwn": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "vwn5": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "w": [9, 103, 307, 356, 374, 386, 389, 395, 463, 503, 1199, 1200, 1704, 1706, 1707, 1714, 1731, 1734, 1748, 1757, 1759, 1772, 1781, 1782, 1788, 1794, 1798, 1815, 1836, 1837, 1842], "w_": 1798, "w_a": 1837, "w_b": 1837, "w_k": 329, "wa": [0, 18, 66, 81, 100, 148, 268, 277, 342, 356, 827, 1210, 1230, 1469, 1470, 1704, 1730, 1738, 1743, 1750, 1755, 1757, 1759, 1767, 1770, 1771, 1781, 1782, 1799, 1801, 1802, 1808, 1809, 1817, 1824, 1828, 1832, 1833, 1837, 1838, 1841, 1844], "waal": [106, 1759, 1781, 1832, 1837], "wabei": [510, 1201, 1704], "wabei_lowdisk": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "wai": [2, 247, 284, 568, 603, 616, 660, 672, 1124, 1206, 1221, 1232, 1666, 1704, 1714, 1730, 1735, 1738, 1740, 1743, 1747, 1752, 1753, 1755, 1757, 1767, 1770, 1777, 1781, 1782, 1786, 1795, 1797, 1798, 1799, 1801, 1802, 1803, 1810, 1817, 1819, 1822, 1828, 1832, 1833, 1836, 1837, 1838, 1842, 1843, 1844], "wait": [2, 1748, 1788], "waldrop": [1734, 1781, 1837], "wall": 1838, "wallac": 1836, "wang": [1734, 1753, 1781, 1786, 1802], "want": [0, 1, 2, 609, 1206, 1704, 1737, 1738, 1746, 1747, 1748, 1749, 1754, 1756, 1759, 1762, 1765, 1767, 1773, 1774, 1775, 1781, 1782, 1783, 1784, 1786, 1788, 1792, 1801, 1803, 1804, 1807, 1817, 1821, 1828, 1829, 1833, 1836, 1837, 1838, 1839, 1844], "warn": [0, 2, 150, 192, 193, 203, 204, 296, 314, 679, 833, 888, 1206, 1210, 1704, 1738, 1764, 1767, 1768, 1769, 1786, 1788, 1791, 1804, 1808, 1810, 1828], "washington": 1734, "watch": 1788, "water": [2, 574, 660, 1206, 1692, 1704, 1710, 1711, 1712, 1714, 1715, 1719, 1722, 1728, 1750, 1752, 1754, 1757, 1759, 1763, 1782, 1789, 1792, 1802, 1803, 1828, 1832, 1833, 1837, 1838, 1842, 1844], "water_dim": 1837, "wave": [352, 488, 586, 678, 1200, 1206, 1704, 1730, 1771, 1798, 1829, 1836], "wavefunct": [0, 1, 2, 11, 13, 14, 26, 61, 74, 76, 84, 104, 128, 130, 145, 161, 163, 164, 165, 166, 167, 173, 177, 178, 179, 180, 181, 185, 186, 190, 215, 216, 217, 218, 222, 232, 237, 265, 267, 270, 276, 277, 291, 295, 296, 297, 300, 301, 302, 303, 306, 307, 314, 317, 318, 319, 341, 347, 352, 365, 394, 399, 409, 421, 423, 455, 456, 464, 475, 492, 506, 508, 511, 529, 533, 552, 553, 556, 560, 563, 565, 567, 640, 681, 748, 863, 880, 891, 962, 993, 997, 1127, 1128, 1164, 1165, 1169, 1187, 1194, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1208, 1210, 1211, 1212, 1213, 1214, 1215, 1221, 1222, 1225, 1229, 1230, 1297, 1402, 1433, 1442, 1575, 1584, 1599, 1649, 1664, 1674, 1676, 1704, 1734, 1740, 1742, 1743, 1746, 1749, 1750, 1753, 1754, 1755, 1756, 1757, 1766, 1769, 1775, 1777, 1781, 1785, 1789, 1791, 1794, 1798, 1799, 1800, 1803, 1808, 1809, 1823, 1827, 1828, 1829, 1832, 1837, 1838, 1841, 1843, 1844], "wavefunctionprotocolenum": [265, 1740, 1794], "wavel": [1714, 1842], "wavelength": [324, 377, 1706, 1776], "wb": 1706, "wb88": 1757, "wb97": [295, 1695, 1698, 1701, 1714, 1757, 1758, 1766, 1842], "wb97m": [295, 1695, 1697, 1698, 1700, 1701, 1702, 1758, 1766], "wb97x": [295, 1695, 1697, 1698, 1700, 1701, 1710, 1714, 1739, 1757, 1758, 1759, 1766, 1774, 1781, 1842], "wb97x3c": [295, 1695, 1698, 1700, 1701, 1758, 1766], "wb97x_03": [1714, 1842], "wb97x_20": [1714, 1842], "wcm": [1734, 1781], "wcombin": [0, 1, 2, 92, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "wdin": [1734, 1776, 1781, 1799], "we": [2, 84, 247, 277, 324, 352, 356, 368, 369, 804, 948, 1210, 1213, 1225, 1231, 1248, 1554, 1555, 1647, 1655, 1704, 1730, 1738, 1740, 1743, 1747, 1753, 1755, 1756, 1757, 1761, 1764, 1767, 1770, 1771, 1781, 1782, 1785, 1786, 1788, 1789, 1795, 1797, 1798, 1801, 1802, 1809, 1810, 1813, 1817, 1821, 1822, 1823, 1824, 1825, 1828, 1829, 1832, 1833, 1837, 1838, 1841, 1844], "weak": [446, 484, 523, 547, 1199, 1200, 1202, 1203, 1704, 1706, 1757], "weak_mixing_angl": 1706, "weakli": [1692, 1752], "webbook": 1837, "webmo": [1768, 1791], "webserv": 1788, "websit": [1206, 1759, 1764, 1788], "weigend": [1734, 1838], "weight": [2, 92, 95, 140, 147, 307, 386, 389, 399, 618, 707, 738, 784, 1137, 1206, 1208, 1210, 1221, 1231, 1545, 1630, 1704, 1714, 1740, 1743, 1752, 1757, 1761, 1772, 1776, 1842], "weird": [1714, 1757, 1810, 1842], "welcom": [1777, 1785, 1818], "well": [0, 1, 84, 390, 575, 640, 662, 747, 835, 1206, 1208, 1210, 1704, 1714, 1738, 1743, 1748, 1752, 1754, 1756, 1759, 1764, 1770, 1771, 1781, 1785, 1798, 1799, 1802, 1805, 1817, 1828, 1833, 1837, 1838, 1842, 1844], "weller": 1734, "wennmoh": [1734, 1771], "were": [0, 150, 277, 314, 329, 342, 356, 1714, 1753, 1757, 1770, 1791, 1802, 1809, 1817, 1824, 1828, 1832, 1833, 1837, 1838, 1842, 1844], "werner": [443, 444, 479, 482, 519, 521, 543, 545, 1199, 1200, 1202, 1203, 1704], "wex": 1761, "wfn": [0, 1, 2, 11, 84, 145, 150, 267, 270, 276, 277, 284, 291, 295, 296, 297, 300, 301, 302, 303, 306, 307, 314, 317, 318, 319, 341, 347, 352, 365, 398, 399, 861, 1704, 1714, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "wfn_data": 150, "wfn_dict": 1767, "wfn_dimer": 1837, "wfn_from_dict": 1767, "wfn_from_fil": 1767, "wfn_lo": [284, 1740], "wfn_mona": 1837, "wfn_monb": 1837, "wfn_sym": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "wfn_type": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "what": [8, 277, 296, 329, 609, 616, 643, 656, 664, 672, 698, 708, 719, 732, 804, 893, 894, 1124, 1166, 1206, 1207, 1208, 1210, 1211, 1221, 1231, 1563, 1612, 1704, 1736, 1739, 1743, 1755, 1759, 1767, 1769, 1771, 1785, 1787, 1788, 1789, 1794, 1798, 1808, 1812, 1814, 1817, 1821, 1823, 1828, 1829, 1831, 1832, 1835, 1837, 1844], "whatev": [329, 1748, 1809, 1821], "whatsnew": 1828, "when": [2, 8, 100, 106, 148, 150, 170, 235, 236, 268, 269, 272, 277, 278, 283, 284, 295, 297, 300, 301, 302, 306, 307, 312, 318, 319, 328, 329, 333, 335, 342, 346, 347, 356, 357, 370, 374, 377, 393, 395, 470, 471, 570, 575, 577, 582, 586, 594, 623, 632, 635, 650, 651, 652, 661, 672, 682, 684, 691, 694, 808, 823, 837, 842, 884, 1001, 1041, 1079, 1086, 1125, 1132, 1158, 1167, 1200, 1206, 1210, 1215, 1218, 1219, 1221, 1224, 1226, 1231, 1240, 1303, 1339, 1341, 1500, 1507, 1555, 1556, 1575, 1648, 1655, 1656, 1704, 1726, 1730, 1736, 1740, 1743, 1750, 1753, 1754, 1755, 1759, 1762, 1763, 1764, 1766, 1767, 1768, 1770, 1772, 1774, 1776, 1777, 1779, 1780, 1782, 1785, 1786, 1788, 1792, 1794, 1797, 1800, 1801, 1802, 1808, 1809, 1810, 1817, 1821, 1824, 1828, 1832, 1833, 1836, 1837, 1838, 1840, 1841], "whenev": [935, 1198, 1201, 1202, 1213, 1223, 1704, 1743, 1748, 1782, 1809, 1837, 1838], "where": [0, 81, 100, 110, 148, 150, 279, 303, 308, 314, 318, 319, 329, 356, 371, 376, 380, 385, 397, 569, 574, 575, 582, 593, 621, 632, 635, 638, 645, 652, 660, 685, 708, 729, 811, 855, 861, 1047, 1100, 1181, 1206, 1208, 1210, 1217, 1218, 1220, 1222, 1229, 1405, 1704, 1711, 1714, 1730, 1735, 1738, 1742, 1743, 1746, 1748, 1749, 1750, 1753, 1755, 1756, 1757, 1759, 1761, 1762, 1763, 1764, 1765, 1767, 1768, 1770, 1771, 1773, 1774, 1775, 1776, 1777, 1779, 1781, 1782, 1783, 1784, 1785, 1786, 1789, 1791, 1795, 1796, 1797, 1798, 1800, 1802, 1803, 1804, 1809, 1810, 1815, 1817, 1818, 1824, 1828, 1829, 1833, 1835, 1837, 1838, 1839, 1841, 1842, 1844], "wherea": [318, 319, 1740, 1800, 1801, 1837, 1838], "wherein": [1756, 1794], "whereupon": 1738, "wherev": [1750, 1757, 1837], "whether": [1, 2, 8, 84, 106, 138, 150, 208, 209, 210, 212, 219, 220, 235, 236, 265, 267, 286, 288, 289, 298, 300, 301, 302, 314, 318, 319, 337, 339, 340, 348, 388, 389, 393, 470, 571, 573, 579, 596, 597, 598, 599, 600, 602, 605, 608, 610, 617, 625, 626, 636, 642, 658, 669, 674, 675, 678, 682, 683, 688, 691, 692, 695, 699, 701, 702, 703, 706, 707, 727, 731, 742, 745, 749, 758, 819, 989, 990, 991, 994, 996, 999, 1004, 1010, 1098, 1105, 1200, 1206, 1208, 1210, 1215, 1220, 1221, 1226, 1229, 1230, 1231, 1335, 1432, 1453, 1649, 1704, 1711, 1714, 1730, 1735, 1738, 1740, 1743, 1746, 1749, 1752, 1754, 1757, 1759, 1762, 1765, 1768, 1772, 1775, 1782, 1791, 1794, 1800, 1801, 1802, 1803, 1804, 1817, 1837, 1838, 1839, 1842], "which": [0, 2, 8, 13, 98, 100, 103, 106, 112, 148, 150, 241, 242, 266, 267, 268, 270, 276, 277, 279, 284, 285, 286, 287, 291, 296, 297, 299, 300, 301, 302, 303, 314, 317, 318, 319, 321, 327, 329, 330, 336, 337, 338, 341, 344, 347, 349, 355, 365, 374, 377, 381, 382, 383, 386, 387, 389, 395, 399, 415, 433, 434, 448, 466, 476, 490, 496, 507, 514, 539, 568, 570, 572, 574, 575, 580, 586, 589, 592, 601, 603, 608, 609, 614, 615, 616, 621, 627, 632, 634, 637, 639, 640, 650, 660, 662, 664, 665, 667, 669, 671, 679, 680, 681, 687, 692, 696, 697, 715, 729, 736, 740, 752, 761, 765, 774, 777, 794, 811, 816, 823, 832, 833, 835, 842, 874, 905, 964, 992, 1000, 1053, 1070, 1099, 1108, 1109, 1111, 1156, 1180, 1181, 1188, 1198, 1199, 1200, 1201, 1202, 1203, 1206, 1207, 1208, 1209, 1210, 1212, 1214, 1215, 1218, 1219, 1220, 1221, 1222, 1224, 1225, 1226, 1228, 1229, 1230, 1231, 1234, 1242, 1323, 1379, 1380, 1405, 1412, 1426, 1455, 1462, 1475, 1498, 1499, 1521, 1567, 1568, 1569, 1571, 1584, 1616, 1617, 1657, 1658, 1704, 1714, 1730, 1735, 1738, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1763, 1764, 1767, 1768, 1769, 1770, 1771, 1772, 1774, 1775, 1776, 1781, 1782, 1785, 1788, 1789, 1791, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1806, 1808, 1809, 1810, 1817, 1823, 1824, 1826, 1828, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1841, 1842, 1844], "whichev": [1759, 1774, 1788], "while": [2, 279, 300, 301, 302, 318, 319, 321, 433, 466, 507, 514, 575, 584, 589, 592, 596, 601, 615, 617, 623, 627, 640, 647, 655, 671, 673, 677, 679, 702, 704, 708, 738, 882, 1199, 1200, 1201, 1202, 1206, 1208, 1210, 1225, 1231, 1242, 1532, 1704, 1714, 1730, 1739, 1742, 1743, 1750, 1752, 1753, 1754, 1756, 1757, 1759, 1764, 1767, 1770, 1772, 1774, 1776, 1779, 1781, 1782, 1786, 1788, 1795, 1798, 1799, 1800, 1802, 1803, 1808, 1809, 1817, 1824, 1828, 1829, 1832, 1833, 1834, 1836, 1837, 1838, 1842, 1844], "white": [601, 609, 660, 1206, 1704, 1734, 1750], "whitespac": 1743, "who": [2, 1743, 1748, 1786, 1804, 1817], "whole": [2, 8, 1048, 1218, 1704, 1748, 1770, 1781, 1788, 1802, 1808], "wholli": 1838, "whose": [5, 1101, 1220, 1226, 1362, 1704, 1752, 1757, 1768, 1770, 1771, 1775, 1776, 1794, 1817, 1823, 1828, 1833, 1835, 1841, 1844], "why": [324, 1736, 1767, 1781, 1788, 1817], "wi7": [1692, 1752], "wiberg": [1685, 1776, 1799], "wiberg_lowdin_indic": [111, 1799], "wide": [1, 1730, 1738, 1747, 1757, 1781, 1838, 1844], "widehat": 1798, "widetild": 1798, "width": [106, 282, 313, 322, 323, 325, 332, 364, 377, 1685, 1750, 1776, 1799], "wien": 1706, "wien_frequency_displacement_law_const": 1706, "wien_wavelength_displacement_law_const": 1706, "wigner": [864, 1210, 1704, 1755], "wiki": [1817, 1821], "wikipedia": 1821, "wild": [2, 285, 296, 336, 901, 1212, 1704, 1769], "wilei": 1734, "wilk": 1781, "william": [1734, 1838], "willing": [1737, 1816], "wilson": 1740, "win": 1788, "wind": 1844, "window": [153, 1737, 1738, 1746, 1748, 1749, 1759, 1762, 1767, 1773, 1774, 1775, 1781, 1782, 1783, 1784, 1788, 1803, 1806, 1807, 1808, 1839], "windowswsl": 1788, "windu": 1734, "winnow": 2, "wipe": [86, 111], "wire": [1734, 1781, 1828, 1837, 1844], "wise": [2, 1738], "wish": [1748, 1770, 1771, 1781, 1786, 1789, 1829, 1844], "within": [2, 11, 90, 106, 299, 304, 349, 383, 419, 489, 527, 622, 662, 671, 695, 728, 761, 774, 832, 887, 1043, 1046, 1052, 1198, 1200, 1202, 1206, 1208, 1209, 1210, 1218, 1231, 1607, 1704, 1730, 1735, 1736, 1742, 1743, 1754, 1755, 1757, 1759, 1764, 1767, 1770, 1776, 1781, 1782, 1786, 1788, 1789, 1801, 1802, 1810, 1817, 1824, 1829, 1832, 1833, 1838], "without": [0, 1, 2, 76, 106, 150, 267, 307, 318, 319, 342, 344, 356, 374, 383, 395, 614, 616, 625, 664, 665, 674, 1206, 1231, 1554, 1692, 1704, 1714, 1736, 1742, 1743, 1746, 1748, 1749, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1762, 1765, 1767, 1769, 1771, 1772, 1773, 1775, 1776, 1781, 1782, 1783, 1784, 1785, 1787, 1790, 1794, 1798, 1800, 1802, 1803, 1809, 1810, 1814, 1828, 1838, 1839, 1842, 1844], "wizardri": 1737, "wk": [92, 1708], "wmr": [628, 1206, 1704], "woith": 1754, "wolf": [1777, 1780, 1836], "wolfsberg": 1838, "won": [279, 1070, 1088, 1219, 1704, 1748, 1759, 1764, 1767, 1771, 1786, 1788, 1808, 1821, 1835], "word": [284, 620, 651, 1206, 1704, 1730, 1740, 1741, 1785, 1798, 1838], "work": [0, 2, 8, 13, 106, 153, 284, 285, 314, 323, 336, 573, 605, 657, 666, 697, 786, 835, 881, 882, 1206, 1210, 1224, 1229, 1231, 1236, 1629, 1688, 1704, 1714, 1730, 1735, 1737, 1738, 1740, 1743, 1747, 1748, 1755, 1756, 1757, 1759, 1763, 1764, 1767, 1774, 1781, 1785, 1786, 1788, 1791, 1797, 1799, 1802, 1803, 1808, 1810, 1813, 1817, 1821, 1824, 1828, 1829, 1837, 1838, 1842, 1844], "workaround": 1837, "worker": [444, 482, 521, 545, 1199, 1200, 1202, 1203, 1704, 1829], "workflow": [1736, 1738, 1767, 1788, 1819, 1824], "workhors": 1757, "workhorsi": 1738, "working_branch": 1737, "workload": 1824, "workshop": 1804, "workstat": [575, 1206, 1704], "world": [1708, 1757, 1825], "wormit": 1734, "worri": [2, 1753, 1757, 1764, 1809], "wors": 1838, "worst": 106, "worth": [0, 1736, 1767], "worthwhil": [786, 1210, 1704, 1738], "would": [296, 376, 397, 601, 628, 660, 799, 855, 881, 1095, 1126, 1206, 1210, 1219, 1221, 1704, 1735, 1738, 1743, 1749, 1754, 1755, 1757, 1769, 1771, 1781, 1785, 1789, 1803, 1817, 1824, 1828, 1829, 1832, 1833, 1837, 1838, 1844], "wouter": [1215, 1677, 1777, 1780, 1781], "wouthuysen": [1734, 1836], "wow": 1810, "wp": [1734, 1841], "wpbe": [295, 1695, 1697, 1698, 1701, 1757, 1758, 1766], "wpbe0": [295, 1695, 1698, 1700, 1701, 1758, 1766], "wpbeh": [295, 1695, 1698, 1700, 1701, 1758, 1766], "wpbesol": 1757, "wrap": [106, 1743, 1759, 1796, 1810, 1832], "wrapper": [21, 84, 106, 1714, 1735, 1740, 1743, 1752, 1771, 1772, 1777, 1794, 1800, 1812, 1840, 1842], "wrapper_autofrag": 1768, "wrapper_databas": [1752, 1832], "writabl": [1738, 1748, 1767], "write": [12, 62, 74, 86, 87, 99, 100, 104, 148, 150, 187, 205, 295, 296, 314, 399, 424, 828, 867, 934, 1025, 1026, 1027, 1109, 1145, 1198, 1210, 1213, 1217, 1221, 1225, 1226, 1231, 1270, 1372, 1373, 1374, 1560, 1578, 1704, 1714, 1743, 1750, 1753, 1755, 1764, 1766, 1767, 1768, 1769, 1772, 1785, 1786, 1791, 1804, 1823, 1824, 1828, 1833, 1838, 1842, 1844], "write_molden": 150, "write_nbo": 150, "write_no": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "write_opt_histori": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "write_opt_result": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "write_orbit": [295, 1766, 1838], "write_scratch_fil": 87, "write_trajectori": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "writer": [296, 1769], "writer_file_label": [0, 1, 2, 303, 934, 1025, 1026, 1027, 1213, 1217, 1231, 1578, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "written": [0, 106, 208, 209, 210, 314, 586, 614, 639, 642, 643, 679, 828, 836, 1170, 1206, 1210, 1221, 1224, 1226, 1228, 1353, 1393, 1683, 1704, 1738, 1742, 1743, 1749, 1755, 1757, 1764, 1767, 1769, 1770, 1772, 1781, 1791, 1798, 1799, 1801, 1808, 1809, 1817, 1823, 1824, 1833, 1837], "wrong": [388, 1767, 1770, 1822, 1837, 1838], "wrt": 1752, "wsl": [1737, 1748], "wt": [1740, 1743, 1752], "wu": [1734, 1759], "www": [106, 388, 1737, 1738, 1743, 1750, 1759, 1774, 1781, 1788, 1792, 1839], "www3": [2, 287, 338, 1791], "x": [0, 5, 8, 9, 73, 84, 100, 106, 111, 133, 134, 138, 139, 147, 148, 150, 275, 295, 318, 319, 329, 335, 346, 356, 377, 386, 388, 389, 601, 685, 709, 1099, 1206, 1220, 1226, 1231, 1319, 1586, 1695, 1697, 1698, 1700, 1702, 1703, 1704, 1706, 1713, 1714, 1730, 1733, 1734, 1738, 1740, 1743, 1748, 1750, 1757, 1758, 1766, 1768, 1772, 1775, 1776, 1781, 1786, 1788, 1795, 1799, 1800, 1804, 1810, 1817, 1828, 1833, 1836, 1838, 1841, 1842, 1844], "x00": 1786, "x1": [94, 1799, 1821], "x1b95": [295, 318, 319, 1695, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "x2": [94, 536, 1203, 1704, 1799, 1821], "x2c": [677, 1103, 1163, 1206, 1221, 1704, 1714, 1730, 1762, 1781, 1836, 1842], "x2c1": [1714, 1842], "x2c1e": [677, 1206, 1704], "x2c2": [1714, 1842], "x2c3": [1714, 1842], "x3": [94, 1821], "x3lyp": [295, 318, 319, 1695, 1697, 1698, 1700, 1703, 1758, 1766, 1800], "x4": 94, "x5": [614, 1206, 1704], "x7f": 1786, "x86_64": [1738, 1748], "x_": [0, 329], "x_0": [322, 324, 325], "x_1": 1838, "x_2": 1838, "x_alpha": 138, "x_beta": 138, "x_d": 0, "x_function": [138, 1757], "x_hf": 1757, "x_hybrid": [1695, 1696, 1697, 1699, 1700, 1701, 1702, 1758], "x_lrc": [1695, 1696, 1697, 1699, 1700, 1701, 1702, 1758], "x_method_nam": 1757, "x_n": 1838, "x_omega": 138, "x_vec": 84, "xa": 0, "xarg": 1788, "xb1k": [295, 318, 319, 1695, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "xc": [138, 295, 318, 319, 1230, 1468, 1690, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1714, 1757, 1758, 1759, 1766, 1776, 1784, 1800, 1837, 1842], "xc_build": 138, "xc_function": 1757, "xc_gga_x_lb": [1231, 1526, 1704], "xc_lda_c_vwn": [1231, 1524, 1704], "xc_method_nam": 1757, "xcfour": [570, 1206, 1704, 1743], "xclib_descript": [96, 138], "xcode": [1738, 1748, 1808], "xdist": [2, 1738, 1767], "xe": [1707, 1714, 1731, 1842], "xecc": [586, 699, 1206, 1704], "xfail": 1738, "xi": [0, 1, 2, 1704, 1708, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "xi_connect": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "xiao": 1753, "xie": [1230, 1469, 1704, 1734, 1781, 1837], "xjoda": [616, 643, 644, 1206, 1704], "xlyp": [295, 318, 319, 1695, 1697, 1698, 1699, 1703, 1758, 1766, 1800], "xn": [1734, 1799, 1841], "xnm": [1669, 1776], "xpass": 1738, "xsymcor": [616, 1206, 1704], "xtp0": [386, 1772], "xtpl": [295, 318, 319, 1714, 1740, 1766, 1800, 1842], "xtpl_highest_1": [284, 1740], "xtpl_type": 1740, "xvcc": [586, 641, 1206, 1704], "xvdint": [668, 1206, 1704], "xvee": [641, 1206, 1704], "xvmol": [660, 1206, 1704], "xvtran": [708, 1206, 1704], "xxx": [1714, 1730, 1842], "xy": [139, 1226, 1319, 1704, 1833], "xyz": [106, 134, 350, 1226, 1319, 1356, 1704, 1752, 1802, 1833, 1835], "xyz2int": [592, 1206, 1704], "xyzabc": 1782, "xyzint": [592, 1206, 1704], "xz": [139, 1733, 1833], "y": [8, 9, 73, 106, 111, 134, 139, 147, 150, 275, 329, 356, 377, 388, 601, 711, 1099, 1206, 1220, 1230, 1231, 1469, 1586, 1695, 1696, 1697, 1699, 1700, 1701, 1702, 1704, 1707, 1731, 1734, 1742, 1748, 1750, 1753, 1758, 1775, 1779, 1781, 1788, 1799, 1802, 1809, 1810, 1817, 1828, 1833, 1837, 1838, 1841, 1844], "y1": 1799, "y2": 1799, "yamaguchi": [1734, 1781], "yaml": [1738, 1747, 1764, 1788], "yang": [1734, 1759], "yapf": [1777, 1814, 1822], "ye": [0, 318, 319, 1738, 1748, 1795, 1796, 1800, 1804, 1808], "year": [2, 1757, 1787], "yellow": [1738, 1748, 1750], "yet": [284, 351, 370, 381, 382, 616, 1206, 1226, 1231, 1352, 1626, 1704, 1735, 1736, 1737, 1738, 1740, 1743, 1748, 1752, 1753, 1755, 1767, 1779, 1781, 1810, 1817, 1826, 1837, 1840], "yield": [539, 835, 1203, 1210, 1704, 1735, 1738, 1740, 1742, 1743, 1755, 1770, 1771, 1776, 1798, 1817, 1828, 1833, 1836, 1837, 1838], "yloxi": 1833, "yml": [1738, 1788], "ymp": [575, 1206, 1704], "yn": 1799, "york": [1734, 1781], "yoshimine_out_of_cor": [1231, 1620, 1704], "you": [0, 1, 2, 573, 586, 603, 664, 1124, 1126, 1206, 1221, 1704, 1735, 1737, 1738, 1743, 1746, 1747, 1748, 1749, 1754, 1756, 1757, 1759, 1762, 1764, 1765, 1767, 1770, 1771, 1773, 1774, 1775, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1792, 1801, 1802, 1803, 1807, 1808, 1809, 1810, 1821, 1828, 1829, 1832, 1835, 1836, 1837, 1838, 1839, 1843, 1844], "young": [1734, 1838], "your": [0, 2, 586, 620, 1206, 1704, 1735, 1737, 1738, 1743, 1748, 1749, 1750, 1754, 1756, 1759, 1764, 1767, 1774, 1777, 1782, 1785, 1786, 1788, 1792, 1803, 1808, 1809, 1814, 1816, 1818, 1828, 1835, 1838, 1844], "yourself": [1738, 1764, 1788, 1837], "yu": [1734, 1753, 1781, 1786], "yz": [139, 1833], "z": [2, 8, 9, 73, 94, 106, 111, 134, 139, 147, 150, 275, 284, 295, 318, 319, 323, 350, 388, 592, 594, 595, 637, 712, 873, 1099, 1206, 1210, 1220, 1231, 1586, 1694, 1704, 1711, 1714, 1724, 1730, 1732, 1733, 1734, 1740, 1741, 1743, 1750, 1755, 1757, 1766, 1768, 1775, 1776, 1779, 1781, 1786, 1788, 1799, 1800, 1802, 1817, 1828, 1832, 1833, 1837, 1838, 1841, 1842, 1844], "z1": 1799, "z2": 1799, "z_a": 1838, "z_i": 1776, "z_j": 1776, "z_kave": [835, 1210, 1704], "zach": 1763, "zapt": [295, 1714, 1739, 1766, 1776, 1781, 1842], "zapt2": [1739, 1781], "zapt25": 1755, "zapt4": [1714, 1842], "zaptn": [861, 891, 1210, 1673, 1704, 1714, 1755, 1776, 1842], "zero": [0, 2, 12, 64, 73, 88, 100, 106, 139, 148, 183, 184, 329, 443, 479, 519, 543, 569, 575, 593, 599, 609, 660, 707, 827, 881, 1199, 1200, 1202, 1203, 1206, 1210, 1224, 1229, 1238, 1426, 1434, 1691, 1704, 1743, 1752, 1756, 1759, 1775, 1776, 1794, 1810, 1821, 1828, 1833, 1838, 1843, 1844], "zero_ao_basis_set": 8, "zero_diagon": 100, "zero_ghost_frag": [106, 1768], "zero_internal_amp": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "zero_low": 100, "zero_redund": 133, "zero_upp": 100, "zeroth": [1817, 1828, 1829, 1837, 1838, 1844], "zeta": [0, 1, 2, 284, 1704, 1707, 1730, 1731, 1733, 1735, 1738, 1739, 1740, 1741, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "zhang": 1734, "zhao": [1692, 1752], "zhi": 1740, "zhou": 1734, "zip": [1737, 1781, 1788, 1802], "zlib": [1738, 1746, 1803], "zlo": 1740, "zlp": [295, 318, 319, 1695, 1698, 1702, 1703, 1758, 1766, 1800], "zmat": [592, 614, 1206, 1704, 1714, 1743, 1842], "zmatrix": [106, 1714, 1726, 1802, 1842], "zmd": 1740, "zn": [1707, 1731, 1799], "zno": [1714, 1842], "zoom": 323, "zpe": [707, 1206, 1704, 1752, 1843], "zpve": [1691, 1761, 1776, 1843], "zr": [1707, 1731], "zuchowski": [1692, 1734, 1752], "zwaan": 1781, "zzzzzzz": [1786, 1788], "\u00df": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u00e0": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u00e1": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u00e2": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u00e3": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u00e4": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u00e5": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u00e8": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u00e9": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u00ea": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u00eb": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u00ec": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u00ed": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u00ee": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u00ef": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u00f1": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u00f2": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u00f3": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u00f4": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u00f5": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u00f6": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u00f8": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u00f9": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u00fa": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u00fb": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u00fc": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u03c3": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u03c8": 13}, "titles": ["ADC: Ab Initio Polarization Propagator", "Interface to adcc by M. F. Herbst and M. Scheurer", "Test Suite", "AOShellCombinationsIterator", "AngularMomentumInt", "BSVec", "BasisExtents", "BasisFunctions", "BasisSet", "BlockOPoints", "BoysLocalizer", "CCWavefunction", "CIVector", "CIWavefunction", "CUHF", "CdSalc", "CdSalcList", "CharacterTable", "CompositeJK", "CorrelationFactor", "CorrelationTable", "CubeProperties", "DASUM", "DAXPY", "DCOPY", "DDOT", "DFEP2Wavefunction", "DFHelper", "DFSOMCSCF", "DFTGrid", "DFTensor", "DGBMV", "DGEEV", "DGEMM", "DGEMV", "DGER", "DGETRF", "DGETRI", "DGETRS", "DNRM2", "DPOTRF", "DPOTRI", "DPOTRS", "DROT", "DSBMV", "DSCAL", "DSWAP", "DSYEV", "DSYMM", "DSYMV", "DSYR", "DSYR2", "DSYR2K", "DSYRK", "DSYSV", "DTBMV", "DTBSV", "DTRMM", "DTRMV", "DTRSM", "DTRSV", "Deriv", "DerivCalcType", "DiagonalizeOrder", "Dimension", "DipoleInt", "DirectJK", "DiskSOMCSCF", "Dispersion", "ERI", "ESPPropCalc", "ElectricFieldInt", "ElectrostaticInt", "ExternalPotential", "FCHKWriter", "FDDS_Dispersion", "FISAPT", "FittedSlaterCorrelationFactor", "FittingMetric", "FragmentType", "Functional", "GaussianShell", "GaussianType", "GeometryUnits", "HF", "IDAMAX", "IO", "IOManager", "IntVector", "IntegralFactory", "IntegralTransform", "IrreducibleRepresentation", "JK", "KineticInt", "LS_THC_Computer", "LaplaceDenominator", "LibXCFunctional", "Localizer", "MOSpace", "MOWriter", "Matrix", "MatrixFactory", "MemDFJK", "MintsHelper", "MoldenWriter", "MolecularGrid", "Molecule", "MultipoleInt", "MultipoleSymmetry", "NablaInt", "NumIntHelper", "OEProp", "OneBodyAOInt", "OneBodySOInt", "Options", "OrbitalSpace", "OverlapInt", "PMLocalizer", "PetiteList", "PointFunctions", "PointGroup", "PotentialInt", "PrimitiveType", "Prop", "ProtoIntVector", "ProtoVector", "PsiReturnType", "QuadrupoleInt", "RHF", "RKSFunctions", "ROHF", "SADGuess", "SOBasisSet", "SOMCSCF", "SalcComponent", "SaveType", "ShellInfo", "Slice", "SuperFunctional", "SymmetryOperation", "TLaplaceDenominator", "ThreeCenterOverlapInt", "TracelessQuadrupoleInt", "TwoBodyAOInt", "TwoElectronInt", "UHF", "UKSFunctions", "VBase", "Vector", "Vector3", "Wavefunction", "array_variable", "array_variables", "be_quiet", "benchmark_blas1", "benchmark_blas2", "benchmark_blas3", "benchmark_disk", "benchmark_integrals", "benchmark_math", "ccdensity", "ccenergy", "cceom", "cchbar", "cclambda", "ccresponse", "cctransort", "cctriples", "clean", "clean_options", "clean_timers", "clean_variables", "close_outfile", "dct", "del_array_variable", "del_scalar_variable", "del_variable", "detci", "dfmp2", "dfocc", "dlpno", "dmrg", "doublet", "dpdbuf4", "dpdfile2", "dummy_einsums", "dummy_integratorxx", "fcidump_tei_helper", "finalize", "flush_outfile", "fnocc", "get_active_molecule", "get_array_variable", "get_array_variables", "get_datadir", "get_global_option", "get_global_option_list", "get_local_option", "get_memory", "get_num_threads", "get_option", "get_options", "get_output_file", "get_variable", "get_variables", "get_writer_file_prefix", "git_version", "has_array_variable", "has_global_option_changed", "has_local_option_changed", "has_option_changed", "has_scalar_variable", "has_variable", "initialize", "libint2_solid_harmonics_ordering", "mcscf", "mrcc_generate_input", "mrcc_load_densities", "occ", "option_exists_in_module", "options_to_python", "outfile_name", "plugin", "plugin_close", "plugin_close_all", "plugin_load", "prepare_options_for_module", "print_global_options", "print_options", "print_out", "print_variables", "psi_top_srcdir", "psimrcc", "psio_entry", "reopen_outfile", "revoke_global_option_changed", "revoke_local_option_changed", "sapt", "scalar_variable", "scalar_variables", "scatter", "scfgrad", "scfhess", "set_active_molecule", "set_array_variable", "set_datadir", "set_global_option", "set_global_option_python", "set_local_option", "set_local_option_python", "set_memory_bytes", "set_num_threads", "set_output_file", "set_psi_file_prefix", "set_scalar_variable", "set_variable", "test_matrix_dpd_interface", "timer_off", "timer_on", "triplet", "tstart", "tstop", "variable", "variables", "version", "AtomicComputer", "ConvergenceError", "EmpiricalDispersion", "ManagedMethodError", "MissingMethodError", "OptimizationConvergenceError", "ParsingError", "PastureRequiredError", "PsiException", "QMMM", "QMMMbohr", "SCFConvergenceError", "TDSCFConvergenceError", "TestComparisonError", "UpgradeHelper", "ValidationError", "activate", "banner", "basis_helper", "cbs", "compare_fchkfiles", "compare_fcidumps", "compare_moldenfiles", "copy_file_from_scratch", "copy_file_to_scratch", "create_plugin", "cubeprop", "docs_table_link", "dynamic_variable_bind", "energies_from_fcidump", "energy", "fchk", "fcidump", "fcidump_from_file", "find_approximate_string_matches", "freq", "frequencies", "frequency", "gdma", "geometry", "get_memory", "gradient", "hessian", "ipi_broker", "levenshtein", "libint2_configuration", "libint2_print_out", "mdi_run", "message_box", "molden", "molecule_get_attr", "molecule_set_attr", "oeprop", "opt", "optimize", "optimize_geometric", "DIIS", "Gaussian", "InPsight", "Lineshape", "Lorentzian", "OptionState", "OptionsState", "OptionsStateCM", "SolverEngine", "all_casings", "array_to_matrix", "banner", "basis_helper", "block_diagonal_array", "cg_solver", "compare_fchkfiles", "compare_fcidumps", "compare_moldenfiles", "copy_file_from_scratch", "copy_file_to_scratch", "cubeprop", "davidson_solver", "docs_table_link", "drop_duplicates", "energies_from_fcidump", "expand_psivars", "fcidump", "fcidump_from_file", "find_approximate_string_matches", "format_molecule_for_input", "format_options_for_input", "free_atom_volumes", "get_memory", "get_psifile", "getattr_ignorecase", "hamiltonian_solver", "hold_options_state", "import_ignorecase", "kwargs_lower", "levenshtein", "libint2_configuration", "libint2_print_out", "mat2arr", "message_box", "oeprop", "pcm_helper", "plump_qcvar", "prefactor_ecd", "prefactor_opa", "prepare_options_for_modules", "prepare_options_for_set_options", "provenance_stamp", "sanitize_method", "set_memory", "set_module_options", "set_options", "spectrum", "state_to_atomicinput", "pcm_helper", "process_input", "prop", "properties", "compare_vibinfos", "filter_nonvib", "filter_omega_to_real", "harmonic_analysis", "hessian_symmetrize", "print_molden_vibs", "print_vibs", "thermo", "sanitize_method", "sanitize_name", "scf_helper", "scf_wavefunction_factory", "set_memory", "set_module_options", "set_options", "tdscf", "vibanal_wfn", "Appendices", "<span class=\"xref std std-term\">CUTOFF_AMPS_PRINT</span>", "<span class=\"xref std std-term\">GAUGE</span>", "<span class=\"xref std std-term\">KIND</span>", "<span class=\"xref std std-term\">MAX_NUM_VECS</span>", "<span class=\"xref std std-term\">MAXITER</span>", "<span class=\"xref std std-term\">NUM_CORE_ORBITALS</span>", "<span class=\"xref std std-term\">NUM_GUESSES</span>", "<span class=\"xref std std-term\">R_CONVERGENCE</span>", "<span class=\"xref std std-term\">REFERENCE</span>", "<span class=\"xref std std-term\">ROOTS_PER_IRREP</span>", "<span class=\"xref std std-term\">AO_BASIS</span>", "<span class=\"xref std std-term\">CACHELEVEL</span>", "<span class=\"xref std std-term\">DEBUG</span>", "<span class=\"xref std std-term\">GAUGE</span>", "<span class=\"xref std std-term\">INTS_TOLERANCE</span>", "<span class=\"xref std std-term\">OPDM_ONLY</span>", "<span class=\"xref std std-term\">OPDM_RELAX</span>", "<span class=\"xref std std-term\">PROP_ALL</span>", "<span class=\"xref std std-term\">PROP_ROOT</span>", "<span class=\"xref std std-term\">PROP_SYM</span>", "<span class=\"xref std std-term\">REFERENCE</span>", "<span class=\"xref std std-term\">ROOTS_PER_IRREP</span>", "<span class=\"xref std std-term\">WFN</span>", "<span class=\"xref std std-term\">WRITE_NOS</span>", "<span class=\"xref std std-term\">XI</span>", "<span class=\"xref std std-term\">XI_CONNECT</span>", "<span class=\"xref std std-term\">ZETA</span>", "<span class=\"xref std std-term\">ABCD</span>", "<span class=\"xref std std-term\">ANALYZE</span>", "<span class=\"xref std std-term\">AO_BASIS</span>", "<span class=\"xref std std-term\">BCCD_MAXITER</span>", "<span class=\"xref std std-term\">BRUECKNER_ORBS_R_CONVERGENCE</span>", "<span class=\"xref std std-term\">CACHELEVEL</span>", "<span class=\"xref std std-term\">CACHETYPE</span>", "<span class=\"xref std std-term\">CC_NUM_THREADS</span>", "<span class=\"xref std std-term\">CC_OS_SCALE</span>", "<span class=\"xref std std-term\">CC_SS_SCALE</span>", "<span class=\"xref std std-term\">DIIS</span>", "<span class=\"xref std std-term\">E_CONVERGENCE</span>", "<span class=\"xref std std-term\">FORCE_RESTART</span>", "<span class=\"xref std std-term\">LOCAL</span>", "<span class=\"xref std std-term\">LOCAL_CPHF_CUTOFF</span>", "<span class=\"xref std std-term\">LOCAL_CUTOFF</span>", "<span class=\"xref std std-term\">LOCAL_METHOD</span>", "<span class=\"xref std std-term\">LOCAL_PAIRDEF</span>", "<span class=\"xref std std-term\">LOCAL_WEAKP</span>", "<span class=\"xref std std-term\">MAXITER</span>", "<span class=\"xref std std-term\">MP2_AMPS_PRINT</span>", "<span class=\"xref std std-term\">MP2_OS_SCALE</span>", "<span class=\"xref std std-term\">MP2_SS_SCALE</span>", "<span class=\"xref std std-term\">NEW_TRIPLES</span>", "<span class=\"xref std std-term\">NUM_AMPS_PRINT</span>", "<span class=\"xref std std-term\">PAIR_ENERGIES_PRINT</span>", "<span class=\"xref std std-term\">PROPERTY</span>", "<span class=\"xref std std-term\">R_CONVERGENCE</span>", "<span class=\"xref std std-term\">REFERENCE</span>", "<span class=\"xref std std-term\">RESTART</span>", "<span class=\"xref std std-term\">SCS_CCSD</span>", "<span class=\"xref std std-term\">SCS_MP2</span>", "<span class=\"xref std std-term\">SCSN_MP2</span>", "<span class=\"xref std std-term\">SEMICANONICAL</span>", "<span class=\"xref std std-term\">T2_COUPLED</span>", "<span class=\"xref std std-term\">T3_WS_INCORE</span>", "<span class=\"xref std std-term\">WFN</span>", "<span class=\"xref std std-term\">ABCD</span>", "<span class=\"xref std std-term\">CACHELEVEL</span>", "<span class=\"xref std std-term\">CACHETYPE</span>", "<span class=\"xref std std-term\">CC3_FOLLOW_ROOT</span>", "<span class=\"xref std std-term\">CC_NUM_THREADS</span>", "<span class=\"xref std std-term\">COLLAPSE_WITH_LAST</span>", "<span class=\"xref std std-term\">COLLAPSE_WITH_LAST_CC3</span>", "<span class=\"xref std std-term\">COMPLEX_TOLERANCE</span>", "<span class=\"xref std std-term\">E_CONVERGENCE</span>", "<span class=\"xref std std-term\">EOM_GUESS</span>", "<span class=\"xref std std-term\">EOM_REFERENCE</span>", "<span class=\"xref std std-term\">EXCITATION_RANGE</span>", "<span class=\"xref std std-term\">FULL_MATRIX</span>", "<span class=\"xref std std-term\">LOCAL</span>", "<span class=\"xref std std-term\">LOCAL_CUTOFF</span>", "<span class=\"xref std std-term\">LOCAL_DO_SINGLES</span>", "<span class=\"xref std std-term\">LOCAL_FILTER_SINGLES</span>", "<span class=\"xref std std-term\">LOCAL_METHOD</span>", "<span class=\"xref std std-term\">LOCAL_PRECONDITIONER</span>", "<span class=\"xref std std-term\">LOCAL_WEAKP</span>", "<span class=\"xref std std-term\">MAXITER</span>", "<span class=\"xref std std-term\">NEW_TRIPLES</span>", "<span class=\"xref std std-term\">NUM_AMPS_PRINT</span>", "<span class=\"xref std std-term\">OVERLAP_CHECK</span>", "<span class=\"xref std std-term\">PROP_ROOT</span>", "<span class=\"xref std std-term\">PROP_SYM</span>", "<span class=\"xref std std-term\">R_CONVERGENCE</span>", "<span class=\"xref std std-term\">REFERENCE</span>", "<span class=\"xref std std-term\">RESTART_EOM_CC3</span>", "<span class=\"xref std std-term\">RHF_TRIPLETS</span>", "<span class=\"xref std std-term\">ROOTS_PER_IRREP</span>", "<span class=\"xref std std-term\">SCHMIDT_ADD_RESIDUAL_TOLERANCE</span>", "<span class=\"xref std std-term\">SEMICANONICAL</span>", "<span class=\"xref std std-term\">SINGLES_PRINT</span>", "<span class=\"xref std std-term\">SS_E_CONVERGENCE</span>", "<span class=\"xref std std-term\">SS_R_CONVERGENCE</span>", "<span class=\"xref std std-term\">SS_SKIP_DIAG</span>", "<span class=\"xref std std-term\">SS_VECS_PER_ROOT</span>", "<span class=\"xref std std-term\">T3_WS_INCORE</span>", "<span class=\"xref std std-term\">VECS_CC3</span>", "<span class=\"xref std std-term\">VECS_PER_ROOT</span>", "<span class=\"xref std std-term\">WFN</span>", "<span class=\"xref std std-term\">CACHELEVEL</span>", "<span class=\"xref std std-term\">EOM_REFERENCE</span>", "<span class=\"xref std std-term\">T_AMPS</span>", "<span class=\"xref std std-term\">WABEI_LOWDISK</span>", "<span class=\"xref std std-term\">WFN</span>", "<span class=\"xref std std-term\">ABCD</span>", "<span class=\"xref std std-term\">AO_BASIS</span>", "<span class=\"xref std std-term\">CACHELEVEL</span>", "<span class=\"xref std std-term\">DIIS</span>", "<span class=\"xref std std-term\">JOBTYPE</span>", "<span class=\"xref std std-term\">LOCAL</span>", "<span class=\"xref std std-term\">LOCAL_CPHF_CUTOFF</span>", "<span class=\"xref std std-term\">LOCAL_CUTOFF</span>", "<span class=\"xref std std-term\">LOCAL_FILTER_SINGLES</span>", "<span class=\"xref std std-term\">LOCAL_METHOD</span>", "<span class=\"xref std std-term\">LOCAL_PAIRDEF</span>", "<span class=\"xref std std-term\">LOCAL_WEAKP</span>", "<span class=\"xref std std-term\">MAXITER</span>", "<span class=\"xref std std-term\">NUM_AMPS_PRINT</span>", "<span class=\"xref std std-term\">PROP_ALL</span>", "<span class=\"xref std std-term\">PROP_ROOT</span>", "<span class=\"xref std std-term\">PROP_SYM</span>", "<span class=\"xref std std-term\">R_CONVERGENCE</span>", "<span class=\"xref std std-term\">RESTART</span>", "<span class=\"xref std std-term\">ROOTS_PER_IRREP</span>", "<span class=\"xref std std-term\">SEKINO</span>", "<span class=\"xref std std-term\">WFN</span>", "<span class=\"xref std std-term\">ZETA</span>", "<span class=\"xref std std-term\">ABCD</span>", "<span class=\"xref std std-term\">ANALYZE</span>", "<span class=\"xref std std-term\">CACHELEVEL</span>", "<span class=\"xref std std-term\">DIIS</span>", "<span class=\"xref std std-term\">GAUGE</span>", "<span class=\"xref std std-term\">LINEAR</span>", "<span class=\"xref std std-term\">LOCAL</span>", "<span class=\"xref std std-term\">LOCAL_CPHF_CUTOFF</span>", "<span class=\"xref std std-term\">LOCAL_CUTOFF</span>", "<span class=\"xref std std-term\">LOCAL_FILTER_SINGLES</span>", "<span class=\"xref std std-term\">LOCAL_METHOD</span>", "<span class=\"xref std std-term\">LOCAL_PAIRDEF</span>", "<span class=\"xref std std-term\">LOCAL_WEAKP</span>", "<span class=\"xref std std-term\">MAXITER</span>", "<span class=\"xref std std-term\">NUM_AMPS_PRINT</span>", "<span class=\"xref std std-term\">OMEGA</span>", "<span class=\"xref std std-term\">PROPERTY</span>", "<span class=\"xref std std-term\">R_CONVERGENCE</span>", "<span class=\"xref std std-term\">REFERENCE</span>", "<span class=\"xref std std-term\">RESTART</span>", "<span class=\"xref std std-term\">SEKINO</span>", "<span class=\"xref std std-term\">WFN</span>", "<span class=\"xref std std-term\">AO_BASIS</span>", "<span class=\"xref std std-term\">CACHELEVEL</span>", "<span class=\"xref std std-term\">DELETE_TEI</span>", "<span class=\"xref std std-term\">REFERENCE</span>", "<span class=\"xref std std-term\">RUN_CCTRANSORT</span>", "<span class=\"xref std std-term\">SEMICANONICAL</span>", "<span class=\"xref std std-term\">WFN</span>", "<span class=\"xref std std-term\">CC_NUM_THREADS</span>", "<span class=\"xref std std-term\">REFERENCE</span>", "<span class=\"xref std std-term\">SEMICANONICAL</span>", "<span class=\"xref std std-term\">WFN</span>", "<span class=\"xref std std-term\">CFOUR_ABCDTYPE</span>", "<span class=\"xref std std-term\">CFOUR_ACTIVE_ORBI</span>", "<span class=\"xref std std-term\">CFOUR_ANH_ALGORITHM</span>", "<span class=\"xref std std-term\">CFOUR_ANH_DERIVATIVES</span>", "<span class=\"xref std std-term\">CFOUR_ANH_STEPSIZE</span>", "<span class=\"xref std std-term\">CFOUR_ANH_SYMMETRY</span>", "<span class=\"xref std std-term\">CFOUR_ANHARMONIC</span>", "<span class=\"xref std std-term\">CFOUR_AO_LADDERS</span>", "<span class=\"xref std std-term\">CFOUR_AV_SCF</span>", "<span class=\"xref std std-term\">CFOUR_BASIS</span>", "<span class=\"xref std std-term\">CFOUR_BRUCK_CONV</span>", "<span class=\"xref std std-term\">CFOUR_BRUECKNER</span>", "<span class=\"xref std std-term\">CFOUR_CACHE_RECS</span>", "<span class=\"xref std std-term\">CFOUR_CALC_LEVEL</span>", "<span class=\"xref std std-term\">CFOUR_CC_CONV</span>", "<span class=\"xref std std-term\">CFOUR_CC_EXPORDER</span>", "<span class=\"xref std std-term\">CFOUR_CC_EXTRAPOLATION</span>", "<span class=\"xref std std-term\">CFOUR_CC_MAXCYC</span>", "<span class=\"xref std std-term\">CFOUR_CC_PROGRAM</span>", "<span class=\"xref std std-term\">CFOUR_CHARGE</span>", "<span class=\"xref std std-term\">CFOUR_CIS_CONV</span>", "<span class=\"xref std std-term\">CFOUR_CONTINUUM</span>", "<span class=\"xref std std-term\">CFOUR_CONTRACTION</span>", "<span class=\"xref std std-term\">CFOUR_CONVERGENCE</span>", "<span class=\"xref std std-term\">CFOUR_COORDINATES</span>", "<span class=\"xref std std-term\">CFOUR_CORE_ORBITALS</span>", "<span class=\"xref std std-term\">CFOUR_CPHF_CONVER</span>", "<span class=\"xref std std-term\">CFOUR_CPHF_MAXCYC</span>", "<span class=\"xref std std-term\">CFOUR_CURVILINEAR</span>", "<span class=\"xref std std-term\">CFOUR_DBOC</span>", "<span class=\"xref std std-term\">CFOUR_DCT</span>", "<span class=\"xref std std-term\">CFOUR_DERIV_LEVEL</span>", "<span class=\"xref std std-term\">CFOUR_DIFF_TYPE</span>", "<span class=\"xref std std-term\">CFOUR_DROPMO</span>", "<span class=\"xref std std-term\">CFOUR_ECP</span>", "<span class=\"xref std std-term\">CFOUR_EIGENVECTOR</span>", "<span class=\"xref std std-term\">CFOUR_EL_ANHARM</span>", "<span class=\"xref std std-term\">CFOUR_EOM_NONIT</span>", "<span class=\"xref std std-term\">CFOUR_ESTATE_CONV</span>", "<span class=\"xref std std-term\">CFOUR_ESTATE_MAXCYC</span>", "<span class=\"xref std std-term\">CFOUR_ESTATE_PROP</span>", "<span class=\"xref std std-term\">CFOUR_ESTATE_SYM</span>", "<span class=\"xref std std-term\">CFOUR_ESTATE_TRANS</span>", "<span class=\"xref std std-term\">CFOUR_EVAL_HESS</span>", "<span class=\"xref std std-term\">CFOUR_EXCITATION</span>", "<span class=\"xref std std-term\">CFOUR_EXCITE</span>", "<span class=\"xref std std-term\">CFOUR_FC_FIELD</span>", "<span class=\"xref std std-term\">CFOUR_FD_CALCTYPE</span>", "<span class=\"xref std std-term\">CFOUR_FD_IRREPS</span>", "<span class=\"xref std std-term\">CFOUR_FD_PROJECT</span>", "<span class=\"xref std std-term\">CFOUR_FD_STEPSIZE</span>", "<span class=\"xref std std-term\">CFOUR_FD_USEGROUP</span>", "<span class=\"xref std std-term\">CFOUR_FILE_RECSIZ</span>", "<span class=\"xref std std-term\">CFOUR_FILE_STRIPE</span>", "<span class=\"xref std std-term\">CFOUR_FINITE_PERTURBATION</span>", "<span class=\"xref std std-term\">CFOUR_FOCK</span>", "<span class=\"xref std std-term\">CFOUR_FREQ_ALGORITHM</span>", "<span class=\"xref std std-term\">CFOUR_FROZEN_CORE</span>", "<span class=\"xref std std-term\">CFOUR_FROZEN_VIRT</span>", "<span class=\"xref std std-term\">CFOUR_GAMMA_ABCD</span>", "<span class=\"xref std std-term\">CFOUR_GENBAS_1</span>", "<span class=\"xref std std-term\">CFOUR_GENBAS_2</span>", "<span class=\"xref std std-term\">CFOUR_GENBAS_3</span>", "<span class=\"xref std std-term\">CFOUR_GENBAS_4</span>", "<span class=\"xref std std-term\">CFOUR_GEO_CONV</span>", "<span class=\"xref std std-term\">CFOUR_GEO_MAXCYC</span>", "<span class=\"xref std std-term\">CFOUR_GEO_MAXSTEP</span>", "<span class=\"xref std std-term\">CFOUR_GEO_METHOD</span>", "<span class=\"xref std std-term\">CFOUR_GIAO</span>", "<span class=\"xref std std-term\">CFOUR_GRID</span>", "<span class=\"xref std std-term\">CFOUR_GUESS</span>", "<span class=\"xref std std-term\">CFOUR_HBAR</span>", "<span class=\"xref std std-term\">CFOUR_HFSTABILITY</span>", "<span class=\"xref std std-term\">CFOUR_INCORE</span>", "<span class=\"xref std std-term\">CFOUR_INPUT_MRCC</span>", "<span class=\"xref std std-term\">CFOUR_INTEGRALS</span>", "<span class=\"xref std std-term\">CFOUR_JODA_PRINT</span>", "<span class=\"xref std std-term\">CFOUR_LINEQ_CONV</span>", "<span class=\"xref std std-term\">CFOUR_LINEQ_MAXCY</span>", "<span class=\"xref std std-term\">CFOUR_LINEQ_TYPE</span>", "<span class=\"xref std std-term\">CFOUR_LOCK_ORBOCC</span>", "<span class=\"xref std std-term\">CFOUR_MAXSTEP</span>", "<span class=\"xref std std-term\">CFOUR_MEM_UNIT</span>", "<span class=\"xref std std-term\">CFOUR_MEMORY_SIZE</span>", "<span class=\"xref std std-term\">CFOUR_METHOD</span>", "<span class=\"xref std std-term\">CFOUR_MRCC</span>", "<span class=\"xref std std-term\">CFOUR_MULTIPLICITY</span>", "<span class=\"xref std std-term\">CFOUR_NACOUPLING</span>", "<span class=\"xref std std-term\">CFOUR_NEGEVAL</span>", "<span class=\"xref std std-term\">CFOUR_NEWNORM</span>", "<span class=\"xref std std-term\">CFOUR_NONHF</span>", "<span class=\"xref std std-term\">CFOUR_NTOP_TAMP</span>", "<span class=\"xref std std-term\">CFOUR_OCCUPATION</span>", "<span class=\"xref std std-term\">CFOUR_OMP_NUM_THREADS</span>", "<span class=\"xref std std-term\">CFOUR_OPEN-SHELL</span>", "<span class=\"xref std std-term\">CFOUR_OPT_MAXCYC</span>", "<span class=\"xref std std-term\">CFOUR_ORBITALS</span>", "<span class=\"xref std std-term\">CFOUR_PERT_ORB</span>", "<span class=\"xref std std-term\">CFOUR_POINTS</span>", "<span class=\"xref std std-term\">CFOUR_PRINT</span>", "<span class=\"xref std std-term\">CFOUR_PROP_INTEGRAL</span>", "<span class=\"xref std std-term\">CFOUR_PROPS</span>", "<span class=\"xref std std-term\">CFOUR_QRHF_GENERAL</span>", "<span class=\"xref std std-term\">CFOUR_QRHF_ORBITAL</span>", "<span class=\"xref std std-term\">CFOUR_QRHFGUES</span>", "<span class=\"xref std std-term\">CFOUR_RAMAN_INT</span>", "<span class=\"xref std std-term\">CFOUR_RAMAN_ORB</span>", "<span class=\"xref std std-term\">CFOUR_RDO</span>", "<span class=\"xref std std-term\">CFOUR_REFERENCE</span>", "<span class=\"xref std std-term\">CFOUR_RELATIVISTIC</span>", "<span class=\"xref std std-term\">CFOUR_RELAX_DENS</span>", "<span class=\"xref std std-term\">CFOUR_RES_RAMAN</span>", "<span class=\"xref std std-term\">CFOUR_RESTART_CC</span>", "<span class=\"xref std std-term\">CFOUR_ROT_EVEC</span>", "<span class=\"xref std std-term\">CFOUR_SAVE_INTS</span>", "<span class=\"xref std std-term\">CFOUR_SCALE_ON</span>", "<span class=\"xref std std-term\">CFOUR_SCF_CONV</span>", "<span class=\"xref std std-term\">CFOUR_SCF_DAMPING</span>", "<span class=\"xref std std-term\">CFOUR_SCF_EXPORDER</span>", "<span class=\"xref std std-term\">CFOUR_SCF_EXPSTART</span>", "<span class=\"xref std std-term\">CFOUR_SCF_EXTRAPOLATION</span>", "<span class=\"xref std std-term\">CFOUR_SCF_MAXCYC</span>", "<span class=\"xref std std-term\">CFOUR_SD_FIELD</span>", "<span class=\"xref std std-term\">CFOUR_SPHERICAL</span>", "<span class=\"xref std std-term\">CFOUR_SPIN_FLIP</span>", "<span class=\"xref std std-term\">CFOUR_SPIN_ORBIT</span>", "<span class=\"xref std std-term\">CFOUR_SPIN_SCAL</span>", "<span class=\"xref std std-term\">CFOUR_SPINROTATION</span>", "<span class=\"xref std std-term\">CFOUR_SUBGROUP</span>", "<span class=\"xref std std-term\">CFOUR_SYM_CHECK</span>", "<span class=\"xref std std-term\">CFOUR_SYMMETRY</span>", "<span class=\"xref std std-term\">CFOUR_T3_EXTRAPOL</span>", "<span class=\"xref std std-term\">CFOUR_TAMP_SUM</span>", "<span class=\"xref std std-term\">CFOUR_THERMOCHEMISTRY</span>", "<span class=\"xref std std-term\">CFOUR_TRANS_INV</span>", "<span class=\"xref std std-term\">CFOUR_TREAT_PERT</span>", "<span class=\"xref std std-term\">CFOUR_UIJ_THRESHOLD</span>", "<span class=\"xref std std-term\">CFOUR_UNITS</span>", "<span class=\"xref std std-term\">CFOUR_UPDATE_HESSIAN</span>", "<span class=\"xref std std-term\">CFOUR_VIBRATION</span>", "<span class=\"xref std std-term\">CFOUR_VTRAN</span>", "<span class=\"xref std std-term\">CFOUR_XFIELD</span>", "<span class=\"xref std std-term\">CFOUR_XFORM_TOL</span>", "<span class=\"xref std std-term\">CFOUR_YFIELD</span>", "<span class=\"xref std std-term\">CFOUR_ZFIELD</span>", "<span class=\"xref std std-term\">TRANSLATE_PSI4</span>", "<span class=\"xref std std-term\">CPHF_MEM_SAFETY_FACTOR</span>", "<span class=\"xref std std-term\">CPHF_TASKS</span>", "<span class=\"xref std std-term\">DEBUG</span>", "<span class=\"xref std std-term\">DF_BASIS_SCF</span>", "<span class=\"xref std std-term\">EXPLICIT_HAMILTONIAN</span>", "<span class=\"xref std std-term\">MODULE</span>", "<span class=\"xref std std-term\">PRINT</span>", "<span class=\"xref std std-term\">SCF_TYPE</span>", "<span class=\"xref std std-term\">SOLVER_CONVERGENCE</span>", "<span class=\"xref std std-term\">SOLVER_MAXITER</span>", "<span class=\"xref std std-term\">SOLVER_N_GUESS</span>", "<span class=\"xref std std-term\">SOLVER_PRECONDITION</span>", "<span class=\"xref std std-term\">ALGORITHM</span>", "<span class=\"xref std std-term\">AO_BASIS</span>", "<span class=\"xref std std-term\">CACHELEVEL</span>", "<span class=\"xref std std-term\">DAMPING_PERCENTAGE</span>", "<span class=\"xref std std-term\">DCT_FUNCTIONAL</span>", "<span class=\"xref std std-term\">DCT_GUESS</span>", "<span class=\"xref std std-term\">DCT_TYPE</span>", "<span class=\"xref std std-term\">DF_BASIS_DCT</span>", "<span class=\"xref std std-term\">DIIS_MAX_VECS</span>", "<span class=\"xref std std-term\">DIIS_MIN_VECS</span>", "<span class=\"xref std std-term\">DIIS_START_CONVERGENCE</span>", "<span class=\"xref std std-term\">E_CONVERGENCE</span>", "<span class=\"xref std std-term\">ENERGY_LEVEL_SHIFT</span>", "<span class=\"xref std std-term\">GUESS_R_CONVERGENCE</span>", "<span class=\"xref std std-term\">INTS_TOLERANCE</span>", "<span class=\"xref std std-term\">MAXITER</span>", "<span class=\"xref std std-term\">ODC_GUESS</span>", "<span class=\"xref std std-term\">OPDM</span>", "<span class=\"xref std std-term\">ORBITAL_LEVEL_SHIFT</span>", "<span class=\"xref std std-term\">QC_COUPLING</span>", "<span class=\"xref std std-term\">QC_TYPE</span>", "<span class=\"xref std std-term\">R_CONVERGENCE</span>", "<span class=\"xref std std-term\">REFERENCE</span>", "<span class=\"xref std std-term\">RELAX_GUESS_ORBITALS</span>", "<span class=\"xref std std-term\">RESPONSE_ALGORITHM</span>", "<span class=\"xref std std-term\">STABILITY_ADD_VECTORS</span>", "<span class=\"xref std std-term\">STABILITY_AUGMENT_SPACE_TOL</span>", "<span class=\"xref std std-term\">STABILITY_CHECK</span>", "<span class=\"xref std std-term\">STABILITY_CONVERGENCE</span>", "<span class=\"xref std std-term\">STABILITY_MAX_SPACE_SIZE</span>", "<span class=\"xref std std-term\">STABILITY_N_EIGENVALUES</span>", "<span class=\"xref std std-term\">STABILITY_N_GUESS_VECTORS</span>", "<span class=\"xref std std-term\">THREE_PARTICLE</span>", "<span class=\"xref std std-term\">TIKHONOW_OMEGA</span>", "<span class=\"xref std std-term\">DDX_DIIS_MAX_VECS</span>", "<span class=\"xref std std-term\">DDX_ETA</span>", "<span class=\"xref std std-term\">DDX_FMM</span>", "<span class=\"xref std std-term\">DDX_FMM_LOCAL_LMAX</span>", "<span class=\"xref std std-term\">DDX_FMM_MULTIPOLE_LMAX</span>", "<span class=\"xref std std-term\">DDX_INCORE</span>", "<span class=\"xref std std-term\">DDX_LMAX</span>", "<span class=\"xref std std-term\">DDX_LOGFILE</span>", "<span class=\"xref std std-term\">DDX_MAXITER</span>", "<span class=\"xref std std-term\">DDX_MODEL</span>", "<span class=\"xref std std-term\">DDX_N_LEBEDEV</span>", "<span class=\"xref std std-term\">DDX_RADII</span>", "<span class=\"xref std std-term\">DDX_RADII_SCALING</span>", "<span class=\"xref std std-term\">DDX_RADII_SET</span>", "<span class=\"xref std std-term\">DDX_SHIFT</span>", "<span class=\"xref std std-term\">DDX_SOLUTE_RADIAL_POINTS</span>", "<span class=\"xref std std-term\">DDX_SOLUTE_SPHERICAL_POINTS</span>", "<span class=\"xref std std-term\">DDX_SOLVATION_CONVERGENCE</span>", "<span class=\"xref std std-term\">DDX_SOLVENT</span>", "<span class=\"xref std std-term\">DDX_SOLVENT_EPSILON</span>", "<span class=\"xref std std-term\">DDX_SOLVENT_EPSILON_OPTICAL</span>", "<span class=\"xref std std-term\">DDX_SOLVENT_KAPPA</span>", "<span class=\"xref std std-term\">A_RAS3_MAX</span>", "<span class=\"xref std std-term\">AVG_STATES</span>", "<span class=\"xref std std-term\">AVG_WEIGHTS</span>", "<span class=\"xref std std-term\">B_RAS3_MAX</span>", "<span class=\"xref std std-term\">BENDAZZOLI</span>", "<span class=\"xref std std-term\">CALC_S_SQUARED</span>", "<span class=\"xref std std-term\">CC</span>", "<span class=\"xref std std-term\">CC_A_RAS3_MAX</span>", "<span class=\"xref std std-term\">CC_B_RAS3_MAX</span>", "<span class=\"xref std std-term\">CC_EX_LEVEL</span>", "<span class=\"xref std std-term\">CC_FIX_EXTERNAL</span>", "<span class=\"xref std std-term\">CC_FIX_EXTERNAL_MIN</span>", "<span class=\"xref std std-term\">CC_MACRO</span>", "<span class=\"xref std std-term\">CC_MIXED</span>", "<span class=\"xref std std-term\">CC_RAS34_MAX</span>", "<span class=\"xref std std-term\">CC_RAS3_MAX</span>", "<span class=\"xref std std-term\">CC_RAS4_MAX</span>", "<span class=\"xref std std-term\">CC_UPDATE_EPS</span>", "<span class=\"xref std std-term\">CC_VAL_EX_LEVEL</span>", "<span class=\"xref std std-term\">CC_VARIATIONAL</span>", "<span class=\"xref std std-term\">CC_VECS_READ</span>", "<span class=\"xref std std-term\">CC_VECS_WRITE</span>", "<span class=\"xref std std-term\">CI_FILE_START</span>", "<span class=\"xref std std-term\">CI_MAXITER</span>", "<span class=\"xref std std-term\">CI_NUM_THREADS</span>", "<span class=\"xref std std-term\">CIBLKS_PRINT</span>", "<span class=\"xref std std-term\">COLLAPSE_SIZE</span>", "<span class=\"xref std std-term\">DETCI_FREEZE_CORE</span>", "<span class=\"xref std std-term\">DF_BASIS_MCSCF</span>", "<span class=\"xref std std-term\">DIAG_METHOD</span>", "<span class=\"xref std std-term\">DIIS</span>", "<span class=\"xref std std-term\">DIIS_FREQ</span>", "<span class=\"xref std std-term\">DIIS_MAX_VECS</span>", "<span class=\"xref std std-term\">DIIS_MIN_VECS</span>", "<span class=\"xref std std-term\">DIIS_START_ITER</span>", "<span class=\"xref std std-term\">DIPMOM</span>", "<span class=\"xref std std-term\">E_CONVERGENCE</span>", "<span class=\"xref std std-term\">EX_ALLOW</span>", "<span class=\"xref std std-term\">EX_LEVEL</span>", "<span class=\"xref std std-term\">FCI</span>", "<span class=\"xref std std-term\">FCI_STRINGS</span>", "<span class=\"xref std std-term\">FILTER_GUESS</span>", "<span class=\"xref std std-term\">FILTER_GUESS_DET1</span>", "<span class=\"xref std std-term\">FILTER_GUESS_DET2</span>", "<span class=\"xref std std-term\">FILTER_GUESS_SIGN</span>", "<span class=\"xref std std-term\">FILTER_ZERO_DET</span>", "<span class=\"xref std std-term\">FOLLOW_ROOT</span>", "<span class=\"xref std std-term\">FOLLOW_VECTOR</span>", "<span class=\"xref std std-term\">GUESS_VECTOR</span>", "<span class=\"xref std std-term\">H0_BLOCK_COUPLING</span>", "<span class=\"xref std std-term\">H0_BLOCK_COUPLING_SIZE</span>", "<span class=\"xref std std-term\">H0_BLOCKSIZE</span>", "<span class=\"xref std std-term\">H0_GUESS_SIZE</span>", "<span class=\"xref std std-term\">HD_AVG</span>", "<span class=\"xref std std-term\">HD_OTF</span>", "<span class=\"xref std std-term\">ICORE</span>", "<span class=\"xref std std-term\">ISTOP</span>", "<span class=\"xref std std-term\">LSE</span>", "<span class=\"xref std std-term\">LSE_COLLAPSE</span>", "<span class=\"xref std std-term\">LSE_TOLERANCE</span>", "<span class=\"xref std std-term\">MAX_NUM_VECS</span>", "<span class=\"xref std std-term\">MCSCF_ALGORITHM</span>", "<span class=\"xref std std-term\">MCSCF_CI_CLEANUP</span>", "<span class=\"xref std std-term\">MCSCF_DIIS_ERROR_TYPE</span>", "<span class=\"xref std std-term\">MCSCF_DIIS_FREQ</span>", "<span class=\"xref std std-term\">MCSCF_DIIS_MAX_VECS</span>", "<span class=\"xref std std-term\">MCSCF_DIIS_START</span>", "<span class=\"xref std std-term\">MCSCF_DPD_CLEANUP</span>", "<span class=\"xref std std-term\">MCSCF_E_CONVERGENCE</span>", "<span class=\"xref std std-term\">MCSCF_GUESS</span>", "<span class=\"xref std std-term\">MCSCF_MAX_ROT</span>", "<span class=\"xref std std-term\">MCSCF_MAXITER</span>", "<span class=\"xref std std-term\">MCSCF_R_CONVERGENCE</span>", "<span class=\"xref std std-term\">MCSCF_ROTATE</span>", "<span class=\"xref std std-term\">MCSCF_SO_START_E</span>", "<span class=\"xref std std-term\">MCSCF_SO_START_GRAD</span>", "<span class=\"xref std std-term\">MCSCF_TYPE</span>", "<span class=\"xref std std-term\">MIXED</span>", "<span class=\"xref std std-term\">MIXED4</span>", "<span class=\"xref std std-term\">MPN</span>", "<span class=\"xref std std-term\">MPN_ORDER_SAVE</span>", "<span class=\"xref std std-term\">MPN_SCHMIDT</span>", "<span class=\"xref std std-term\">MPN_WIGNER</span>", "<span class=\"xref std std-term\">MS0</span>", "<span class=\"xref std std-term\">NAT_ORBS</span>", "<span class=\"xref std std-term\">NO_DFILE</span>", "<span class=\"xref std std-term\">NUM_AMPS_PRINT</span>", "<span class=\"xref std std-term\">NUM_DETS_PRINT</span>", "<span class=\"xref std std-term\">NUM_INIT_VECS</span>", "<span class=\"xref std std-term\">NUM_ROOTS</span>", "<span class=\"xref std std-term\">OPDM</span>", "<span class=\"xref std std-term\">PERTURB_MAGNITUDE</span>", "<span class=\"xref std std-term\">PRECONDITIONER</span>", "<span class=\"xref std std-term\">R4S</span>", "<span class=\"xref std std-term\">R_CONVERGENCE</span>", "<span class=\"xref std std-term\">RAS34_MAX</span>", "<span class=\"xref std std-term\">RAS3_MAX</span>", "<span class=\"xref std std-term\">RAS4_MAX</span>", "<span class=\"xref std std-term\">REFERENCE</span>", "<span class=\"xref std std-term\">REFERENCE_SYM</span>", "<span class=\"xref std std-term\">REPL_OTF</span>", "<span class=\"xref std std-term\">RESTART</span>", "<span class=\"xref std std-term\">S</span>", "<span class=\"xref std std-term\">SF_RESTRICT</span>", "<span class=\"xref std std-term\">SIGMA_OVERLAP</span>", "<span class=\"xref std std-term\">TDM</span>", "<span class=\"xref std std-term\">TPDM</span>", "<span class=\"xref std std-term\">UPDATE</span>", "<span class=\"xref std std-term\">VAL_EX_LEVEL</span>", "<span class=\"xref std std-term\">WFN</span>", "<span class=\"xref std std-term\">DF_BASIS_EP2</span>", "<span class=\"xref std std-term\">EP2_CONVERGENCE</span>", "<span class=\"xref std std-term\">EP2_MAXITER</span>", "<span class=\"xref std std-term\">EP2_NUM_EA</span>", "<span class=\"xref std std-term\">EP2_NUM_IP</span>", "<span class=\"xref std std-term\">EP2_ORBITALS</span>", "<span class=\"xref std std-term\">BASIS</span>", "<span class=\"xref std std-term\">DF_BASIS_MP2</span>", "<span class=\"xref std std-term\">DF_INTS_IO</span>", "<span class=\"xref std std-term\">DF_INTS_NUM_THREADS</span>", "<span class=\"xref std std-term\">DFMP2_MEM_FACTOR</span>", "<span class=\"xref std std-term\">DFMP2_P2_TOLERANCE</span>", "<span class=\"xref std std-term\">DFMP2_P_TOLERANCE</span>", "<span class=\"xref std std-term\">INTS_TOLERANCE</span>", "<span class=\"xref std std-term\">MADMP2_SLEEP</span>", "<span class=\"xref std std-term\">MP2_OS_SCALE</span>", "<span class=\"xref std std-term\">MP2_SS_SCALE</span>", "<span class=\"xref std std-term\">ONEPDM</span>", "<span class=\"xref std std-term\">OPDM_RELAX</span>", "<span class=\"xref std std-term\">CC_DIIS_MAX_VECS</span>", "<span class=\"xref std std-term\">CC_DIIS_MIN_VECS</span>", "<span class=\"xref std std-term\">CC_LAMBDA</span>", "<span class=\"xref std std-term\">CC_MAXITER</span>", "<span class=\"xref std std-term\">CHOLESKY</span>", "<span class=\"xref std std-term\">CHOLESKY_TOLERANCE</span>", "<span class=\"xref std std-term\">COMPUT_S2</span>", "<span class=\"xref std std-term\">CUTOFF</span>", "<span class=\"xref std std-term\">DO_DIIS</span>", "<span class=\"xref std std-term\">DO_LEVEL_SHIFT</span>", "<span class=\"xref std std-term\">DO_SCS</span>", "<span class=\"xref std std-term\">DO_SOS</span>", "<span class=\"xref std std-term\">E3_SCALE</span>", "<span class=\"xref std std-term\">E_CONVERGENCE</span>", "<span class=\"xref std std-term\">EKT_IP</span>", "<span class=\"xref std std-term\">HESS_TYPE</span>", "<span class=\"xref std std-term\">INTEGRAL_CUTOFF</span>", "<span class=\"xref std std-term\">LEVEL_SHIFT</span>", "<span class=\"xref std std-term\">LINEQ_SOLVER</span>", "<span class=\"xref std std-term\">MAX_MOGRAD_CONVERGENCE</span>", "<span class=\"xref std std-term\">MO_DIIS_NUM_VECS</span>", "<span class=\"xref std std-term\">MO_MAXITER</span>", "<span class=\"xref std std-term\">MO_STEP_MAX</span>", "<span class=\"xref std std-term\">MOLDEN_WRITE</span>", "<span class=\"xref std std-term\">MP2_AMP_TYPE</span>", "<span class=\"xref std std-term\">MP2_OS_SCALE</span>", "<span class=\"xref std std-term\">MP2_SOS_SCALE</span>", "<span class=\"xref std std-term\">MP2_SOS_SCALE2</span>", "<span class=\"xref std std-term\">MP2_SS_SCALE</span>", "<span class=\"xref std std-term\">NAT_ORBS</span>", "<span class=\"xref std std-term\">OCC_ORBS_PRINT</span>", "<span class=\"xref std std-term\">OEPROP</span>", "<span class=\"xref std std-term\">OO_SCALE</span>", "<span class=\"xref std std-term\">OPT_METHOD</span>", "<span class=\"xref std std-term\">ORB_OPT</span>", "<span class=\"xref std std-term\">ORB_RESP_SOLVER</span>", "<span class=\"xref std std-term\">ORTH_TYPE</span>", "<span class=\"xref std std-term\">PCG_BETA_TYPE</span>", "<span class=\"xref std std-term\">PCG_CONVERGENCE</span>", "<span class=\"xref std std-term\">PCG_MAXITER</span>", "<span class=\"xref std std-term\">PPL_TYPE</span>", "<span class=\"xref std std-term\">QCHF</span>", "<span class=\"xref std std-term\">R_CONVERGENCE</span>", "<span class=\"xref std std-term\">READ_SCF_3INDEX</span>", "<span class=\"xref std std-term\">REG_PARAM</span>", "<span class=\"xref std std-term\">REGULARIZATION</span>", "<span class=\"xref std std-term\">REMP_A</span>", "<span class=\"xref std std-term\">RMS_MOGRAD_CONVERGENCE</span>", "<span class=\"xref std std-term\">SCS_TYPE</span>", "<span class=\"xref std std-term\">SOS_TYPE</span>", "<span class=\"xref std std-term\">TRIPLES_IABC_TYPE</span>", "<span class=\"xref std std-term\">WFN_TYPE</span>", "<span class=\"xref std std-term\">DF_BASIS_MP2</span>", "<span class=\"xref std std-term\">DLPNO_ALGORITHM</span>", "<span class=\"xref std std-term\">DLPNO_LOCAL_ORBITALS</span>", "<span class=\"xref std std-term\">DLPNO_MAXITER</span>", "<span class=\"xref std std-term\">DOI_BASIS_TOLERANCE</span>", "<span class=\"xref std std-term\">DOI_PRUNING_SCHEME</span>", "<span class=\"xref std std-term\">DOI_RADIAL_POINTS</span>", "<span class=\"xref std std-term\">DOI_SPHERICAL_POINTS</span>", "<span class=\"xref std std-term\">E_CONVERGENCE</span>", "<span class=\"xref std std-term\">F_CUT</span>", "<span class=\"xref std std-term\">LOCAL_CONVERGENCE</span>", "<span class=\"xref std std-term\">LOCAL_MAXITER</span>", "<span class=\"xref std std-term\">PNO_CONVERGENCE</span>", "<span class=\"xref std std-term\">R_CONVERGENCE</span>", "<span class=\"xref std std-term\">S_CUT</span>", "<span class=\"xref std std-term\">T_CUT_CLMO</span>", "<span class=\"xref std std-term\">T_CUT_CPAO</span>", "<span class=\"xref std std-term\">T_CUT_DO</span>", "<span class=\"xref std std-term\">T_CUT_DO_IJ</span>", "<span class=\"xref std std-term\">T_CUT_DO_PRE</span>", "<span class=\"xref std std-term\">T_CUT_MKN</span>", "<span class=\"xref std std-term\">T_CUT_PNO</span>", "<span class=\"xref std std-term\">T_CUT_PRE</span>", "<span class=\"xref std std-term\">DMRG_CASPT2_CALC</span>", "<span class=\"xref std std-term\">DMRG_CASPT2_IMAG</span>", "<span class=\"xref std std-term\">DMRG_CASPT2_IPEA</span>", "<span class=\"xref std std-term\">DMRG_CASPT2_ORBS</span>", "<span class=\"xref std std-term\">DMRG_DIIS</span>", "<span class=\"xref std std-term\">DMRG_DIIS_WRITE</span>", "<span class=\"xref std std-term\">DMRG_EXCITATION</span>", "<span class=\"xref std std-term\">DMRG_IRREP</span>", "<span class=\"xref std std-term\">DMRG_LOCAL_INIT</span>", "<span class=\"xref std std-term\">DMRG_MOLDEN_WRITE</span>", "<span class=\"xref std std-term\">DMRG_MPS_WRITE</span>", "<span class=\"xref std std-term\">DMRG_MULTIPLICITY</span>", "<span class=\"xref std std-term\">DMRG_OPDM_AO_PRINT</span>", "<span class=\"xref std std-term\">DMRG_PRINT_CORR</span>", "<span class=\"xref std std-term\">DMRG_SCF_ACTIVE_SPACE</span>", "<span class=\"xref std std-term\">DMRG_SCF_DIIS_THR</span>", "<span class=\"xref std std-term\">DMRG_SCF_GRAD_THR</span>", "<span class=\"xref std std-term\">DMRG_SCF_MAX_ITER</span>", "<span class=\"xref std std-term\">DMRG_SCF_STATE_AVG</span>", "<span class=\"xref std std-term\">DMRG_SWEEP_DVDSON_RTOL</span>", "<span class=\"xref std std-term\">DMRG_SWEEP_ENERGY_CONV</span>", "<span class=\"xref std std-term\">DMRG_SWEEP_MAX_SWEEPS</span>", "<span class=\"xref std std-term\">DMRG_SWEEP_NOISE_PREFAC</span>", "<span class=\"xref std std-term\">DMRG_SWEEP_STATES</span>", "<span class=\"xref std std-term\">DMRG_UNITARY_WRITE</span>", "<span class=\"xref std std-term\">DERTYPE</span>", "<span class=\"xref std std-term\">EFP_DISP</span>", "<span class=\"xref std std-term\">EFP_DISP_DAMPING</span>", "<span class=\"xref std std-term\">EFP_ELST</span>", "<span class=\"xref std std-term\">EFP_ELST_DAMPING</span>", "<span class=\"xref std std-term\">EFP_EXCH</span>", "<span class=\"xref std std-term\">EFP_IND</span>", "<span class=\"xref std std-term\">EFP_IND_DAMPING</span>", "<span class=\"xref std std-term\">EFP_QM_ELST</span>", "<span class=\"xref std std-term\">EFP_QM_IND</span>", "<span class=\"xref std std-term\">PRINT</span>", "<span class=\"xref std std-term\">QMEFP</span>", "<span class=\"xref std std-term\">DISP_SIZE</span>", "<span class=\"xref std std-term\">FD_PROJECT</span>", "<span class=\"xref std std-term\">GRADIENT_WRITE</span>", "<span class=\"xref std std-term\">HESSIAN_WRITE</span>", "<span class=\"xref std std-term\">NORMAL_MODES_WRITE</span>", "<span class=\"xref std std-term\">POINTS</span>", "<span class=\"xref std std-term\">CPHF_R_CONVERGENCE</span>", "<span class=\"xref std std-term\">CUBIC_BASIS_TOLERANCE</span>", "<span class=\"xref std std-term\">CUBIC_BLOCK_MAX_POINTS</span>", "<span class=\"xref std std-term\">CUBIC_GRID_OVERAGE</span>", "<span class=\"xref std std-term\">CUBIC_GRID_SPACING</span>", "<span class=\"xref std std-term\">FISAPT_CHARGE_COMPLETENESS</span>", "<span class=\"xref std std-term\">FISAPT_CUBE_DENSMAT</span>", "<span class=\"xref std std-term\">FISAPT_CUBE_LINKIBOS</span>", "<span class=\"xref std std-term\">FISAPT_CUBE_LINKIHOS</span>", "<span class=\"xref std std-term\">FISAPT_DO_FSAPT</span>", "<span class=\"xref std std-term\">FISAPT_DO_FSAPT_DISP</span>", "<span class=\"xref std std-term\">FISAPT_DO_PLOT</span>", "<span class=\"xref std std-term\">FISAPT_EXCH_PARPERP</span>", "<span class=\"xref std std-term\">FISAPT_FSAPT_EXCH_SCALE</span>", "<span class=\"xref std std-term\">FISAPT_FSAPT_FILEPATH</span>", "<span class=\"xref std std-term\">FISAPT_FSAPT_IND_RESPONSE</span>", "<span class=\"xref std std-term\">FISAPT_FSAPT_IND_SCALE</span>", "<span class=\"xref std std-term\">FISAPT_FSSAPT_FILEPATH</span>", "<span class=\"xref std std-term\">FISAPT_LINK_ASSIGNMENT</span>", "<span class=\"xref std std-term\">FISAPT_LINK_ORTHO</span>", "<span class=\"xref std std-term\">FISAPT_LINK_SELECTION</span>", "<span class=\"xref std std-term\">FISAPT_MANUAL_LINKS</span>", "<span class=\"xref std std-term\">FISAPT_MEM_SAFETY_FACTOR</span>", "<span class=\"xref std std-term\">FISAPT_PLOT_FILEPATH</span>", "<span class=\"xref std std-term\">INTS_TOLERANCE</span>", "<span class=\"xref std std-term\">LOCAL_CONVERGENCE</span>", "<span class=\"xref std std-term\">LOCAL_IBO_CONDITION</span>", "<span class=\"xref std std-term\">LOCAL_IBO_POWER</span>", "<span class=\"xref std std-term\">LOCAL_IBO_STARS</span>", "<span class=\"xref std std-term\">LOCAL_IBO_STARS_COMPLETENESS</span>", "<span class=\"xref std std-term\">LOCAL_IBO_USE_STARS</span>", "<span class=\"xref std std-term\">LOCAL_MAXITER</span>", "<span class=\"xref std std-term\">LOCAL_USE_GHOSTS</span>", "<span class=\"xref std std-term\">MAXITER</span>", "<span class=\"xref std std-term\">MINAO_BASIS</span>", "<span class=\"xref std std-term\">SSAPT0_SCALE</span>", "<span class=\"xref std std-term\">ACTIVE_NAT_ORBS</span>", "<span class=\"xref std std-term\">BRUECKNER_MAXITER</span>", "<span class=\"xref std std-term\">CC_SCALE_OS</span>", "<span class=\"xref std std-term\">CC_SCALE_SS</span>", "<span class=\"xref std std-term\">CC_TIMINGS</span>", "<span class=\"xref std std-term\">CEPA_LEVEL</span>", "<span class=\"xref std std-term\">CEPA_NO_SINGLES</span>", "<span class=\"xref std std-term\">CHOLESKY_TOLERANCE</span>", "<span class=\"xref std std-term\">COMPUTE_MP4_TRIPLES</span>", "<span class=\"xref std std-term\">COMPUTE_TRIPLES</span>", "<span class=\"xref std std-term\">DF_BASIS_CC</span>", "<span class=\"xref std std-term\">DFCC</span>", "<span class=\"xref std std-term\">DIIS_MAX_VECS</span>", "<span class=\"xref std std-term\">DIPMOM</span>", "<span class=\"xref std std-term\">E_CONVERGENCE</span>", "<span class=\"xref std std-term\">MAXITER</span>", "<span class=\"xref std std-term\">MP2_SCALE_OS</span>", "<span class=\"xref std std-term\">MP2_SCALE_SS</span>", "<span class=\"xref std std-term\">NAT_ORBS</span>", "<span class=\"xref std std-term\">OCC_PERCENTAGE</span>", "<span class=\"xref std std-term\">OCC_TOLERANCE</span>", "<span class=\"xref std std-term\">R_CONVERGENCE</span>", "<span class=\"xref std std-term\">RUN_CCSD</span>", "<span class=\"xref std std-term\">RUN_CEPA</span>", "<span class=\"xref std std-term\">RUN_MP2</span>", "<span class=\"xref std std-term\">RUN_MP3</span>", "<span class=\"xref std std-term\">RUN_MP4</span>", "<span class=\"xref std std-term\">SCS_CCSD</span>", "<span class=\"xref std std-term\">SCS_CEPA</span>", "<span class=\"xref std std-term\">SCS_MP2</span>", "<span class=\"xref std std-term\">TRIPLES_LOW_MEMORY</span>", "<span class=\"xref std std-term\">USE_DF_INTS</span>", "<span class=\"xref std std-term\">GDMA_LIMIT</span>", "<span class=\"xref std std-term\">GDMA_MULTIPOLE_UNITS</span>", "<span class=\"xref std std-term\">GDMA_ORIGIN</span>", "<span class=\"xref std std-term\">GDMA_RADIUS</span>", "<span class=\"xref std std-term\">GDMA_SWITCH</span>", "<span class=\"xref std std-term\">ACTIVE</span>", "<span class=\"xref std std-term\">BASIS_RELATIVISTIC</span>", "<span class=\"xref std std-term\">BENCH</span>", "<span class=\"xref std std-term\">BRIANQC_ENABLE</span>", "<span class=\"xref std std-term\">CC_TYPE</span>", "<span class=\"xref std std-term\">CI_TYPE</span>", "<span class=\"xref std std-term\">CUBEPROP_BASIS_FUNCTIONS</span>", "<span class=\"xref std std-term\">CUBEPROP_FILEPATH</span>", "<span class=\"xref std std-term\">CUBEPROP_ISOCONTOUR_THRESHOLD</span>", "<span class=\"xref std std-term\">CUBEPROP_ORBITALS</span>", "<span class=\"xref std std-term\">CUBEPROP_TASKS</span>", "<span class=\"xref std std-term\">CUBIC_BASIS_TOLERANCE</span>", "<span class=\"xref std std-term\">CUBIC_BLOCK_MAX_POINTS</span>", "<span class=\"xref std std-term\">CUBIC_GRID_OVERAGE</span>", "<span class=\"xref std std-term\">CUBIC_GRID_SPACING</span>", "<span class=\"xref std std-term\">DDX</span>", "<span class=\"xref std std-term\">DEBUG</span>", "<span class=\"xref std std-term\">DERTYPE</span>", "<span class=\"xref std std-term\">DF_BASIS_CC</span>", "<span class=\"xref std std-term\">DIE_IF_NOT_CONVERGED</span>", "<span class=\"xref std std-term\">DKH_ORDER</span>", "<span class=\"xref std std-term\">DOCC</span>", "<span class=\"xref std std-term\">EXTERNAL_POTENTIAL_SYMMETRY</span>", "<span class=\"xref std std-term\">FREEZE_CORE</span>", "<span class=\"xref std std-term\">FREEZE_CORE_POLICY</span>", "<span class=\"xref std std-term\">FROZEN_DOCC</span>", "<span class=\"xref std std-term\">FROZEN_UOCC</span>", "<span class=\"xref std std-term\">INTEGRAL_PACKAGE</span>", "<span class=\"xref std std-term\">LITERAL_CFOUR</span>", "<span class=\"xref std std-term\">LS_THC_BASIS_TOLERANCE</span>", "<span class=\"xref std std-term\">LS_THC_DF</span>", "<span class=\"xref std std-term\">LS_THC_PRUNING_SCHEME</span>", "<span class=\"xref std std-term\">LS_THC_RADIAL_POINTS</span>", "<span class=\"xref std std-term\">LS_THC_S_EPSILON</span>", "<span class=\"xref std std-term\">LS_THC_SPHERICAL_POINTS</span>", "<span class=\"xref std std-term\">LS_THC_WEIGHTS_TOLERANCE</span>", "<span class=\"xref std std-term\">MAT_NUM_COLUMN_PRINT</span>", "<span class=\"xref std std-term\">MAX_RADIAL_MOMENT</span>", "<span class=\"xref std std-term\">MBIS_D_CONVERGENCE</span>", "<span class=\"xref std std-term\">MBIS_MAXITER</span>", "<span class=\"xref std std-term\">MBIS_PRUNING_SCHEME</span>", "<span class=\"xref std std-term\">MBIS_RADIAL_POINTS</span>", "<span class=\"xref std std-term\">MBIS_SPHERICAL_POINTS</span>", "<span class=\"xref std std-term\">MOLDEN_WITH_VIRTUAL</span>", "<span class=\"xref std std-term\">MP2_TYPE</span>", "<span class=\"xref std std-term\">MP_TYPE</span>", "<span class=\"xref std std-term\">NUM_FROZEN_DOCC</span>", "<span class=\"xref std std-term\">NUM_FROZEN_UOCC</span>", "<span class=\"xref std std-term\">PARENT_SYMMETRY</span>", "<span class=\"xref std std-term\">PCM</span>", "<span class=\"xref std std-term\">PE</span>", "<span class=\"xref std std-term\">PRINT</span>", "<span class=\"xref std std-term\">PRINT_NOONS</span>", "<span class=\"xref std std-term\">PROPERTIES</span>", "<span class=\"xref std std-term\">PROPERTIES_ORIGIN</span>", "<span class=\"xref std std-term\">PUREAM</span>", "<span class=\"xref std std-term\">QC_MODULE</span>", "<span class=\"xref std std-term\">RAS1</span>", "<span class=\"xref std std-term\">RAS2</span>", "<span class=\"xref std std-term\">RAS3</span>", "<span class=\"xref std std-term\">RAS4</span>", "<span class=\"xref std std-term\">RELATIVISTIC</span>", "<span class=\"xref std std-term\">RESTRICTED_DOCC</span>", "<span class=\"xref std std-term\">RESTRICTED_UOCC</span>", "<span class=\"xref std std-term\">SCF_TYPE</span>", "<span class=\"xref std std-term\">SCREENING</span>", "<span class=\"xref std std-term\">SOCC</span>", "<span class=\"xref std std-term\">WFN</span>", "<span class=\"xref std std-term\">WRITER_FILE_LABEL</span>", "<span class=\"xref std std-term\">CANONICALIZE_ACTIVE_FAVG</span>", "<span class=\"xref std std-term\">CANONICALIZE_INACTIVE_FAVG</span>", "<span class=\"xref std std-term\">CI_DIIS</span>", "<span class=\"xref std std-term\">D_CONVERGENCE</span>", "<span class=\"xref std std-term\">DIIS</span>", "<span class=\"xref std std-term\">DIIS_MAX_VECS</span>", "<span class=\"xref std std-term\">DOCC</span>", "<span class=\"xref std std-term\">E_CONVERGENCE</span>", "<span class=\"xref std std-term\">FAVG</span>", "<span class=\"xref std std-term\">FAVG_START</span>", "<span class=\"xref std std-term\">FOLLOW_ROOT</span>", "<span class=\"xref std std-term\">FORCE_TWOCON</span>", "<span class=\"xref std std-term\">INTERNAL_ROTATIONS</span>", "<span class=\"xref std std-term\">LEVEL_SHIFT</span>", "<span class=\"xref std std-term\">MAXITER</span>", "<span class=\"xref std std-term\">MO_READ</span>", "<span class=\"xref std std-term\">REFERENCE</span>", "<span class=\"xref std std-term\">ROTATE_MO_ANGLE</span>", "<span class=\"xref std std-term\">ROTATE_MO_IRREP</span>", "<span class=\"xref std std-term\">ROTATE_MO_P</span>", "<span class=\"xref std std-term\">ROTATE_MO_Q</span>", "<span class=\"xref std std-term\">SOCC</span>", "<span class=\"xref std std-term\">TURN_ON_ACTV</span>", "<span class=\"xref std std-term\">WFN_SYM</span>", "<span class=\"xref std std-term\">BASIS</span>", "<span class=\"xref std std-term\">OMEGA_ERF</span>", "ADC", "CCDENSITY", "CCENERGY", "CCEOM", "CCHBAR", "CCLAMBDA", "CCRESPONSE", "CCTRANSORT", "CCTRIPLES", "CFOUR", "CPHF", "DCT", "DDX", "DETCI", "DFEP2", "DFMP2", "DFOCC", "DLPNO", "DMRG", "EFP", "FINDIF", "FISAPT", "FNOCC", "GDMA", "GLOBALS", "MCSCF", "MINTS", "MRCC", "OCC", "OPTKING", "PCM", "PE", "PSIMRCC", "SAPT", "SCF", "THERMO", "<span class=\"xref std std-term\">E_CONVERGENCE</span>", "<span class=\"xref std std-term\">INTS_TOLERANCE</span>", "<span class=\"xref std std-term\">MRCC_LEVEL</span>", "<span class=\"xref std std-term\">MRCC_METHOD</span>", "<span class=\"xref std std-term\">MRCC_NUM_DOUBLET_ROOTS</span>", "<span class=\"xref std std-term\">MRCC_NUM_SINGLET_ROOTS</span>", "<span class=\"xref std std-term\">MRCC_NUM_TRIPLET_ROOTS</span>", "<span class=\"xref std std-term\">MRCC_OMP_NUM_THREADS</span>", "<span class=\"xref std std-term\">MRCC_RESTART</span>", "<span class=\"xref std std-term\">CACHELEVEL</span>", "<span class=\"xref std std-term\">CC_MAXITER</span>", "<span class=\"xref std std-term\">CCL_ENERGY</span>", "<span class=\"xref std std-term\">CEPA_OS_SCALE</span>", "<span class=\"xref std std-term\">CEPA_SOS_SCALE</span>", "<span class=\"xref std std-term\">CEPA_SS_SCALE</span>", "<span class=\"xref std std-term\">CEPA_TYPE</span>", "<span class=\"xref std std-term\">CUTOFF</span>", "<span class=\"xref std std-term\">DIIS_MAX_VECS</span>", "<span class=\"xref std std-term\">DIIS_MIN_VECS</span>", "<span class=\"xref std std-term\">DO_DIIS</span>", "<span class=\"xref std std-term\">DO_LEVEL_SHIFT</span>", "<span class=\"xref std std-term\">DO_SCS</span>", "<span class=\"xref std std-term\">DO_SOS</span>", "<span class=\"xref std std-term\">E3_SCALE</span>", "<span class=\"xref std std-term\">E_CONVERGENCE</span>", "<span class=\"xref std std-term\">EA_POLES</span>", "<span class=\"xref std std-term\">EKT_EA</span>", "<span class=\"xref std std-term\">EKT_IP</span>", "<span class=\"xref std std-term\">EP_EA_POLES</span>", "<span class=\"xref std std-term\">EP_IP_POLES</span>", "<span class=\"xref std std-term\">EP_MAXITER</span>", "<span class=\"xref std std-term\">IP_POLES</span>", "<span class=\"xref std std-term\">LEVEL_SHIFT</span>", "<span class=\"xref std std-term\">MAX_MOGRAD_CONVERGENCE</span>", "<span class=\"xref std std-term\">MO_MAXITER</span>", "<span class=\"xref std std-term\">MO_READ</span>", "<span class=\"xref std std-term\">MO_STEP_MAX</span>", "<span class=\"xref std std-term\">MO_WRITE</span>", "<span class=\"xref std std-term\">MOGRAD_DAMPING</span>", "<span class=\"xref std std-term\">MP2_OS_SCALE</span>", "<span class=\"xref std std-term\">MP2_SOS_SCALE</span>", "<span class=\"xref std std-term\">MP2_SOS_SCALE2</span>", "<span class=\"xref std std-term\">MP2_SS_SCALE</span>", "<span class=\"xref std std-term\">NAT_ORBS</span>", "<span class=\"xref std std-term\">OCC_ORBS_PRINT</span>", "<span class=\"xref std std-term\">OEPROP</span>", "<span class=\"xref std std-term\">OPT_METHOD</span>", "<span class=\"xref std std-term\">ORB_OPT</span>", "<span class=\"xref std std-term\">ORB_RESP_SOLVER</span>", "<span class=\"xref std std-term\">ORTH_TYPE</span>", "<span class=\"xref std std-term\">OS_SCALE</span>", "<span class=\"xref std std-term\">PCG_BETA_TYPE</span>", "<span class=\"xref std std-term\">PCG_CONVERGENCE</span>", "<span class=\"xref std std-term\">PCG_MAXITER</span>", "<span class=\"xref std std-term\">R_CONVERGENCE</span>", "<span class=\"xref std std-term\">RELAXED</span>", "<span class=\"xref std std-term\">REMP_A</span>", "<span class=\"xref std std-term\">RMS_MOGRAD_CONVERGENCE</span>", "<span class=\"xref std std-term\">SCS_TYPE</span>", "<span class=\"xref std std-term\">SOS_TYPE</span>", "<span class=\"xref std std-term\">SPIN_SCALE_TYPE</span>", "<span class=\"xref std std-term\">SS_SCALE</span>", "<span class=\"xref std std-term\">SYMMETRIZE</span>", "<span class=\"xref std std-term\">TPDM_ABCD_TYPE</span>", "<span class=\"xref std std-term\">WFN_TYPE</span>", "<span class=\"xref std std-term\">ADD_AUXILIARY_BONDS</span>", "<span class=\"xref std std-term\">AUXILIARY_BOND_FACTOR</span>", "<span class=\"xref std std-term\">CART_HESS_READ</span>", "<span class=\"xref std std-term\">CARTESIAN_SYM_TOLERANCE</span>", "<span class=\"xref std std-term\">CONSECUTIVE_BACKSTEPS</span>", "<span class=\"xref std std-term\">COVALENT_CONNECT</span>", "<span class=\"xref std std-term\">CUSTOM_COORDS</span>", "<span class=\"xref std std-term\">DYNAMIC_LEVEL</span>", "<span class=\"xref std std-term\">ENSURE_BT_CONVERGENCE</span>", "<span class=\"xref std std-term\">EXT_FORCE_BEND</span>", "<span class=\"xref std std-term\">EXT_FORCE_CARTESIAN</span>", "<span class=\"xref std std-term\">EXT_FORCE_DIHEDRAL</span>", "<span class=\"xref std std-term\">EXT_FORCE_DISTANCE</span>", "<span class=\"xref std std-term\">EXT_FORCE_OOFP</span>", "<span class=\"xref std std-term\">FLEXIBLE_G_CONVERGENCE</span>", "<span class=\"xref std std-term\">FRAG_MODE</span>", "<span class=\"xref std std-term\">FRAG_REF_ATOMS</span>", "<span class=\"xref std std-term\">FREEZE_ALL_DIHEDRALS</span>", "<span class=\"xref std std-term\">FREEZE_INTERFRAG</span>", "<span class=\"xref std std-term\">FREEZE_INTRAFRAG</span>", "<span class=\"xref std std-term\">FROZEN_BEND</span>", "<span class=\"xref std std-term\">FROZEN_CARTESIAN</span>", "<span class=\"xref std std-term\">FROZEN_DIHEDRAL</span>", "<span class=\"xref std std-term\">FROZEN_DISTANCE</span>", "<span class=\"xref std std-term\">FROZEN_OOFP</span>", "<span class=\"xref std std-term\">FULL_HESS_EVERY</span>", "<span class=\"xref std std-term\">G_CONVERGENCE</span>", "<span class=\"xref std std-term\">GEOM_MAXITER</span>", "<span class=\"xref std std-term\">H_BOND_CONNECT</span>", "<span class=\"xref std std-term\">H_GUESS_EVERY</span>", "<span class=\"xref std std-term\">H_UPDATE_DEN_TOL</span>", "<span class=\"xref std std-term\">HESS_UPDATE</span>", "<span class=\"xref std std-term\">HESS_UPDATE_LIMIT</span>", "<span class=\"xref std std-term\">HESS_UPDATE_LIMIT_MAX</span>", "<span class=\"xref std std-term\">HESS_UPDATE_LIMIT_SCALE</span>", "<span class=\"xref std std-term\">HESS_UPDATE_USE_LAST</span>", "<span class=\"xref std std-term\">INTCOS_GENERATE_EXIT</span>", "<span class=\"xref std std-term\">INTERFRAG_COLLINEAR_TOL</span>", "<span class=\"xref std std-term\">INTERFRAG_COORDS</span>", "<span class=\"xref std std-term\">INTERFRAG_DIST_INV</span>", "<span class=\"xref std std-term\">INTERFRAG_HESS</span>", "<span class=\"xref std std-term\">INTERFRAG_MODE</span>", "<span class=\"xref std std-term\">INTERFRAG_STEP_LIMIT</span>", "<span class=\"xref std std-term\">INTERFRAGMENT_CONNECT</span>", "<span class=\"xref std std-term\">INTRAFRAG_HESS</span>", "<span class=\"xref std std-term\">INTRAFRAG_STEP_LIMIT</span>", "<span class=\"xref std std-term\">INTRAFRAG_STEP_LIMIT_MAX</span>", "<span class=\"xref std std-term\">INTRAFRAG_STEP_LIMIT_MIN</span>", "<span class=\"xref std std-term\">IRC_DIRECTION</span>", "<span class=\"xref std std-term\">IRC_POINTS</span>", "<span class=\"xref std std-term\">IRC_STEP_SIZE</span>", "<span class=\"xref std std-term\">MAX_DISP_G_CONVERGENCE</span>", "<span class=\"xref std std-term\">MAX_ENERGY_G_CONVERGENCE</span>", "<span class=\"xref std std-term\">MAX_FORCE_G_CONVERGENCE</span>", "<span class=\"xref std std-term\">OPT_COORDINATES</span>", "<span class=\"xref std std-term\">OPT_RESTART</span>", "<span class=\"xref std std-term\">OPT_TYPE</span>", "<span class=\"xref std std-term\">PRINT_OPT_PARAMS</span>", "<span class=\"xref std std-term\">PRINT_TRAJECTORY_XYZ_FILE</span>", "<span class=\"xref std std-term\">RANGED_BEND</span>", "<span class=\"xref std std-term\">RANGED_DIHEDRAL</span>", "<span class=\"xref std std-term\">RANGED_DISTANCE</span>", "<span class=\"xref std std-term\">RANGED_OOFP</span>", "<span class=\"xref std std-term\">RFO_FOLLOW_ROOT</span>", "<span class=\"xref std std-term\">RFO_NORMALIZATION_MAX</span>", "<span class=\"xref std std-term\">RFO_ROOT</span>", "<span class=\"xref std std-term\">RMS_DISP_G_CONVERGENCE</span>", "<span class=\"xref std std-term\">RMS_FORCE_G_CONVERGENCE</span>", "<span class=\"xref std std-term\">RSRFO_ALPHA_MAX</span>", "<span class=\"xref std std-term\">SAVE_OPTIMIZATION</span>", "<span class=\"xref std std-term\">STEP_TYPE</span>", "<span class=\"xref std std-term\">TEST_B</span>", "<span class=\"xref std std-term\">TEST_DERIVATIVE_B</span>", "<span class=\"xref std std-term\">UNFREEZE_DIHEDRALS</span>", "<span class=\"xref std std-term\">WRITE_OPT_HISTORY</span>", "<span class=\"xref std std-term\">WRITE_OPT_RESULT</span>", "<span class=\"xref std std-term\">WRITE_TRAJECTORY</span>", "<span class=\"xref std std-term\">PCM_CC_TYPE</span>", "<span class=\"xref std std-term\">PCM_SCF_TYPE</span>", "<span class=\"xref std std-term\">PCMSOLVER_PARSED_FNAME</span>", "<span class=\"xref std std-term\">BORDER</span>", "<span class=\"xref std std-term\">BORDER_N_REDIST</span>", "<span class=\"xref std std-term\">BORDER_REDIST_ORDER</span>", "<span class=\"xref std std-term\">BORDER_REDIST_POL</span>", "<span class=\"xref std std-term\">BORDER_RMIN</span>", "<span class=\"xref std std-term\">BORDER_RMIN_UNIT</span>", "<span class=\"xref std std-term\">BORDER_TYPE</span>", "<span class=\"xref std std-term\">DAMP_INDUCED</span>", "<span class=\"xref std std-term\">DAMP_MULTIPOLE</span>", "<span class=\"xref std std-term\">DAMPING_FACTOR_INDUCED</span>", "<span class=\"xref std std-term\">DAMPING_FACTOR_MULTIPOLE</span>", "<span class=\"xref std std-term\">INDUCED_CONVERGENCE</span>", "<span class=\"xref std std-term\">ISOTROPIC_POL</span>", "<span class=\"xref std std-term\">MAXITER</span>", "<span class=\"xref std std-term\">PE_ECP</span>", "<span class=\"xref std std-term\">POTFILE</span>", "<span class=\"xref std std-term\">SUMMATION_FIELDS</span>", "<span class=\"xref std std-term\">TREE_EXPANSION_ORDER</span>", "<span class=\"xref std std-term\">TREE_THETA</span>", "<span class=\"xref std std-term\">CC_NUM_THREADS</span>", "<span class=\"xref std std-term\">CORR_ANSATZ</span>", "<span class=\"xref std std-term\">CORR_CCSD_T</span>", "<span class=\"xref std std-term\">CORR_CHARGE</span>", "<span class=\"xref std std-term\">CORR_MULTP</span>", "<span class=\"xref std std-term\">CORR_WFN</span>", "<span class=\"xref std std-term\">COUPLING</span>", "<span class=\"xref std std-term\">COUPLING_TERMS</span>", "<span class=\"xref std std-term\">DAMPING_PERCENTAGE</span>", "<span class=\"xref std std-term\">DIAGONAL_CCSD_T</span>", "<span class=\"xref std std-term\">DIAGONALIZE_HEFF</span>", "<span class=\"xref std std-term\">DIIS_MAX_VECS</span>", "<span class=\"xref std std-term\">DIIS_START</span>", "<span class=\"xref std std-term\">E_CONVERGENCE</span>", "<span class=\"xref std std-term\">FAVG_CCSD_T</span>", "<span class=\"xref std std-term\">FOLLOW_ROOT</span>", "<span class=\"xref std std-term\">HEFF4</span>", "<span class=\"xref std std-term\">HEFF_PRINT</span>", "<span class=\"xref std std-term\">LOCK_SINGLET</span>", "<span class=\"xref std std-term\">MAXITER</span>", "<span class=\"xref std std-term\">MP2_CCSD_METHOD</span>", "<span class=\"xref std std-term\">MP2_GUESS</span>", "<span class=\"xref std std-term\">NO_SINGLES</span>", "<span class=\"xref std std-term\">OFFDIAGONAL_CCSD_T</span>", "<span class=\"xref std std-term\">PERTURB_CBS</span>", "<span class=\"xref std std-term\">PERTURB_CBS_COUPLING</span>", "<span class=\"xref std std-term\">PT_ENERGY</span>", "<span class=\"xref std std-term\">R_CONVERGENCE</span>", "<span class=\"xref std std-term\">SMALL_CUTOFF</span>", "<span class=\"xref std std-term\">TIKHONOW_MAX</span>", "<span class=\"xref std std-term\">TIKHONOW_OMEGA</span>", "<span class=\"xref std std-term\">TIKHONOW_TRIPLES</span>", "<span class=\"xref std std-term\">TRIPLES_ALGORITHM</span>", "<span class=\"xref std std-term\">TRIPLES_DIIS</span>", "<span class=\"xref std std-term\">USE_SPIN_SYM</span>", "<span class=\"xref std std-term\">USE_SPIN_SYMMETRY</span>", "<span class=\"xref std std-term\">WFN_SYM</span>", "<span class=\"xref std std-term\">ZERO_INTERNAL_AMPS</span>", "<span class=\"xref std std-term\">AIO_CPHF</span>", "<span class=\"xref std std-term\">AIO_DF_INTS</span>", "<span class=\"xref std std-term\">BASIS</span>", "<span class=\"xref std std-term\">CCD_E_CONVERGENCE</span>", "<span class=\"xref std std-term\">CCD_MAXITER</span>", "<span class=\"xref std std-term\">CCD_T_CONVERGENCE</span>", "<span class=\"xref std std-term\">COUPLED_INDUCTION</span>", "<span class=\"xref std std-term\">CPHF_R_CONVERGENCE</span>", "<span class=\"xref std std-term\">DENOMINATOR_ALGORITHM</span>", "<span class=\"xref std std-term\">DENOMINATOR_DELTA</span>", "<span class=\"xref std std-term\">DF_BASIS_ELST</span>", "<span class=\"xref std std-term\">DF_BASIS_SAPT</span>", "<span class=\"xref std std-term\">DO_CCD_DISP</span>", "<span class=\"xref std std-term\">DO_DISP_EXCH_SINF</span>", "<span class=\"xref std std-term\">DO_IND30_EXCH_SINF</span>", "<span class=\"xref std std-term\">DO_IND_EXCH_SINF</span>", "<span class=\"xref std std-term\">DO_MBPT_DISP</span>", "<span class=\"xref std std-term\">DO_THIRD_ORDER</span>", "<span class=\"xref std std-term\">EXCH_SCALE_ALPHA</span>", "<span class=\"xref std std-term\">FREEZE_CORE</span>", "<span class=\"xref std std-term\">INTS_TOLERANCE</span>", "<span class=\"xref std std-term\">MAX_CCD_DIISVECS</span>", "<span class=\"xref std std-term\">MAXITER</span>", "<span class=\"xref std std-term\">MIN_CCD_DIISVECS</span>", "<span class=\"xref std std-term\">NAT_ORBS_T2</span>", "<span class=\"xref std std-term\">NAT_ORBS_T3</span>", "<span class=\"xref std std-term\">NAT_ORBS_V4</span>", "<span class=\"xref std std-term\">OCC_TOLERANCE</span>", "<span class=\"xref std std-term\">PRINT</span>", "<span class=\"xref std std-term\">SAPT0_E10</span>", "<span class=\"xref std std-term\">SAPT0_E20DISP</span>", "<span class=\"xref std std-term\">SAPT0_E20IND</span>", "<span class=\"xref std std-term\">SAPT_DFT_DO_DHF</span>", "<span class=\"xref std std-term\">SAPT_DFT_DO_HYBRID</span>", "<span class=\"xref std std-term\">SAPT_DFT_EXCH_DISP_FIXED_SCALE</span>", "<span class=\"xref std std-term\">SAPT_DFT_EXCH_DISP_SCALE_SCHEME</span>", "<span class=\"xref std std-term\">SAPT_DFT_FUNCTIONAL</span>", "<span class=\"xref std std-term\">SAPT_DFT_GRAC_DETERMINATION</span>", "<span class=\"xref std std-term\">SAPT_DFT_GRAC_SHIFT_A</span>", "<span class=\"xref std std-term\">SAPT_DFT_GRAC_SHIFT_B</span>", "<span class=\"xref std std-term\">SAPT_DFT_MP2_DISP_ALG</span>", "<span class=\"xref std std-term\">SAPT_FDDS_DISP_LEG_LAMBDA</span>", "<span class=\"xref std std-term\">SAPT_FDDS_DISP_NUM_POINTS</span>", "<span class=\"xref std std-term\">SAPT_FDDS_V2_RHO_CUTOFF</span>", "<span class=\"xref std std-term\">SAPT_LEVEL</span>", "<span class=\"xref std std-term\">SAPT_MEM_CHECK</span>", "<span class=\"xref std std-term\">SAPT_MEM_FACTOR</span>", "<span class=\"xref std std-term\">SAPT_MEM_SAFETY</span>", "<span class=\"xref std std-term\">SAPT_QUIET</span>", "<span class=\"xref std std-term\">BASIS</span>", "<span class=\"xref std std-term\">BASIS_GUESS</span>", "<span class=\"xref std std-term\">CHOLESKY_TOLERANCE</span>", "<span class=\"xref std std-term\">COSX_BASIS_TOLERANCE</span>", "<span class=\"xref std std-term\">COSX_DENSITY_TOLERANCE</span>", "<span class=\"xref std std-term\">COSX_INTS_TOLERANCE</span>", "<span class=\"xref std std-term\">COSX_MAXITER_FINAL</span>", "<span class=\"xref std std-term\">COSX_OVERLAP_FITTING</span>", "<span class=\"xref std std-term\">COSX_PRUNING_SCHEME</span>", "<span class=\"xref std std-term\">COSX_RADIAL_POINTS_FINAL</span>", "<span class=\"xref std std-term\">COSX_RADIAL_POINTS_INITIAL</span>", "<span class=\"xref std std-term\">COSX_SPHERICAL_POINTS_FINAL</span>", "<span class=\"xref std std-term\">COSX_SPHERICAL_POINTS_INITIAL</span>", "<span class=\"xref std std-term\">D_CONVERGENCE</span>", "<span class=\"xref std std-term\">DAMPING_CONVERGENCE</span>", "<span class=\"xref std std-term\">DAMPING_PERCENTAGE</span>", "<span class=\"xref std std-term\">DF_BASIS_GUESS</span>", "<span class=\"xref std std-term\">DF_BASIS_SAD</span>", "<span class=\"xref std std-term\">DF_BASIS_SCF</span>", "<span class=\"xref std std-term\">DF_BUMP_R0</span>", "<span class=\"xref std std-term\">DF_BUMP_R1</span>", "<span class=\"xref std std-term\">DF_DOMAINS</span>", "<span class=\"xref std std-term\">DF_FITTING_CONDITION</span>", "<span class=\"xref std std-term\">DF_INTS_IO</span>", "<span class=\"xref std std-term\">DF_INTS_NUM_THREADS</span>", "<span class=\"xref std std-term\">DF_METRIC</span>", "<span class=\"xref std std-term\">DF_SCF_GUESS</span>", "<span class=\"xref std std-term\">DF_THETA</span>", "<span class=\"xref std std-term\">DFT_ALPHA</span>", "<span class=\"xref std std-term\">DFT_ALPHA_C</span>", "<span class=\"xref std std-term\">DFT_BASIS_TOLERANCE</span>", "<span class=\"xref std std-term\">DFT_BLOCK_MAX_POINTS</span>", "<span class=\"xref std std-term\">DFT_BLOCK_MAX_RADIUS</span>", "<span class=\"xref std std-term\">DFT_BLOCK_MIN_POINTS</span>", "<span class=\"xref std std-term\">DFT_BLOCK_SCHEME</span>", "<span class=\"xref std std-term\">DFT_BS_RADIUS_ALPHA</span>", "<span class=\"xref std std-term\">DFT_DENSITY_TOLERANCE</span>", "<span class=\"xref std std-term\">DFT_DISPERSION_PARAMETERS</span>", "<span class=\"xref std std-term\">DFT_GRAC_ALPHA</span>", "<span class=\"xref std std-term\">DFT_GRAC_BETA</span>", "<span class=\"xref std std-term\">DFT_GRAC_C_FUNC</span>", "<span class=\"xref std std-term\">DFT_GRAC_SHIFT</span>", "<span class=\"xref std std-term\">DFT_GRAC_X_FUNC</span>", "<span class=\"xref std std-term\">DFT_GRID_NAME</span>", "<span class=\"xref std std-term\">DFT_NUCLEAR_SCHEME</span>", "<span class=\"xref std std-term\">DFT_OMEGA</span>", "<span class=\"xref std std-term\">DFT_OMEGA_C</span>", "<span class=\"xref std std-term\">DFT_PRUNING_ALPHA</span>", "<span class=\"xref std std-term\">DFT_PRUNING_SCHEME</span>", "<span class=\"xref std std-term\">DFT_RADIAL_POINTS</span>", "<span class=\"xref std std-term\">DFT_RADIAL_SCHEME</span>", "<span class=\"xref std std-term\">DFT_REMOVE_DISTANT_POINTS</span>", "<span class=\"xref std std-term\">DFT_SPHERICAL_POINTS</span>", "<span class=\"xref std std-term\">DFT_SPHERICAL_SCHEME</span>", "<span class=\"xref std std-term\">DFT_V2_RHO_CUTOFF</span>", "<span class=\"xref std std-term\">DFT_VV10_B</span>", "<span class=\"xref std std-term\">DFT_VV10_C</span>", "<span class=\"xref std std-term\">DFT_VV10_POSTSCF</span>", "<span class=\"xref std std-term\">DFT_VV10_RADIAL_POINTS</span>", "<span class=\"xref std std-term\">DFT_VV10_RHO_CUTOFF</span>", "<span class=\"xref std std-term\">DFT_VV10_SPHERICAL_POINTS</span>", "<span class=\"xref std std-term\">DFT_WEIGHTS_TOLERANCE</span>", "<span class=\"xref std std-term\">DIIS</span>", "<span class=\"xref std std-term\">DIIS_MAX_VECS</span>", "<span class=\"xref std std-term\">DIIS_MIN_VECS</span>", "<span class=\"xref std std-term\">DIIS_RMS_ERROR</span>", "<span class=\"xref std std-term\">DIIS_START</span>", "<span class=\"xref std std-term\">DISTRIBUTED_MATRIX</span>", "<span class=\"xref std std-term\">E_CONVERGENCE</span>", "<span class=\"xref std std-term\">EXTERN</span>", "<span class=\"xref std std-term\">FAIL_ON_MAXITER</span>", "<span class=\"xref std std-term\">FOLLOW_STEP_INCREMENT</span>", "<span class=\"xref std std-term\">FOLLOW_STEP_SCALE</span>", "<span class=\"xref std std-term\">FRAC_DIIS</span>", "<span class=\"xref std std-term\">FRAC_LOAD</span>", "<span class=\"xref std std-term\">FRAC_OCC</span>", "<span class=\"xref std std-term\">FRAC_RENORMALIZE</span>", "<span class=\"xref std std-term\">FRAC_START</span>", "<span class=\"xref std std-term\">FRAC_VAL</span>", "<span class=\"xref std std-term\">GUESS</span>", "<span class=\"xref std std-term\">GUESS_MIX</span>", "<span class=\"xref std std-term\">GUESS_PERSIST</span>", "<span class=\"xref std std-term\">INCFOCK</span>", "<span class=\"xref std std-term\">INCFOCK_CONVERGENCE</span>", "<span class=\"xref std std-term\">INCFOCK_FULL_FOCK_EVERY</span>", "<span class=\"xref std std-term\">INTS_TOLERANCE</span>", "<span class=\"xref std std-term\">LEVEL_SHIFT</span>", "<span class=\"xref std std-term\">LEVEL_SHIFT_CUTOFF</span>", "<span class=\"xref std std-term\">LINK_INTS_TOLERANCE</span>", "<span class=\"xref std std-term\">LOCAL_CONVERGENCE</span>", "<span class=\"xref std std-term\">LOCAL_MAXITER</span>", "<span class=\"xref std std-term\">MAX_ATTEMPTS</span>", "<span class=\"xref std std-term\">MAX_MEM_BUF</span>", "<span class=\"xref std std-term\">MAXITER</span>", "<span class=\"xref std std-term\">MOLDEN_WRITE</span>", "<span class=\"xref std std-term\">MOM_OCC</span>", "<span class=\"xref std std-term\">MOM_START</span>", "<span class=\"xref std std-term\">MOM_VIR</span>", "<span class=\"xref std std-term\">NL_DISPERSION_PARAMETERS</span>", "<span class=\"xref std std-term\">ONEPOT_GRID_READ</span>", "<span class=\"xref std std-term\">ORBITALS_WRITE</span>", "<span class=\"xref std std-term\">PARALLEL</span>", "<span class=\"xref std std-term\">PERTURB_DIPOLE</span>", "<span class=\"xref std std-term\">PERTURB_H</span>", "<span class=\"xref std std-term\">PERTURB_MAGNITUDE</span>", "<span class=\"xref std std-term\">PERTURB_WITH</span>", "<span class=\"xref std std-term\">PHI_POINTS</span>", "<span class=\"xref std std-term\">PK_ALL_NONSYM</span>", "<span class=\"xref std std-term\">PK_MAX_BUCKETS</span>", "<span class=\"xref std std-term\">PRINT_BASIS</span>", "<span class=\"xref std std-term\">PRINT_MOS</span>", "<span class=\"xref std std-term\">PROCESS_GRID</span>", "<span class=\"xref std std-term\">QCHF</span>", "<span class=\"xref std std-term\">R_POINTS</span>", "<span class=\"xref std std-term\">RADIUS</span>", "<span class=\"xref std std-term\">REFERENCE</span>", "<span class=\"xref std std-term\">S_CHOLESKY_TOLERANCE</span>", "<span class=\"xref std std-term\">S_ORTHOGONALIZATION</span>", "<span class=\"xref std std-term\">S_TOLERANCE</span>", "<span class=\"xref std std-term\">SAD_CHOL_TOLERANCE</span>", "<span class=\"xref std std-term\">SAD_D_CONVERGENCE</span>", "<span class=\"xref std std-term\">SAD_E_CONVERGENCE</span>", "<span class=\"xref std std-term\">SAD_FRAC_OCC</span>", "<span class=\"xref std std-term\">SAD_MAXITER</span>", "<span class=\"xref std std-term\">SAD_PRINT</span>", "<span class=\"xref std std-term\">SAD_SCF_TYPE</span>", "<span class=\"xref std std-term\">SAD_SPIN_AVERAGE</span>", "<span class=\"xref std std-term\">SAPGAU_BASIS</span>", "<span class=\"xref std std-term\">SAPT</span>", "<span class=\"xref std std-term\">SAVE_JK</span>", "<span class=\"xref std std-term\">SAVE_UHF_NOS</span>", "<span class=\"xref std std-term\">SCF_INITIAL_ACCELERATOR</span>", "<span class=\"xref std std-term\">SCF_INITIAL_FINISH_DIIS_TRANSITION</span>", "<span class=\"xref std std-term\">SCF_INITIAL_START_DIIS_TRANSITION</span>", "<span class=\"xref std std-term\">SCF_MEM_SAFETY_FACTOR</span>", "<span class=\"xref std std-term\">SCF_PROPERTIES</span>", "<span class=\"xref std std-term\">SCF_SUBTYPE</span>", "<span class=\"xref std std-term\">SNLINK_BASIS_TOLERANCE</span>", "<span class=\"xref std std-term\">SNLINK_DENSITY_TOLERANCE</span>", "<span class=\"xref std std-term\">SNLINK_FORCE_CARTESIAN</span>", "<span class=\"xref std std-term\">SNLINK_GPU_MEM</span>", "<span class=\"xref std std-term\">SNLINK_GRID_BATCH_SIZE</span>", "<span class=\"xref std std-term\">SNLINK_INTEGRATOR_KERNEL</span>", "<span class=\"xref std std-term\">SNLINK_INTS_TOLERANCE</span>", "<span class=\"xref std std-term\">SNLINK_LOAD_BALANCER_KERNEL</span>", "<span class=\"xref std std-term\">SNLINK_LWD_KERNEL</span>", "<span class=\"xref std std-term\">SNLINK_MOL_WEIGHTS_KERNEL</span>", "<span class=\"xref std std-term\">SNLINK_PRUNING_SCHEME</span>", "<span class=\"xref std std-term\">SNLINK_RADIAL_POINTS</span>", "<span class=\"xref std std-term\">SNLINK_RADIAL_SCHEME</span>", "<span class=\"xref std std-term\">SNLINK_REDUCTION_KERNEL</span>", "<span class=\"xref std std-term\">SNLINK_SPHERICAL_POINTS</span>", "<span class=\"xref std std-term\">SNLINK_USE_DEBUG_GRID</span>", "<span class=\"xref std std-term\">SNLINK_USE_GPU</span>", "<span class=\"xref std std-term\">SOLVER_CONVERGENCE</span>", "<span class=\"xref std std-term\">SOLVER_MAXITER</span>", "<span class=\"xref std std-term\">SOLVER_N_GUESS</span>", "<span class=\"xref std std-term\">SOLVER_N_ROOT</span>", "<span class=\"xref std std-term\">SOLVER_ROOTS_PER_IRREP</span>", "<span class=\"xref std std-term\">SOSCF</span>", "<span class=\"xref std std-term\">SOSCF_CONV</span>", "<span class=\"xref std std-term\">SOSCF_MAX_ITER</span>", "<span class=\"xref std std-term\">SOSCF_MIN_ITER</span>", "<span class=\"xref std std-term\">SOSCF_PRINT</span>", "<span class=\"xref std std-term\">SOSCF_START_CONVERGENCE</span>", "<span class=\"xref std std-term\">STABILITY_ANALYSIS</span>", "<span class=\"xref std std-term\">TDSCF_COEFF_CUTOFF</span>", "<span class=\"xref std std-term\">TDSCF_GUESS</span>", "<span class=\"xref std std-term\">TDSCF_MAXITER</span>", "<span class=\"xref std std-term\">TDSCF_PRINT</span>", "<span class=\"xref std std-term\">TDSCF_R_CONVERGENCE</span>", "<span class=\"xref std std-term\">TDSCF_STATES</span>", "<span class=\"xref std std-term\">TDSCF_TDA</span>", "<span class=\"xref std std-term\">TDSCF_TDM_PRINT</span>", "<span class=\"xref std std-term\">TDSCF_TRIPLETS</span>", "<span class=\"xref std std-term\">THETA_POINTS</span>", "<span class=\"xref std std-term\">THICKNESS</span>", "<span class=\"xref std std-term\">TILE_SZ</span>", "<span class=\"xref std std-term\">UHF_NOONS</span>", "<span class=\"xref std std-term\">WCOMBINE</span>", "<span class=\"xref std std-term\">WFN</span>", "<span class=\"xref std std-term\">P</span>", "<span class=\"xref std std-term\">ROTATIONAL_SYMMETRY_NUMBER</span>", "<span class=\"xref std std-term\">T</span>", "ADC", "CCENERGY", "CFOUR", "DCT", "DDX", "DETCI", "DFMP2", "DFOCC", "DLPNO", "DMRG", "EFP", "FISAPT", "FNOCC", "GDMA", "MCSCF", "MRCC", "OCC", "OEPROP", "PCM", "PE", "PSIMRCC", "SAPT", "SCF", "THERMO", "BAKERJCC96", "&lt;no title&gt;", "&lt;no title&gt;", "&lt;no title&gt;", "&lt;no title&gt;", "&lt;no title&gt;", "&lt;no title&gt;", "&lt;no title&gt;", "&lt;no title&gt;", "&lt;no title&gt;", "&lt;no title&gt;", "&lt;no title&gt;", "Keywords by Alpha", "Keywords by Module", "Physical Constants", "&lt;no title&gt;", "PSIOH Intermediate Files", "PSI Variables by Module", "BRIANQC", "CFOUR", "CHEMPS2", "COOKBOOK", "&lt;no title&gt;", "DFTD3", "DFTD4", "DKH", "GCP", "GDMA", "GPU_DFCC", "JSON", "LIBEFP", "MRCC", "PCMSOLVER", "PSI4NUMPY", "PYTHON", "SIMINT", "SNSMP2", "V2RDM_CASSCF", "Basis Sets", "Basis Sets by Element", "Auxiliary Basis Sets", "Basis Sets by Family", "Bibliography", "Interface to the BrianQC GPU module by the BrianQC team", "Build &amp; Run FAQ", "Obtaining <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>", "Compiling and Installing from Source", "Capabilities and Alternate Implementations", "Complete Basis Set", "&lt;no title&gt;", "CC: Coupled Cluster Theory", "Interface to CFOUR by J. Stanton &amp; J. Gauss", "&lt;no title&gt;", "&lt;no title&gt;", "Interface to CheMPS2 by S. Wouters", "Code style conventions", "Conda Binary Distribution", "Interface to CPPE by M. Scheurer", "Generation of Cube Files \u2014 <code class=\"xref py py-func docutils literal notranslate\"><span class=\"pre\">cubeprop()</span></code>", "Customization: Adding Simple Extensions", "Database \u2014 <code class=\"xref py py-func docutils literal notranslate\"><span class=\"pre\">database()</span></code>", "DCT: Density Cumulant Theory", "Interface to ddx by A. Mikhalev, A. Jha, M. Nottoli and M. F. Herbst", "CI: Configuration Interaction", "DF-MP2: Density-Fitted 2nd-Order M\u00f8ller\u2013Plesset Perturbation Theory", "DFT: Density Functional Theory", "DFT Functionals", "Interface to DFTD3 by S. Grimme", "DFT-NL", "Spectroscopic Constants for Diatomics", "Interface to DKH by A. Wolf, M. Reiher, and B. A. Hess", "DLPNO-MP2: Domain-Based Local Pair Natural Orbital MP2", "Updating the <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span> Users\u2019 and Programmers\u2019 Manual", "Interface to LibECPInt by R. Shaw", "Single-Point Energy \u2014 <code class=\"xref py py-func docutils literal notranslate\"><span class=\"pre\">energy()</span></code>", "Installation and Runtime Configuration", "External API Objects", "Interface to programs through FCHK files \u2014 <code class=\"xref py py-func docutils literal notranslate\"><span class=\"pre\">fchk()</span></code>", "F/I-SAPT: Functional Group and/or Intramolecular SAPT", "FNOCC: Frozen natural orbitals for CCSD(T), QCISD(T), CEPA, and MP4", "Harmonic Vibrational Analysis and Visualization of Normal Modes \u2014 <code class=\"xref py py-func docutils literal notranslate\"><span class=\"pre\">frequency()</span></code> and <code class=\"xref py py-func docutils literal notranslate\"><span class=\"pre\">hessian()</span></code>", "Interface to gau2grid by D. G. A. Smith", "Interface to gCP by S. Grimme", "Interface to GDMA Distributed Multipole Analysis by A. J. Stone \u2014 <code class=\"xref py py-func docutils literal notranslate\"><span class=\"pre\">gdma()</span></code>", "PSI Variables by Alpha", "<span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>: Open-Source Quantum Chemistry", "A <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span> Tutorial", "Function Intercalls", "Interfaces: Enhancing <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span> Capabilities", "Introduction", "Interface to LIBEFP by I. Kaliman", "Interface to Libint by E. Valeev", "Interface to Libxc by M. A. L. Marques", "Adding Add-Ons", "Git, Versioning", "Managing: Git, Conda, CMake and all that", "Release Procedures", "MCSCF: Multi-Configurational Self-Consistent-Field", "Theoretical Methods: SCF to FCI", "Interface to Molden \u2014 <code class=\"xref py py-func docutils literal notranslate\"><span class=\"pre\">molden()</span></code>", "Interface to MRCC by M. K\u00e1llay", "&lt;no title&gt;", "Basis Set Superposition Corrections", "Notes on Options", "Notes on Options", "Interface to NumPy", "OCC: Orbital-Optimized Coupled-Cluster and M\u00f8ller\u2013Plesset Perturbation Theories", "Evaluation of One-Electron Properties \u2014 <code class=\"xref py py-func docutils literal notranslate\"><span class=\"pre\">oeprop()</span></code>", "Geometry Optimization \u2014 <code class=\"xref py py-func docutils literal notranslate\"><span class=\"pre\">optimize()</span></code> and <code class=\"xref py py-func docutils literal notranslate\"><span class=\"pre\">gradient()</span></code>", "LibOptions: globals, locals, has_changed and all that", "Geometry Optimization", "Interface to PCMSolver by R. Di Remigio", "PEP1: Proposing PsiPEP for <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>", "Psi4FockCI: A General Fock-Space CI For Spin-Flip And IP/EA", "Spin-Network-Scaled MP2 (SNS-MP2) by D. E. Shaw", "Plugin v2rdm_casscf by A. E. DePrince", "Creating New Plugins", "Adding Methods to Driver", "Linear Algebra in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>", "Community Code of Conduct", "Programming with the Core Libraries", "Debugging and Profiling", "Programmers FAQ", "Integrating New Features into <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>", "Where to Get Help", "Integrals in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>", "Introduction to Programming in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>", "Adding New Code to <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>", "Setting Up Your Development Environment", "C++ Style", "Python Style", "General layout of the core: where new C++ code should live", "Ways to Add Code: Psi4NumPy, Plugins, Full Integration", "Welcome to New Programmers", "Property", "<span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span> API: Linking C++ and Python", "PsiAPI Tutorial: Using Psi4 as a Python Module", "PSIMRCC Implementation of Mk-MRCC Theory", "PsiPEP: Plans and Practices to Organize <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>", "Psithon Functions: Invoking a Calculation", "Psithon: Structuring an Input File", "Molecule and Geometry Specification", "Defining a Method Alias", "Creating a Database", "Scalar relativistic Hamiltonians", "SAPT: Symmetry-Adapted Perturbation Theory", "HF: Hartree\u2013Fock Theory", "Interface to SIMINT by B. Pritchard", "Embarrassing Parallelism", "TDSCF: Time-dependent Hartree\u2013Fock and density-functional theory", "Test Suite and Sample Inputs", "Vibrational and Thermochemical Analysis", "Psithon Tutorial: Using <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span> as an Executable"], "titleterms": {"": [884, 1210, 1735, 1738, 1746, 1759, 1774, 1785, 1837], "0": 1821, "1": [1733, 1770, 1838], "2": 1788, "2nd": 1756, "3": 1788, "3rc1": 1788, "4": [1694, 1695, 1696, 1697, 1699, 1700, 1701, 1702, 1706, 1707, 1708, 1731, 1732, 1733, 1735, 1736, 1737, 1738, 1739, 1742, 1743, 1746, 1748, 1758, 1764, 1777, 1778, 1780, 1781, 1797, 1799, 1802, 1804, 1810, 1814, 1815, 1816, 1817, 1818, 1819, 1824, 1825, 1827, 1830, 1833, 1838, 1844], "8": 1788, "82": [1694, 1695, 1696, 1697, 1699, 1700, 1701, 1702, 1706, 1707, 1708, 1731, 1732, 1733, 1735, 1736, 1737, 1739, 1742, 1743, 1746, 1748, 1758, 1764, 1777, 1778, 1780, 1781, 1797, 1799, 1802, 1804, 1810, 1814, 1815, 1816, 1817, 1818, 1819, 1824, 1825, 1827, 1830, 1833, 1838, 1844], "9": 1738, "A": [1754, 1762, 1770, 1773, 1775, 1778, 1784, 1805, 1807, 1829, 1836, 1837], "And": 1805, "For": 1805, "In": 1730, "NO": 1837, "No": 1738, "On": [1738, 1785, 1788], "One": [1799, 1817], "Ons": 1785, "The": [1764, 1817, 1825, 1837], "_py_falsestruct": 1738, "a24": [1692, 1752], "a24alt": [1692, 1752], "a_ras3_max": [782, 1210], "ab": 0, "abcd": [428, 465, 512, 535, 1199, 1200, 1202, 1203], "absorpt": 1841, "access": [1771, 1772, 1798, 1817], "acen": [1692, 1752], "activ": [281, 1102, 1221], "active_nat_orb": [1065, 1219], "actual": 1738, "ad": [2, 1751, 1770, 1785, 1809, 1819], "adapt": [1781, 1837], "adc": [0, 1197, 1668, 1781], "adcc": [0, 1], "add": [1738, 1785, 1824], "add_auxiliary_bond": [1226, 1298], "addit": 1770, "address": 1817, "advanc": [1757, 1770, 1771, 1798, 1833, 1837], "after": 1738, "aio_cphf": [1230, 1435, 1837], "aio_df_int": [1230, 1436, 1837], "aka": 400, "algebra": [1781, 1810], "algorithm": [726, 1208, 1210, 1226, 1231, 1739, 1742, 1753, 1756, 1757, 1771, 1781, 1798, 1817, 1838], "alia": 1834, "alias": 1740, "all": [1758, 1787, 1801], "all_cas": 330, "allow": 1799, "alpha": [1704, 1776], "altern": [1210, 1739], "an": [1748, 1785, 1786, 1832, 1844], "ana": 1748, "anaconda": 1738, "analysi": [1770, 1772, 1775, 1828, 1838, 1843, 1844], "analyt": [1739, 1742, 1753, 1756, 1757, 1771, 1781, 1798], "analyz": [429, 536, 1199, 1203], "angular": 1738, "angularmomentumint": 4, "annot": 1786, "annual": 1788, "anticip": 1788, "ao": 1810, "ao_basi": [411, 430, 513, 557, 727, 1198, 1199, 1202, 1204, 1208], "aoshellcombinationsiter": 3, "api": [1740, 1768, 1772, 1794, 1827], "appendic": 400, "appli": 1747, "approach": 1808, "approv": 1738, "approxim": [1771, 1837], "ar": 1738, "arbitrari": 1755, "arrai": 1797, "array_to_matrix": 331, "array_vari": [151, 152], "ascii": 1786, "assembl": 1788, "atom": 1833, "atomiccomput": 265, "author": 1788, "auto": 1821, "auxiliari": [1694, 1708, 1732], "auxiliary_bond_factor": [1226, 1299], "avail": [0, 1695, 1696, 1697, 1699, 1700, 1701, 1702, 1707, 1731, 1733, 1738, 1752, 1758, 1781, 1802, 1817, 1838], "avg_stat": [783, 1210], "avg_weight": [784, 1210], "avoid": 1824, "b": [1762, 1839], "b_ras3_max": [785, 1210], "bakerjcc93": [1692, 1752], "bakerjcc96": [1692, 1752], "banner": [282, 332], "base": [1754, 1763, 1810], "basi": [400, 898, 1195, 1212, 1223, 1230, 1231, 1437, 1484, 1694, 1707, 1730, 1731, 1732, 1733, 1738, 1740, 1771, 1794, 1799, 1832, 1836, 1837], "basic": [1692, 1742, 1752, 1755, 1771, 1789, 1797, 1798, 1799, 1802, 1828, 1837, 1844], "basis_guess": [1231, 1485], "basis_help": [283, 333], "basis_relativist": [1103, 1221, 1836], "basisext": 6, "basisfunct": 7, "basisset": 8, "bbi": [1692, 1752], "bccd_maxit": [431, 1199], "be_quiet": 153, "befor": 1788, "bench": [1104, 1221], "bench12": [1692, 1752], "benchmark_blas1": 154, "benchmark_blas2": 155, "benchmark_blas3": 156, "benchmark_disk": 157, "benchmark_integr": 158, "benchmark_math": 159, "bendazzoli": [786, 1210], "bibliographi": 1734, "binari": [1736, 1737, 1748, 1808], "bla": [1738, 1810], "block": 1817, "block_diagonal_arrai": 334, "blockopoint": 9, "bodi": [1759, 1771], "bond": [1833, 1837], "border": [1228, 1378, 1749], "border_n_redist": [1228, 1379, 1749], "border_redist_ord": [1228, 1380, 1749], "border_redist_pol": [1228, 1381, 1749], "border_rmin": [1228, 1382, 1749], "border_rmin_unit": [1228, 1383, 1749], "border_typ": [1228, 1384, 1749], "bot": 1822, "boysloc": 10, "bra": 1817, "branch": 1788, "brianqc": [1710, 1735], "brianqc_en": [1105, 1221, 1735], "broken": 1838, "brueckner_maxit": [1066, 1219], "brueckner_orbs_r_converg": [432, 1199, 1742], "bsvec": 5, "buffer": 1817, "bug": 1816, "build": [1, 1735, 1736, 1738, 1746, 1749, 1754, 1762, 1765, 1773, 1775, 1782, 1783, 1784, 1785, 1788, 1803, 1839], "built": [1730, 1735], "bump": 1786, "c": [1738, 1814, 1821, 1823, 1827], "cachelevel": [412, 433, 466, 507, 514, 537, 558, 728, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1208, 1225, 1242, 1742], "cachetyp": [434, 467, 1199, 1200, 1742], "calc_s_squar": [787, 1210], "calcul": [0, 1742, 1828, 1831, 1838, 1844], "call": [1810, 1817], "cannot": 1786, "canonicalize_active_favg": [1171, 1222], "canonicalize_inactive_favg": [1172, 1222], "capabl": [0, 1738, 1739, 1742, 1746, 1756, 1757, 1771, 1780, 1781, 1798, 1799], "cart_hess_read": [1226, 1300], "cartesian_sym_toler": [1226, 1301], "case": 2, "caviti": 1754, "cb": 284, "cc": [788, 1210, 1742, 1781, 1785], "cc3_follow_root": [468, 1200], "cc_a_ras3_max": [789, 1210], "cc_b_ras3_max": [790, 1210], "cc_diis_max_vec": [911, 1213], "cc_diis_min_vec": [912, 1213], "cc_ex_level": [791, 1210], "cc_fix_extern": [792, 1210], "cc_fix_external_min": [793, 1210], "cc_lambda": [913, 1213], "cc_macro": [794, 1210], "cc_maxit": [914, 1213, 1225, 1243], "cc_mix": [795, 1210], "cc_num_thread": [435, 469, 564, 1199, 1200, 1205, 1229, 1397], "cc_os_scal": [436, 1199], "cc_ras34_max": [796, 1210], "cc_ras3_max": [797, 1210], "cc_ras4_max": [798, 1210], "cc_scale_o": [1067, 1219, 1771], "cc_scale_ss": [1068, 1219, 1771], "cc_ss_scale": [437, 1199], "cc_time": [1069, 1219, 1771], "cc_type": [1106, 1221, 1739, 1742, 1756, 1757, 1771, 1781, 1798], "cc_update_ep": [799, 1210], "cc_val_ex_level": [800, 1210], "cc_variat": [801, 1210], "cc_vecs_read": [802, 1210], "cc_vecs_writ": [803, 1210], "ccd_e_converg": [1230, 1438], "ccd_maxit": [1230, 1439], "ccd_t_converg": [1230, 1440], "ccdensiti": [160, 1198], "ccenergi": [161, 1199, 1669, 1742], "cceom": [162, 1200], "cchbar": [163, 1201], "ccl_energi": [1225, 1244], "cclambda": [164, 1202], "cclr": 1742, "ccrespons": [165, 1203], "ccsd": 1771, "cctransort": [166, 1204], "cctripl": [167, 1205], "ccwavefunct": 11, "cdsalc": 15, "cdsalclist": 16, "center": 1837, "cepa": 1771, "cepa_level": [1070, 1219, 1771], "cepa_no_singl": [1071, 1219, 1771], "cepa_os_scal": [1225, 1245], "cepa_sos_scal": [1225, 1246], "cepa_ss_scal": [1225, 1247], "cepa_typ": [1225, 1248], "cfour": [1206, 1670, 1711, 1743], "cfour_abcdtyp": [568, 1206], "cfour_active_orbi": [569, 1206], "cfour_anh_algorithm": [570, 1206], "cfour_anh_deriv": [571, 1206], "cfour_anh_steps": [572, 1206], "cfour_anh_symmetri": [573, 1206], "cfour_anharmon": [574, 1206], "cfour_ao_ladd": [575, 1206], "cfour_av_scf": [576, 1206], "cfour_basi": [577, 1206], "cfour_bruck_conv": [578, 1206], "cfour_brueckn": [579, 1206], "cfour_cache_rec": [580, 1206], "cfour_calc_level": [581, 1206], "cfour_cc_conv": [582, 1206], "cfour_cc_expord": [583, 1206], "cfour_cc_extrapol": [584, 1206], "cfour_cc_maxcyc": [585, 1206], "cfour_cc_program": [586, 1206], "cfour_charg": [587, 1206], "cfour_cis_conv": [588, 1206], "cfour_continuum": [589, 1206], "cfour_contract": [590, 1206], "cfour_converg": [591, 1206], "cfour_coordin": [592, 1206], "cfour_core_orbit": [593, 1206], "cfour_cphf_conv": [594, 1206], "cfour_cphf_maxcyc": [595, 1206], "cfour_curvilinear": [596, 1206], "cfour_dboc": [597, 1206], "cfour_dct": [598, 1206], "cfour_deriv_level": [599, 1206], "cfour_diff_typ": [600, 1206], "cfour_dropmo": [601, 1206], "cfour_ecp": [602, 1206], "cfour_eigenvector": [603, 1206], "cfour_el_anharm": [604, 1206], "cfour_eom_nonit": [605, 1206], "cfour_estate_conv": [606, 1206], "cfour_estate_maxcyc": [607, 1206], "cfour_estate_prop": [608, 1206], "cfour_estate_sym": [609, 1206], "cfour_estate_tran": [610, 1206], "cfour_eval_hess": [611, 1206], "cfour_excit": [612, 613, 1206], "cfour_fc_field": [614, 1206], "cfour_fd_calctyp": [615, 1206], "cfour_fd_irrep": [616, 1206], "cfour_fd_project": [617, 1206], "cfour_fd_steps": [618, 1206], "cfour_fd_usegroup": [619, 1206], "cfour_file_recsiz": [620, 1206], "cfour_file_strip": [621, 1206], "cfour_finite_perturb": [622, 1206], "cfour_fock": [623, 1206], "cfour_freq_algorithm": [624, 1206], "cfour_frozen_cor": [625, 1206], "cfour_frozen_virt": [626, 1206], "cfour_gamma_abcd": [627, 1206], "cfour_genbas_1": [628, 1206], "cfour_genbas_2": [629, 1206], "cfour_genbas_3": [630, 1206], "cfour_genbas_4": [631, 1206], "cfour_geo_conv": [632, 1206], "cfour_geo_maxcyc": [633, 1206], "cfour_geo_maxstep": [634, 1206], "cfour_geo_method": [635, 1206], "cfour_giao": [636, 1206], "cfour_grid": [637, 1206], "cfour_guess": [638, 1206], "cfour_hbar": [639, 1206], "cfour_hfstabl": [640, 1206], "cfour_incor": [641, 1206], "cfour_input_mrcc": [642, 1206], "cfour_integr": [643, 1206], "cfour_joda_print": [644, 1206], "cfour_lineq_conv": [645, 1206], "cfour_lineq_maxci": [646, 1206], "cfour_lineq_typ": [647, 1206], "cfour_lock_orbocc": [648, 1206], "cfour_maxstep": [649, 1206], "cfour_mem_unit": [650, 1206], "cfour_memory_s": [651, 1206], "cfour_method": [652, 1206], "cfour_mrcc": [653, 1206], "cfour_multipl": [654, 1206], "cfour_nacoupl": [655, 1206], "cfour_negev": [656, 1206], "cfour_newnorm": [657, 1206], "cfour_nonhf": [658, 1206], "cfour_ntop_tamp": [659, 1206], "cfour_occup": [660, 1206], "cfour_omp_num_thread": [661, 1206], "cfour_open": [662, 1206], "cfour_opt_maxcyc": [663, 1206], "cfour_orbit": [664, 1206], "cfour_pert_orb": [665, 1206], "cfour_point": [666, 1206], "cfour_print": [667, 1206], "cfour_prop": [669, 1206], "cfour_prop_integr": [668, 1206], "cfour_qrhf_gener": [670, 1206], "cfour_qrhf_orbit": [671, 1206], "cfour_qrhfgu": [672, 1206], "cfour_raman_int": [673, 1206], "cfour_raman_orb": [674, 1206], "cfour_rdo": [675, 1206], "cfour_refer": [676, 1206], "cfour_relativist": [677, 1206], "cfour_relax_den": [678, 1206], "cfour_res_raman": [679, 1206], "cfour_restart_cc": [680, 1206], "cfour_rot_evec": [681, 1206], "cfour_save_int": [682, 1206], "cfour_scale_on": [683, 1206], "cfour_scf_conv": [684, 1206], "cfour_scf_damp": [685, 1206], "cfour_scf_expord": [686, 1206], "cfour_scf_expstart": [687, 1206], "cfour_scf_extrapol": [688, 1206], "cfour_scf_maxcyc": [689, 1206], "cfour_sd_field": [690, 1206], "cfour_spher": [691, 1206], "cfour_spin_flip": [692, 1206], "cfour_spin_orbit": [693, 1206], "cfour_spin_sc": [694, 1206], "cfour_spinrot": [695, 1206], "cfour_subgroup": [696, 1206], "cfour_sym_check": [697, 1206], "cfour_symmetri": [698, 1206], "cfour_t3_extrapol": [699, 1206], "cfour_tamp_sum": [700, 1206], "cfour_thermochemistri": [701, 1206], "cfour_trans_inv": [702, 1206], "cfour_treat_pert": [703, 1206], "cfour_uij_threshold": [704, 1206], "cfour_unit": [705, 1206], "cfour_update_hessian": [706, 1206], "cfour_vibr": [707, 1206], "cfour_vtran": [708, 1206], "cfour_xfield": [709, 1206], "cfour_xform_tol": [710, 1206], "cfour_yfield": [711, 1206], "cfour_zfield": [712, 1206], "cg_solver": 335, "chang": [1788, 1802, 1817], "channel": 1788, "charact": 1786, "charactert": 17, "charg": [1770, 1837], "chemistri": 1777, "chemps2": [1712, 1746], "choleski": [915, 1213], "cholesky_toler": [916, 1072, 1213, 1219, 1231, 1486, 1771], "choos": 1738, "ci": [1755, 1781, 1805], "ci_dii": [1173, 1222], "ci_file_start": [804, 1210], "ci_maxit": [805, 1210, 1755], "ci_num_thread": [806, 1210], "ci_typ": [1107, 1221], "ciblks_print": [807, 1210], "circular": 1841, "cite": 1781, "civector": 12, "ciwavefunct": 13, "clang": 1747, "class": [1821, 1827], "clean": 168, "clean_opt": 169, "clean_tim": 170, "clean_vari": 171, "clone": 1737, "close_outfil": 172, "cluster": [1210, 1742, 1755, 1771, 1781, 1798], "cmake": [1738, 1787], "cmakelist": 2, "code": [1736, 1737, 1738, 1747, 1786, 1811, 1819, 1823, 1824], "codebas": [1764, 1786], "collapse_s": [808, 1210], "collapse_with_last": [470, 1200], "collapse_with_last_cc3": [471, 1200], "collect": 1788, "command": [1738, 1748, 1767], "comment": 1804, "commun": [1811, 1825], "compact": 1738, "compare_fchkfil": [285, 336], "compare_fcidump": [286, 337], "compare_moldenfil": [287, 338], "compare_vibinfo": 383, "comparison": 2, "compil": [1738, 1748, 1808], "complet": [1740, 1823], "complex_toler": [472, 1200], "compon": [1735, 1798], "compositejk": 18, "comput": [1755, 1770, 1789, 1837], "comput_s2": [917, 1213], "compute_mp4_tripl": [1073, 1219, 1771], "compute_shel": 1817, "compute_tripl": [1074, 1219, 1771], "conda": [1737, 1738, 1748, 1787, 1788, 1808], "conduct": 1811, "configur": [1, 1736, 1738, 1746, 1749, 1754, 1755, 1762, 1765, 1767, 1771, 1773, 1775, 1781, 1782, 1783, 1784, 1789, 1803, 1839], "conflict": 1738, "consecutive_backstep": [1226, 1302], "consist": 1789, "constant": [1706, 1761, 1832], "constrain": 1802, "construct": [1781, 1838], "consum": 1823, "contain": 1748, "content": [2, 1777], "continum": 1754, "continuum": 1803, "contribut": 1747, "control": [1206, 1226, 1231, 1832, 1837], "convent": [1747, 1798], "converg": [1226, 1231, 1798, 1802, 1838], "convergenceerror": 266, "cookbook": 1713, "coordin": [1226, 1802, 1833], "copy_file_from_scratch": [288, 339], "copy_file_to_scratch": [289, 340], "copyright": 1788, "core": [1692, 1730, 1752, 1772, 1786, 1810, 1812, 1823, 1827, 1838], "corr_ansatz": [1229, 1398], "corr_ccsd_t": [1229, 1399], "corr_charg": [1229, 1400], "corr_multp": [1229, 1401], "corr_wfn": [1229, 1402], "correct": [1697, 1701, 1757, 1758, 1759, 1781, 1794, 1828, 1844], "correlationfactor": 19, "correlationt": 20, "cosx": [1231, 1838], "cosx_basis_toler": [1231, 1487], "cosx_density_toler": [1231, 1488], "cosx_ints_toler": [1231, 1489], "cosx_maxiter_fin": [1231, 1490], "cosx_overlap_fit": [1231, 1491], "cosx_pruning_schem": [1231, 1492], "cosx_radial_points_fin": [1231, 1493], "cosx_radial_points_initi": [1231, 1494], "cosx_spherical_points_fin": [1231, 1495], "cosx_spherical_points_initi": [1231, 1496], "coulomb": 1838, "counter": 1788, "counterpois": [1828, 1844], "coupl": [1210, 1229, 1403, 1742, 1755, 1771, 1781, 1798], "coupled_induct": [1230, 1441, 1837], "coupling_term": [1229, 1404], "coval": 1833, "covalent_connect": [1226, 1303], "cphf": 1207, "cphf_mem_safety_factor": [714, 1207], "cphf_r_converg": [1029, 1218, 1230, 1442, 1837], "cphf_task": [715, 1207], "cpp": 1802, "cppe": 1749, "crai": 1738, "creat": [1786, 1808, 1835], "create_plugin": 290, "criteria": [1802, 1838], "ctest": [2, 1738], "cube": [1750, 1770], "cubeprop": [291, 341, 1750], "cubeprop_basis_funct": [1108, 1221, 1750], "cubeprop_filepath": [1109, 1221, 1750], "cubeprop_isocontour_threshold": [1110, 1221], "cubeprop_orbit": [1111, 1221, 1750], "cubeprop_task": [1112, 1221, 1750], "cubeproperti": 21, "cubic_basis_toler": [1030, 1113, 1218, 1221], "cubic_block_max_point": [1031, 1114, 1218, 1221], "cubic_grid_overag": [1032, 1115, 1218, 1221, 1750], "cubic_grid_spac": [1033, 1116, 1218, 1221, 1750], "cuhf": 14, "cumul": [1753, 1781], "current": [1742, 1799], "curv": 1757, "custom": 1751, "custom_coord": [1226, 1304], "cutoff": [918, 1213, 1225, 1249], "cutoff_amps_print": [0, 1, 401, 1197], "d": [1773, 1806, 1837], "d_converg": [1174, 1222, 1231, 1497], "damp_induc": [1228, 1385], "damp_multipol": [1228, 1386], "damping_converg": [1231, 1498], "damping_factor_induc": [1228, 1387], "damping_factor_multipol": [1228, 1388], "damping_percentag": [729, 1208, 1229, 1231, 1405, 1499], "dasum": 22, "dat": 2, "data": [2, 1797], "databas": [1752, 1833, 1835], "davidson_solv": 342, "daxpi": 23, "dcopi": 24, "dct": [173, 1208, 1671, 1753, 1781], "dct_function": [730, 1208], "dct_guess": [731, 1208], "dct_type": [732, 1208], "dd": 1754, "ddot": 25, "ddx": [1117, 1209, 1221, 1672, 1754], "ddx_diis_max_vec": [760, 1209, 1754], "ddx_eta": [761, 1209, 1754], "ddx_fmm": [762, 1209, 1754], "ddx_fmm_local_lmax": [763, 1209, 1754], "ddx_fmm_multipole_lmax": [764, 1209, 1754], "ddx_incor": [765, 1209, 1754], "ddx_lmax": [766, 1209, 1754], "ddx_logfil": [767, 1209, 1754], "ddx_maxit": [768, 1209, 1754], "ddx_model": [769, 1209, 1754], "ddx_n_lebedev": [770, 1209, 1754], "ddx_radii": [771, 1209, 1754], "ddx_radii_sc": [772, 1209, 1754], "ddx_radii_set": [773, 1209, 1754], "ddx_shift": [774, 1209, 1754], "ddx_solute_radial_point": [775, 1209, 1754], "ddx_solute_spherical_point": [776, 1209, 1754], "ddx_solvation_converg": [777, 1209, 1754], "ddx_solvent": [778, 1209, 1754], "ddx_solvent_epsilon": [779, 1209, 1754], "ddx_solvent_epsilon_opt": [780, 1209], "ddx_solvent_kappa": [781, 1209, 1754], "deal": 1802, "debug": [2, 413, 716, 1118, 1198, 1207, 1221, 1736, 1738, 1813, 1837], "declar": [1801, 1821], "decontract": 1730, "default": [1694, 1732, 1739, 1742, 1756, 1757, 1771, 1781, 1798, 1838], "defin": [1730, 1834], "definit": 1754, "del_array_vari": 174, "del_scalar_vari": 175, "del_vari": 176, "delete_tei": [559, 1204], "denominator_algorithm": [1230, 1443, 1837], "denominator_delta": [1230, 1444, 1837], "densiti": [1210, 1746, 1753, 1756, 1757, 1771, 1781, 1817, 1838, 1841], "depend": [1736, 1738, 1841], "deprinc": 1807, "deriv": [61, 1739, 1781, 1817, 1821], "derivcalctyp": 62, "dertyp": [1011, 1119, 1216, 1221], "detail": [1738, 1739, 1742, 1743, 1748, 1756, 1757, 1771, 1792, 1798], "detci": [177, 1210, 1673, 1755], "detci_freeze_cor": [809, 1210], "dev": 1748, "develop": [1738, 1808, 1820, 1824], "df": 1756, "df_basis_cc": [1075, 1120, 1219, 1221, 1771], "df_basis_dct": [733, 1208], "df_basis_elst": [1230, 1445, 1837], "df_basis_ep2": [892, 1211], "df_basis_guess": [1231, 1500], "df_basis_mcscf": [810, 1210], "df_basis_mp2": [899, 963, 1212, 1214], "df_basis_sad": [1231, 1501], "df_basis_sapt": [1230, 1446, 1837], "df_basis_scf": [717, 1207, 1231, 1502], "df_bump_r0": [1231, 1503], "df_bump_r1": [1231, 1504], "df_domain": [1231, 1505], "df_fitting_condit": [1231, 1506], "df_ints_io": [900, 1212, 1231, 1507], "df_ints_num_thread": [901, 1212, 1231, 1508], "df_metric": [1231, 1509], "df_scf_guess": [1231, 1510], "df_theta": [1231, 1511], "dfcc": [1076, 1219, 1771], "dfep2": 1211, "dfep2wavefunct": 26, "dfhelper": 27, "dfmp2": [178, 1212, 1674, 1756], "dfmp2_mem_factor": [902, 1212], "dfmp2_p2_toler": [903, 1212], "dfmp2_p_toler": [904, 1212], "dfocc": [179, 1213, 1675, 1798], "dfscf": 1231, "dfsomcscf": 28, "dft": [1230, 1231, 1695, 1757, 1758, 1760, 1837], "dft_alpha": [1231, 1512], "dft_alpha_c": [1231, 1513], "dft_basis_toler": [1231, 1514], "dft_block_max_point": [1231, 1515], "dft_block_max_radiu": [1231, 1516], "dft_block_min_point": [1231, 1517], "dft_block_schem": [1231, 1518], "dft_bs_radius_alpha": [1231, 1519], "dft_density_toler": [1231, 1520], "dft_dispersion_paramet": [1231, 1521], "dft_grac_alpha": [1231, 1522], "dft_grac_beta": [1231, 1523], "dft_grac_c_func": [1231, 1524], "dft_grac_shift": [1231, 1525], "dft_grac_x_func": [1231, 1526], "dft_grid_nam": [1231, 1527], "dft_nuclear_schem": [1231, 1528], "dft_omega": [1231, 1529], "dft_omega_c": [1231, 1530], "dft_pruning_alpha": [1231, 1531], "dft_pruning_schem": [1231, 1532], "dft_radial_point": [1231, 1533], "dft_radial_schem": [1231, 1534], "dft_remove_distant_point": [1231, 1535], "dft_spherical_point": [1231, 1536], "dft_spherical_schem": [1231, 1537], "dft_v2_rho_cutoff": [1231, 1538], "dft_vv10_b": [1231, 1539], "dft_vv10_c": [1231, 1540], "dft_vv10_postscf": [1231, 1541], "dft_vv10_radial_point": [1231, 1542], "dft_vv10_rho_cutoff": [1231, 1543], "dft_vv10_spherical_point": [1231, 1544], "dft_weights_toler": [1231, 1545], "dftd3": [1715, 1759], "dftd4": [1716, 1759], "dftensor": 30, "dftgrid": 29, "dgbmv": 31, "dgeev": 32, "dgemm": 33, "dgemv": 34, "dger": 35, "dgetr": 38, "dgetrf": 36, "dgetri": 37, "di": 1803, "diag_method": [811, 1210, 1755], "diagon": 1210, "diagonal_ccsd_t": [1229, 1406], "diagonalize_heff": [1229, 1407], "diagonalizeord": 63, "diagram": 1827, "diagrammat": 1781, "diatom": 1761, "dichroism": 1841, "die_if_not_converg": [1121, 1221], "differ": [1739, 1770, 1781], "diffus": 1733, "dii": [321, 438, 515, 538, 812, 1175, 1199, 1202, 1203, 1210, 1222, 1231, 1546], "diis_freq": [813, 1210], "diis_max_vec": [734, 814, 1077, 1176, 1208, 1210, 1219, 1222, 1225, 1229, 1231, 1250, 1408, 1547, 1771], "diis_min_vec": [735, 815, 1208, 1210, 1225, 1231, 1251, 1548], "diis_rms_error": [1231, 1549], "diis_start": [1229, 1231, 1409, 1550], "diis_start_converg": [736, 1208], "diis_start_it": [816, 1210], "dimens": [64, 1810], "dimer": 1802, "dipmom": [817, 1078, 1210, 1219, 1755, 1771], "dipoleint": 65, "dir": [1737, 1786], "direct": [1821, 1838], "directjk": 66, "directori": [1738, 1785, 1808], "discretis": 1754, "disksomcscf": 67, "disp_siz": [1023, 1217], "dispers": [68, 1697, 1757, 1758, 1759], "distribut": [1748, 1775, 1785], "distributed_matrix": [1231, 1551], "dkh": [1717, 1762], "dkh_order": [1122, 1221, 1762], "dlpno": [180, 1214, 1676, 1763], "dlpno_algorithm": [964, 1214], "dlpno_local_orbit": [965, 1214], "dlpno_maxit": [966, 1214], "dmrg": [181, 1215, 1677, 1746, 1781], "dmrg_caspt2_calc": [986, 1215, 1746], "dmrg_caspt2_imag": [987, 1215, 1746], "dmrg_caspt2_ipea": [988, 1215, 1746], "dmrg_caspt2_orb": [989, 1215, 1746], "dmrg_dii": [990, 1215, 1746], "dmrg_diis_writ": [991, 1215, 1746], "dmrg_excit": [992, 1215, 1746], "dmrg_irrep": [993, 1215, 1746], "dmrg_local_init": [994, 1215, 1746], "dmrg_molden_writ": [995, 1215, 1746], "dmrg_mps_write": [996, 1215, 1746], "dmrg_multipl": [997, 1215, 1746], "dmrg_opdm_ao_print": [998, 1215, 1746], "dmrg_print_corr": [999, 1215, 1746], "dmrg_scf_active_spac": [1000, 1215, 1746], "dmrg_scf_diis_thr": [1001, 1215, 1746], "dmrg_scf_grad_thr": [1002, 1215, 1746], "dmrg_scf_max_it": [1003, 1215, 1746], "dmrg_scf_state_avg": [1004, 1215, 1746], "dmrg_sweep_dvdson_rtol": [1005, 1215, 1746], "dmrg_sweep_energy_conv": [1006, 1215, 1746], "dmrg_sweep_max_sweep": [1007, 1215, 1746], "dmrg_sweep_noise_prefac": [1008, 1215, 1746], "dmrg_sweep_stat": [1009, 1215, 1746], "dmrg_unitary_writ": [1010, 1215, 1746], "dnrm2": 39, "do": [1738, 1748, 1786, 1788], "do_ccd_disp": [1230, 1447, 1837], "do_dii": [919, 1213, 1225, 1252, 1798], "do_disp_exch_sinf": [1230, 1448, 1837], "do_ind30_exch_sinf": [1230, 1449, 1837], "do_ind_exch_sinf": [1230, 1450, 1837], "do_level_shift": [920, 1213, 1225, 1253, 1798], "do_mbpt_disp": [1230, 1451, 1837], "do_sc": [921, 1213, 1225, 1254], "do_so": [922, 1213, 1225, 1255], "do_third_ord": [1230, 1452, 1837], "doc": 1785, "docc": [1123, 1177, 1221, 1222, 1810], "docker": 1788, "docs_table_link": [292, 343], "document": [1764, 1788], "doi": 1214, "doi_basis_toler": [967, 1214], "doi_pruning_schem": [968, 1214], "doi_radial_point": [969, 1214], "doi_spherical_point": [970, 1214], "domain": 1763, "doubl": [1696, 1739, 1742, 1756, 1757, 1758, 1771, 1781, 1798], "doublet": 182, "dougla": 1733, "download": [1748, 1788], "dpdbuf4": 183, "dpdfile2": 184, "dpotr": 42, "dpotrf": 40, "dpotri": 41, "driver": [1738, 1772, 1801, 1809, 1827], "drop_dupl": 344, "drot": 43, "dsbmv": 44, "dscal": 45, "dswap": 46, "dsyev": 47, "dsymm": 48, "dsymv": 49, "dsyr": 50, "dsyr2": 51, "dsyr2k": 52, "dsyrk": 53, "dsysv": 54, "dtbmv": 55, "dtbsv": 56, "dtrmm": 57, "dtrmv": 58, "dtrsm": 59, "dtrsv": 60, "dual": 1733, "dummy_einsum": 185, "dummy_integratorxx": 186, "dun": 1733, "dynamic_level": [1226, 1305], "dynamic_variable_bind": 293, "e": [1739, 1742, 1756, 1757, 1771, 1781, 1783, 1788, 1798, 1806, 1807, 1810], "e3_scal": [923, 1213, 1225, 1256], "e_converg": [439, 473, 737, 818, 924, 971, 1079, 1178, 1199, 1200, 1208, 1210, 1213, 1214, 1219, 1222, 1224, 1225, 1229, 1231, 1233, 1257, 1410, 1552, 1742, 1771, 1798], "ea": 1805, "ea_pol": [1225, 1258], "easi": [1828, 1844], "easier": [1748, 1824], "ecosystem": 1788, "ecp": [1730, 1838], "editor": 1747, "effect": [1231, 1730, 1838], "efp": [1216, 1678, 1782], "efp_disp": [1012, 1216], "efp_disp_damp": [1013, 1216], "efp_elst": [1014, 1216], "efp_elst_damp": [1015, 1216], "efp_exch": [1016, 1216], "efp_ind": [1017, 1216], "efp_ind_damp": [1018, 1216], "efp_qm_elst": [1019, 1216], "efp_qm_ind": [1020, 1216], "ekt_ea": [1225, 1259], "ekt_ip": [925, 1213, 1225, 1260], "electricfieldint": 71, "electron": [1771, 1799, 1817, 1841], "electrostaticint": 72, "element": [1707, 1731], "elementari": 1767, "els": 1785, "elsewher": 1738, "embarrass": 1840, "embed": 1749, "empir": 1759, "empiricaldispers": 267, "enabl": 1735, "end": 1737, "energi": [295, 1766], "energies_from_fcidump": [294, 345], "energy_level_shift": [738, 1208], "engin": 1817, "enhanc": 1780, "ensure_bt_converg": [1226, 1306], "environ": [1735, 1738, 1767, 1820], "environment": 1231, "eom_guess": [474, 1200, 1742], "eom_refer": [475, 508, 1200, 1201], "ep2_converg": [893, 1211], "ep2_maxit": [894, 1211], "ep2_num_ea": [895, 1211], "ep2_num_ip": [896, 1211], "ep2_orbit": [897, 1211], "ep_ea_pol": [1225, 1261], "ep_ip_pol": [1225, 1262], "ep_maxit": [1225, 1263], "eri": [69, 1757, 1838], "error": [1736, 1738], "esppropcalc": 70, "evalu": 1799, "ex_allow": [819, 1210], "ex_level": [820, 1210, 1755], "exampl": [1770, 1829, 1836, 1837, 1843], "exch_scale_alpha": [1230, 1453, 1837], "exchang": [1837, 1838], "excit": 1742, "excitation_rang": [476, 1200], "execut": [1738, 1844], "expand_psivar": 346, "expert": [1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1208, 1209, 1210, 1212, 1214, 1216, 1218, 1219, 1221, 1222, 1224, 1225, 1227, 1229, 1230, 1231], "explicit": 1821, "explicit_hamiltonian": [718, 1207], "expos": 1823, "ext_force_bend": [1226, 1307], "ext_force_cartesian": [1226, 1308], "ext_force_dihedr": [1226, 1309], "ext_force_dist": [1226, 1310], "ext_force_oofp": [1226, 1311], "extens": [1736, 1751], "extern": [1231, 1553, 1768, 1817, 1838], "external_potential_symmetri": [1124, 1221], "externalpotenti": 73, "extra": [2, 1788], "extrapol": 1740, "f": [1, 1754, 1770], "f12": 1733, "f_cut": [972, 1214], "fail_on_maxit": [1231, 1554], "famili": [1694, 1695, 1696, 1697, 1699, 1700, 1701, 1702, 1706, 1707, 1708, 1731, 1732, 1733, 1735, 1736, 1737, 1739, 1742, 1743, 1746, 1748, 1758, 1764, 1777, 1778, 1780, 1781, 1797, 1799, 1802, 1804, 1810, 1814, 1815, 1816, 1817, 1818, 1819, 1824, 1825, 1827, 1830, 1833, 1838, 1844], "faq": [1736, 1814], "faster": 1748, "favg": [1179, 1222], "favg_ccsd_t": [1229, 1411], "favg_start": [1180, 1222], "fchk": [296, 1769], "fchkwriter": 74, "fci": [821, 1210, 1755, 1790], "fci_str": [822, 1210], "fcidump": [297, 347], "fcidump_from_fil": [298, 348], "fcidump_tei_help": 187, "fd_project": [1024, 1217], "fdds_dispers": 75, "featur": 1815, "field": 1789, "file": [2, 1210, 1708, 1738, 1750, 1767, 1769, 1770, 1808, 1832, 1844], "filter_guess": [823, 1210], "filter_guess_det1": [824, 1210], "filter_guess_det2": [825, 1210], "filter_guess_sign": [826, 1210], "filter_nonvib": 384, "filter_omega_to_r": 385, "filter_zero_det": [827, 1210], "final": [188, 1788], "find": [1737, 1738, 1786], "find_approximate_string_match": [299, 349], "findif": 1217, "finit": [1739, 1781], "fink": 1738, "first": [1788, 1836, 1837], "fisapt": [76, 1218, 1679], "fisapt_charge_complet": [1034, 1218], "fisapt_cube_densmat": [1035, 1218, 1770], "fisapt_cube_linkibo": [1036, 1218, 1770], "fisapt_cube_linkiho": [1037, 1218, 1770], "fisapt_do_fsapt": [1038, 1218], "fisapt_do_fsapt_disp": [1039, 1218], "fisapt_do_plot": [1040, 1218], "fisapt_exch_parperp": [1041, 1218, 1770], "fisapt_fsapt_exch_scal": [1042, 1218], "fisapt_fsapt_filepath": [1043, 1218], "fisapt_fsapt_ind_respons": [1044, 1218], "fisapt_fsapt_ind_scal": [1045, 1218], "fisapt_fssapt_filepath": [1046, 1218], "fisapt_link_assign": [1047, 1218], "fisapt_link_ortho": [1048, 1218, 1770], "fisapt_link_select": [1049, 1218], "fisapt_manual_link": [1050, 1218], "fisapt_mem_safety_factor": [1051, 1218], "fisapt_plot_filepath": [1052, 1218], "fit": [1733, 1756, 1757, 1771, 1838], "fittedslatercorrelationfactor": 77, "fittingmetr": 78, "fix": [1738, 1746, 1786], "flexible_g_converg": [1226, 1312], "flip": [1805, 1837], "flush_outfil": 189, "fno": 1771, "fnocc": [190, 1219, 1680, 1771], "fock": [1781, 1805, 1828, 1838, 1841, 1844], "follow": 1210, "follow_root": [828, 1181, 1210, 1222, 1229, 1412], "follow_step_incr": [1231, 1555], "follow_step_scal": [1231, 1556], "follow_vector": [829, 1210], "font": [1694, 1695, 1696, 1697, 1699, 1700, 1701, 1702, 1706, 1707, 1708, 1731, 1732, 1733, 1735, 1736, 1737, 1739, 1742, 1743, 1746, 1748, 1758, 1764, 1777, 1778, 1780, 1781, 1797, 1799, 1802, 1804, 1810, 1814, 1815, 1816, 1817, 1818, 1819, 1824, 1825, 1827, 1830, 1833, 1838, 1844], "force_restart": [440, 1199], "force_twocon": [1182, 1222], "fork": 1737, "format": [2, 1747], "format_molecule_for_input": 350, "format_options_for_input": 351, "fortran": 1738, "frac_dii": [1231, 1557], "frac_load": [1231, 1558], "frac_occ": [1231, 1559], "frac_renorm": [1231, 1560], "frac_start": [1231, 1561], "frac_val": [1231, 1562], "fraction": [1231, 1757], "frag_mod": [1226, 1313], "frag_ref_atom": [1226, 1314], "fragment": [1226, 1782, 1802, 1833], "fragmenttyp": 79, "free_atom_volum": 352, "freeze_all_dihedr": [1226, 1315], "freeze_cor": [1125, 1221, 1230, 1454, 1771, 1837], "freeze_core_polici": [1126, 1221], "freeze_interfrag": [1226, 1316], "freeze_intrafrag": [1226, 1317], "freq": 300, "frequenc": [301, 302, 1772, 1828, 1844], "frequency_analysi": 1772, "from": [1735, 1737, 1738, 1786, 1802], "frozen": 1771, "frozen_bend": [1226, 1318], "frozen_cartesian": [1226, 1319], "frozen_dihedr": [1226, 1320], "frozen_dist": [1226, 1321], "frozen_docc": [1127, 1221, 1755], "frozen_oofp": [1226, 1322], "frozen_uocc": [1128, 1221, 1755], "full": 1824, "full_hess_everi": [1226, 1323, 1802], "full_matrix": [477, 1200], "function": [2, 80, 1695, 1696, 1697, 1699, 1700, 1701, 1702, 1733, 1743, 1757, 1758, 1770, 1772, 1779, 1821, 1827, 1831, 1841], "further": 1754, "futur": 1738, "g": [1739, 1742, 1756, 1757, 1771, 1773, 1781, 1788, 1798, 1810], "g_converg": [1226, 1324, 1802], "gau2grid": 1773, "gau2gridfor": 1773, "gaug": [402, 414, 539, 1197, 1198, 1203, 1742], "gauss": 1743, "gaussian": 322, "gaussianshel": 81, "gaussiantyp": 82, "gcc": 1738, "gcp": [1718, 1774], "gdb": 1738, "gdma": [303, 1220, 1681, 1719, 1775], "gdma_limit": [1097, 1220, 1775], "gdma_multipole_unit": [1098, 1220, 1775], "gdma_origin": [1099, 1220, 1775], "gdma_radiu": [1100, 1220, 1775], "gdma_switch": [1101, 1220, 1775], "gener": [1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1227, 1228, 1229, 1231, 1232, 1750, 1788, 1805, 1823], "geom_maxit": [1226, 1325, 1802], "geometr": 1802, "geometri": [304, 1800, 1802, 1828, 1832, 1833, 1844], "geometryunit": 83, "get": [1738, 1816], "get_active_molecul": 191, "get_array_vari": [192, 193], "get_datadir": 194, "get_global_opt": 195, "get_global_option_list": 196, "get_local_opt": 197, "get_memori": [198, 305, 353], "get_num_thread": 199, "get_opt": [200, 201], "get_output_fil": 202, "get_psifil": 354, "get_vari": [203, 204], "get_writer_file_prefix": 205, "getattr_ignorecas": 355, "gga": [1699, 1758], "ghost": 1833, "gib": 1821, "git": [1738, 1747, 1786, 1787], "git_vers": 206, "github": [1737, 1786, 1788], "global": [1221, 1801], "gn": 1771, "gpu": 1735, "gpu_dfcc": 1720, "gradient": [306, 1753, 1800], "gradient_writ": [1025, 1217], "grid": [1214, 1757, 1799], "grimm": [1759, 1774], "group": [1746, 1770, 1781], "guess": [1210, 1231, 1563, 1838], "guess_mix": [1231, 1564], "guess_persist": [1231, 1565], "guess_r_converg": [739, 1208], "guess_vector": [830, 1210], "h0_block_coupl": [831, 1210], "h0_block_coupling_s": [832, 1210], "h0_blocksiz": [833, 1210], "h0_guess_siz": [834, 1210], "h_bond_connect": [1226, 1326], "h_guess_everi": [1226, 1327], "h_update_den_tol": [1226, 1328], "hamiltonian": 1836, "hamiltonian_solv": 356, "handl": [1210, 1738, 1746, 1801], "harmon": 1772, "harmonic_analysi": 386, "hartre": [1781, 1828, 1838, 1841, 1844], "has_array_vari": 207, "has_chang": 1801, "has_global_option_chang": 208, "has_local_option_chang": 209, "has_option_chang": 210, "has_scalar_vari": 211, "has_vari": 212, "hbc6": [1692, 1752], "hd_avg": [835, 1210], "hd_otf": [836, 1210], "header": 1820, "heff4": [1229, 1413], "heff_print": [1229, 1414], "help": 1816, "helper": 1733, "herbst": [1, 1754], "hess": 1762, "hess_typ": [926, 1213, 1798], "hess_upd": [1226, 1329], "hess_update_limit": [1226, 1330], "hess_update_limit_max": [1226, 1331], "hess_update_limit_scal": [1226, 1332], "hess_update_use_last": [1226, 1333], "hessian": [307, 1226, 1772, 1802], "hessian_symmetr": 387, "hessian_writ": [1026, 1217], "hf": [84, 1230, 1838], "hidden": 1738, "high": 1738, "higher": [1755, 1837], "highlight": 1738, "hold_options_st": 357, "homebrew": 1738, "hook": 1747, "how": [1, 1737, 1738, 1746, 1747, 1748, 1749, 1754, 1762, 1765, 1773, 1775, 1782, 1783, 1784, 1785, 1786, 1803, 1810, 1822, 1839], "hsg": [1692, 1752], "htbh": [1692, 1752], "htr40": [1692, 1752], "hybrid": [1696, 1700, 1758], "i": [1737, 1738, 1739, 1742, 1756, 1757, 1770, 1771, 1781, 1782, 1786, 1798, 1801, 1828], "icor": [837, 1210, 1755], "idamax": 85, "ignor": 1822, "ii": 1828, "iii": 1828, "imag": 1788, "implement": [1739, 1759, 1829], "import": [1786, 1802, 1810], "import_ignorecas": 358, "impos": 1747, "incfock": [1231, 1566], "incfock_converg": [1231, 1567], "incfock_full_fock_everi": [1231, 1568], "includ": [1739, 1804], "incorpor": 1824, "induced_converg": [1228, 1389, 1749], "inf": 1837, "info": 1231, "inherit": 1827, "initi": [213, 1788, 1824, 1838], "initio": 0, "inpsight": 323, "input": [2, 1730, 1753, 1757, 1762, 1775, 1805, 1806, 1828, 1832, 1838, 1842, 1844], "instal": [1, 1735, 1736, 1737, 1738, 1743, 1746, 1748, 1749, 1754, 1759, 1762, 1764, 1765, 1767, 1773, 1774, 1775, 1782, 1783, 1784, 1792, 1803, 1805, 1806, 1807, 1839], "instanti": 1817, "int": 1817, "intcos_generate_exit": [1226, 1334], "integr": [1738, 1754, 1785, 1815, 1817, 1823, 1824, 1838], "integral_cutoff": [927, 1213], "integral_packag": [1129, 1221], "integralfactori": 89, "integraltransform": 90, "interact": [1755, 1771, 1781, 1828, 1844], "intercal": 1779, "interfac": [0, 1, 1735, 1743, 1746, 1749, 1754, 1759, 1762, 1765, 1769, 1772, 1773, 1774, 1775, 1780, 1782, 1783, 1784, 1791, 1792, 1797, 1802, 1803, 1814, 1839], "interfrag_collinear_tol": [1226, 1335], "interfrag_coord": [1226, 1336], "interfrag_dist_inv": [1226, 1337], "interfrag_hess": [1226, 1338], "interfrag_mod": [1226, 1339], "interfrag_step_limit": [1226, 1340], "interfragment_connect": [1226, 1341], "intermedi": 1708, "intermolecular": [1828, 1844], "intern": [1206, 1226, 1739, 1781], "internal_rot": [1183, 1222], "interpret": 1837, "intrafrag_hess": [1226, 1342], "intrafrag_step_limit": [1226, 1343], "intrafrag_step_limit_max": [1226, 1344], "intrafrag_step_limit_min": [1226, 1345], "intramolecular": 1770, "introduct": [1750, 1756, 1763, 1781, 1798, 1817, 1818, 1838, 1841], "ints_toler": [415, 740, 905, 1053, 1198, 1208, 1212, 1218, 1224, 1230, 1231, 1234, 1455, 1569, 1837], "intvector": 88, "invok": [1738, 1831], "io": 86, "iomanag": 87, "ip": [1757, 1805], "ip_pol": [1225, 1264], "ipi_brok": 308, "irc_direct": [1226, 1346], "irc_point": [1226, 1347], "irc_step_s": [1226, 1348], "irreduc": 1833, "irreduciblerepresent": 91, "irrep": [1797, 1833], "isotop": 1833, "isotropic_pol": [1228, 1390, 1749], "issu": 1786, "istop": [838, 1210], "iter": [1753, 1754, 1799], "iv": 1828, "j": [1743, 1775], "januari": 1788, "jensen": 1733, "jha": 1754, "jk": [92, 1733], "job": [1767, 1832], "jobtyp": [516, 1202], "jsch": [1692, 1752], "json": 1721, "kaliman": 1782, "karlsruh": 1733, "ket": 1817, "keyword": [1, 400, 1704, 1705, 1735, 1742, 1746, 1749, 1750, 1754, 1755, 1762, 1770, 1771, 1772, 1785, 1789, 1798, 1799, 1802, 1803, 1832, 1833, 1836, 1837, 1841, 1843], "kind": [1, 403, 1197], "kineticint": 93, "known": 1841, "kroll": 1733, "kwargs_low": 359, "k\u00e1llai": 1792, "l": 1784, "lapack": [1738, 1810], "laplacedenomin": 95, "larger": 1742, "layout": [1738, 1823], "level": [1733, 1737, 1786, 1810], "level_shift": [928, 1184, 1213, 1222, 1225, 1231, 1265, 1570], "level_shift_cutoff": [1231, 1571], "levenshtein": [309, 360], "libecpint": 1765, "libefp": [1722, 1782], "libint": 1783, "libint2_configur": [310, 361], "libint2_print_out": [311, 362], "libint2_solid_harmonics_ord": 214, "libopt": 1801, "librari": [1738, 1782, 1812], "libxc": 1784, "libxcfunct": 96, "licens": 1781, "limit": 1841, "line": [1748, 1767], "linear": [540, 1203, 1742, 1810, 1838], "lineq_solv": [929, 1213], "lineshap": 324, "link": [1770, 1827], "link_ints_toler": [1231, 1572], "linux": 1738, "literal_cfour": [1130, 1221], "live": 1823, "lldb": 1738, "local": [97, 441, 478, 517, 541, 1199, 1200, 1202, 1203, 1738, 1763, 1801], "local_converg": [973, 1054, 1214, 1218, 1231, 1573], "local_cphf_cutoff": [442, 518, 542, 1199, 1202, 1203], "local_cutoff": [443, 479, 519, 543, 1199, 1200, 1202, 1203], "local_do_singl": [480, 1200], "local_filter_singl": [481, 520, 544, 1200, 1202, 1203], "local_ibo_condit": [1055, 1218], "local_ibo_pow": [1056, 1218], "local_ibo_star": [1057, 1218], "local_ibo_stars_complet": [1058, 1218], "local_ibo_use_star": [1059, 1218], "local_maxit": [974, 1060, 1214, 1218, 1231, 1574], "local_method": [444, 482, 521, 545, 1199, 1200, 1202, 1203], "local_pairdef": [445, 522, 546, 1199, 1202, 1203], "local_precondition": [483, 1200], "local_use_ghost": [1061, 1218], "local_weakp": [446, 484, 523, 547, 1199, 1200, 1202, 1203], "locat": 1786, "lock_singlet": [1229, 1415], "log": 1738, "logo": 1738, "long": [1701, 1758, 1788], "loop": 1832, "lorentzian": 325, "low": 1810, "ls_thc_basis_toler": [1131, 1221], "ls_thc_comput": 94, "ls_thc_df": [1132, 1221], "ls_thc_pruning_schem": [1133, 1221], "ls_thc_radial_point": [1134, 1221], "ls_thc_s_epsilon": [1135, 1221], "ls_thc_spherical_point": [1136, 1221], "ls_thc_weights_toler": [1137, 1221], "lse": [839, 1210], "lse_collaps": [840, 1210], "lse_toler": [841, 1210], "lto": 1746, "m": [1, 1749, 1754, 1762, 1784, 1792], "mac": 1738, "macport": 1738, "made": [1828, 1844], "madmp2_sleep": [906, 1212], "mai": 1738, "make_shar": 1821, "manag": [1736, 1786, 1787, 1809], "managedmethoderror": 268, "mani": 1771, "manipul": 1757, "manual": [1747, 1764, 1777], "map": 1764, "mark": 1821, "marqu": 1784, "mat2arr": 363, "mat_num_column_print": [1138, 1221], "math": 1764, "matric": 1210, "matrix": [100, 1746, 1781, 1797, 1810], "matrixfactori": 101, "max_attempt": [1231, 1575], "max_ccd_diisvec": [1230, 1456], "max_disp_g_converg": [1226, 1349], "max_energy_g_converg": [1226, 1350], "max_force_g_converg": [1226, 1351], "max_mem_buf": [1231, 1576], "max_mograd_converg": [930, 1213, 1225, 1266, 1798], "max_num_vec": [1, 404, 842, 1197, 1210], "max_radial_mo": [1139, 1221], "maxit": [1, 405, 447, 485, 524, 548, 741, 1062, 1080, 1185, 1197, 1199, 1200, 1202, 1203, 1208, 1218, 1219, 1222, 1228, 1229, 1230, 1231, 1391, 1416, 1457, 1577, 1742, 1749, 1771, 1837], "mbis_d_converg": [1140, 1221], "mbis_maxit": [1141, 1221], "mbis_pruning_schem": [1142, 1221], "mbis_radial_point": [1143, 1221], "mbis_spherical_point": [1144, 1221], "mcscf": [215, 1210, 1222, 1682, 1789], "mcscf_algorithm": [843, 1210, 1789], "mcscf_ci_cleanup": [844, 1210], "mcscf_diis_error_typ": [845, 1210], "mcscf_diis_freq": [846, 1210], "mcscf_diis_max_vec": [847, 1210], "mcscf_diis_start": [848, 1210, 1789], "mcscf_dpd_cleanup": [849, 1210], "mcscf_e_converg": [850, 1210, 1789], "mcscf_guess": [851, 1210], "mcscf_max_rot": [852, 1210], "mcscf_maxit": [853, 1210, 1789], "mcscf_r_converg": [854, 1210, 1789], "mcscf_rotat": [855, 1210, 1789], "mcscf_so_start_": [856, 1210], "mcscf_so_start_grad": [857, 1210], "mcscf_type": [858, 1210, 1789], "mdi_run": 312, "memdfjk": 102, "memori": [1821, 1832], "merg": 1738, "message_box": [313, 364], "meta": [1702, 1758], "method": [0, 1210, 1746, 1753, 1771, 1781, 1790, 1792, 1798, 1809, 1823, 1834, 1838], "mid": 1837, "mikhalev": 1754, "min_ccd_diisvec": [1230, 1458], "minao_basi": [1063, 1218], "miniconda": 1748, "minim": [1753, 1757, 1799, 1838], "minima": 1802, "mint": 1223, "mintshelp": 103, "minut": 1738, "misc": [1226, 1231, 1743, 1788], "miscellan": [400, 1736, 1814], "missingmethoderror": 269, "mix": [859, 1210, 1730], "mixed4": [860, 1210], "mk": [1781, 1829], "mm": 1838, "mo_diis_num_vec": [931, 1213, 1798], "mo_maxit": [932, 1213, 1225, 1267, 1798], "mo_read": [1186, 1222, 1225, 1268], "mo_step_max": [933, 1213, 1225, 1269], "mo_writ": [1225, 1270], "mode": 1772, "model": [1749, 1754, 1803, 1829], "modifi": 1824, "modul": [719, 1207, 1705, 1709, 1735, 1738, 1739, 1742, 1756, 1757, 1771, 1772, 1798, 1801, 1814, 1827, 1828], "modular": 1808, "modulenotfounderror": 1738, "mograd_damp": [1225, 1271], "molden": [314, 1772, 1791], "molden_with_virtu": [1145, 1221, 1791], "molden_writ": [934, 1213, 1231, 1578, 1791], "moldenwrit": 104, "molecul": [106, 1782, 1832, 1833], "moleculargrid": 105, "molecule_get_attr": 315, "molecule_set_attr": 316, "mom_occ": [1231, 1579], "mom_start": [1231, 1580], "mom_vir": [1231, 1581], "momentum": 1738, "monom": 1837, "more": 1824, "mospac": 98, "mowrit": 99, "mp": 1798, "mp2": [1733, 1756, 1763, 1806, 1837], "mp2_amp_typ": [935, 1213], "mp2_amps_print": [448, 1199, 1742], "mp2_ccsd_method": [1229, 1417], "mp2_guess": [1229, 1418], "mp2_os_scal": [449, 907, 936, 1199, 1212, 1213, 1225, 1272, 1798], "mp2_scale_o": [1081, 1219, 1771], "mp2_scale_ss": [1082, 1219, 1771], "mp2_sos_scal": [937, 1213, 1225, 1273, 1798], "mp2_sos_scale2": [938, 1213, 1225, 1274, 1798], "mp2_ss_scale": [450, 908, 939, 1199, 1212, 1213, 1225, 1275, 1798], "mp2_type": [1146, 1221], "mp4": 1771, "mp_type": [1147, 1221], "mpn": [861, 1210, 1755], "mpn_order_sav": [862, 1210], "mpn_schmidt": [863, 1210], "mpn_wigner": [864, 1210], "mrcc": [1224, 1683, 1723, 1781, 1792, 1829], "mrcc_generate_input": 216, "mrcc_level": [1224, 1235], "mrcc_load_dens": 217, "mrcc_method": [1224, 1236], "mrcc_num_doublet_root": [1224, 1237], "mrcc_num_singlet_root": [1224, 1238], "mrcc_num_triplet_root": [1224, 1239], "mrcc_omp_num_thread": [1224, 1240], "mrcc_restart": [1224, 1241], "ms0": [865, 1210], "mukherje": 1781, "multi": [1781, 1789, 1802], "multipl": [1755, 1833], "multipol": 1775, "multipoleint": 107, "multipolesymmetri": 108, "multirefer": 1810, "m\u00f8ller": [1756, 1798], "nablaint": 109, "name": [1738, 1785, 1786, 1810], "nat_orb": [866, 940, 1083, 1210, 1213, 1219, 1225, 1276, 1771, 1798], "nat_orbs_t2": [1230, 1459, 1837], "nat_orbs_t3": [1230, 1460, 1837], "nat_orbs_v4": [1230, 1461, 1837], "natur": [1763, 1771, 1837], "nbc10": [1692, 1752], "ncb31": [1692, 1752], "necessari": 1735, "need": [1746, 1824], "nest": 1779, "network": 1806, "new": [1788, 1808, 1815, 1817, 1819, 1821, 1823, 1825], "new_tripl": [451, 486, 1199, 1200], "next": 1788, "nhtbh": [1692, 1752], "nl": 1760, "nl_dispersion_paramet": [1231, 1582], "no_dfil": [867, 1210], "no_singl": [1229, 1419], "non": [1736, 1786, 1798, 1833], "none": [1694, 1695, 1696, 1697, 1699, 1700, 1701, 1702, 1706, 1707, 1708, 1731, 1732, 1733, 1735, 1736, 1737, 1739, 1742, 1743, 1746, 1748, 1758, 1764, 1777, 1778, 1780, 1781, 1797, 1799, 1802, 1804, 1810, 1814, 1815, 1816, 1817, 1818, 1819, 1824, 1825, 1827, 1830, 1833, 1838, 1844], "normal": 1772, "normal_modes_writ": [1027, 1217, 1772], "note": [1770, 1795, 1796], "nottoli": 1754, "null": 1821, "nullptr": 1821, "num_amps_print": [452, 487, 525, 549, 868, 1199, 1200, 1202, 1203, 1210, 1742], "num_core_orbit": [1, 406, 1197], "num_dets_print": [869, 1210], "num_frozen_docc": [1148, 1221], "num_frozen_uocc": [1149, 1221], "num_guess": [0, 1, 407, 1197], "num_init_vec": [870, 1210], "num_root": [871, 1210, 1755], "numer": 1754, "numinthelp": 110, "numpi": 1797, "o": 1738, "o24by5": [1692, 1752], "o24by5mb": [1692, 1752], "objdir": 1738, "object": [2, 1746, 1768, 1797, 1817], "obtain": [1736, 1737, 1738], "occ": [218, 1225, 1684, 1798], "occ_orbs_print": [941, 1213, 1225, 1277, 1798], "occ_percentag": [1084, 1219], "occ_toler": [1085, 1219, 1230, 1462, 1771, 1837], "occup": 1231, "odc_guess": [742, 1208], "oeprop": [111, 317, 365, 942, 1213, 1225, 1278, 1685, 1799], "offdiagonal_ccsd_t": [1229, 1420], "old": 2, "older": 1817, "omega": [550, 1203, 1742], "omega_erf": [1196, 1223], "one": [1799, 1841], "onebodyaoint": 112, "onebodysoint": 113, "onepdm": [909, 1212], "onepot_grid_read": [1231, 1583], "oo": 1798, "oo_scal": [943, 1213], "opdm": [743, 872, 1208, 1210, 1755], "opdm_onli": [416, 1198], "opdm_relax": [417, 910, 1198, 1212], "open": [1777, 1837], "oper": [1817, 1823], "opt": 318, "opt_coordin": [1226, 1352], "opt_method": [944, 1213, 1225, 1279, 1798], "opt_restart": [1226, 1353], "opt_typ": [1226, 1354, 1802], "optim": [319, 1226, 1781, 1798, 1800, 1802, 1828, 1844], "optima": [1694, 1695, 1696, 1697, 1699, 1700, 1701, 1702, 1706, 1707, 1708, 1731, 1732, 1733, 1735, 1736, 1737, 1739, 1742, 1743, 1746, 1748, 1758, 1764, 1777, 1778, 1780, 1781, 1797, 1799, 1802, 1804, 1810, 1814, 1815, 1816, 1817, 1818, 1819, 1824, 1825, 1827, 1830, 1833, 1838, 1844], "optimizationconvergenceerror": 270, "optimize_geometr": 320, "option": [114, 1210, 1214, 1735, 1738, 1750, 1767, 1775, 1791, 1795, 1796, 1801, 1836], "option_exists_in_modul": 219, "options_to_python": 220, "optionsst": 327, "optionsstatecm": 328, "optionst": 326, "optk": [1226, 1802], "orb_opt": [945, 1213, 1225, 1280, 1798], "orb_resp_solv": [946, 1213, 1225, 1281], "orbit": [1733, 1750, 1755, 1763, 1770, 1771, 1781, 1789, 1798, 1810, 1829, 1837], "orbital_level_shift": [744, 1208], "orbitals_writ": [1231, 1584], "orbitalspac": 115, "order": [1210, 1755, 1756, 1770, 1829, 1833, 1837, 1838], "org": 1788, "organ": 1830, "origin": 1799, "orth_typ": [947, 1213, 1225, 1282, 1798], "orthogon": 1838, "os_scal": [1225, 1283], "other": [1733, 1770], "outfile_nam": 221, "output": [2, 1740, 1743, 1752, 1786, 1802, 1843], "overal": 1781, "overlap": 1739, "overlap_check": [488, 1200], "overlapint": 116, "overrid": 1821, "overview": [1781, 1815, 1817], "p": [1232, 1665, 1694, 1695, 1696, 1697, 1699, 1700, 1701, 1702, 1706, 1707, 1708, 1731, 1732, 1733, 1735, 1736, 1737, 1739, 1742, 1743, 1746, 1748, 1758, 1764, 1777, 1778, 1780, 1781, 1797, 1799, 1802, 1804, 1810, 1814, 1815, 1816, 1817, 1818, 1819, 1824, 1825, 1827, 1830, 1833, 1838, 1843, 1844], "p4util": 1827, "packag": [1737, 1748, 1759, 1781, 1788, 1827], "page": 1788, "pair": [1763, 1771, 1817], "pair_energies_print": [453, 1199], "parallel": [1231, 1585, 1840], "paramet": 1754, "parent_symmetri": [1150, 1221], "parsingerror": 271, "particl": 1757, "partit": 1770, "pass": 1788, "pasturerequirederror": 272, "path": [1738, 1802, 1804], "pb": [1738, 1767], "pcg_beta_typ": [948, 1213, 1225, 1284], "pcg_converg": [949, 1213, 1225, 1285], "pcg_maxit": [950, 1213, 1225, 1286], "pcm": [1151, 1221, 1227, 1686, 1803], "pcm_cc_type": [1227, 1375, 1803], "pcm_helper": [366, 379], "pcm_scf_type": [1227, 1376, 1803], "pcmsolver": [1724, 1803], "pcmsolver_parsed_fnam": [1227, 1377], "pe": [1152, 1221, 1228, 1687, 1749], "pe_ecp": [1228, 1392], "pep1": 1804, "permit": 1779, "permut": 1817, "perturb": [1210, 1755, 1756, 1771, 1781, 1798, 1837], "perturb_cb": [1229, 1421], "perturb_cbs_coupl": [1229, 1422], "perturb_dipol": [1231, 1586], "perturb_h": [1231, 1587], "perturb_magnitud": [873, 1210, 1231, 1588], "perturb_with": [1231, 1589], "petersson": 1733, "petitelist": 118, "phi_point": [1231, 1590], "photon": 1841, "physic": [1706, 1832], "pk_all_nonsym": [1231, 1591], "pk_max_bucket": [1231, 1592], "plain": 2, "plan": [1738, 1830], "plesset": [1756, 1798], "plot": 1841, "plugin": [222, 1746, 1807, 1808, 1824], "plugin_clos": 223, "plugin_close_al": 224, "plugin_load": 225, "plump_qcvar": 367, "pmlocal": 117, "pno_converg": [975, 1214], "point": [1028, 1217, 1766, 1770], "pointfunct": 119, "pointgroup": 120, "polar": 0, "polariz": [1749, 1803], "popl": 1733, "post": [1760, 1781, 1788, 1838], "postreleas": 1788, "potenti": [1730, 1817, 1828, 1838, 1844], "potentialint": 121, "potfil": [1228, 1393, 1749], "ppl_type": [951, 1213], "practic": 1830, "pre": [1788, 1808], "precondition": [874, 1210], "prefactor_ecd": 368, "prefactor_opa": 369, "prefer": 1821, "prepare_options_for_modul": [226, 370], "prepare_options_for_set_opt": 371, "prerequisit": 1750, "primitivetyp": 122, "print": [720, 1021, 1153, 1207, 1216, 1221, 1230, 1463, 1821, 1837], "print_basi": [1231, 1593], "print_global_opt": 227, "print_mo": [1231, 1594], "print_molden_vib": 388, "print_noon": [1154, 1221], "print_opt": 228, "print_opt_param": [1226, 1355], "print_out": 229, "print_trajectory_xyz_fil": [1226, 1356], "print_vari": 230, "print_vib": 389, "pritchard": 1839, "problem": 1798, "problemat": 1802, "proc": 1809, "procedur": 1788, "process_grid": [1231, 1595], "process_input": 380, "profil": 1813, "program": [1769, 1812, 1818], "programm": [1764, 1777, 1814, 1825], "prop": [123, 381], "prop_al": [418, 526, 1198, 1202], "prop_root": [419, 489, 527, 1198, 1200, 1202], "prop_sym": [420, 490, 528, 1198, 1200, 1202], "propag": 0, "properti": [382, 454, 551, 1155, 1199, 1203, 1221, 1742, 1799, 1826], "properties_origin": [1156, 1221], "propos": 1804, "protointvector": 124, "protovector": 125, "provenance_stamp": 372, "psi": [400, 1709, 1776, 1795, 1832], "psi4": [0, 1, 1206, 1737, 1738, 1746, 1748, 1749, 1754, 1762, 1765, 1772, 1773, 1775, 1782, 1783, 1784, 1785, 1786, 1788, 1803, 1810, 1824, 1827, 1828, 1839], "psi4conda": [1748, 1788], "psi4fockci": 1805, "psi4numpi": [1725, 1824], "psi4rc": 1767, "psi_top_srcdir": 231, "psiapi": [2, 1738, 1828, 1841], "psicod": 1788, "psidatadir": 1738, "psiexcept": 273, "psimrcc": [232, 1229, 1688, 1829], "psio_entri": 233, "psioh": 1708, "psipep": [1804, 1830], "psireturntyp": 126, "psithon": [2, 1779, 1831, 1832, 1841, 1844], "pt_energi": [1229, 1423], "pubchem": 1833, "publish": 1788, "puream": [1157, 1221], "py": [2, 1809], "pymol": 1770, "pytest": 2, "python": [1726, 1738, 1822, 1823, 1827, 1828, 1832, 1833], "q": 1817, "qc": 1736, "qc_coupl": [745, 1208], "qc_modul": [1158, 1221, 1739, 1742, 1756, 1757, 1771, 1798], "qc_type": [746, 1208], "qca": 2, "qcdb": 1772, "qchf": [952, 1213, 1231, 1596], "qcisd": 1771, "qcvariabl": 400, "qm": 1838, "qmefp": [1022, 1216], "qmmm": 274, "qmmmbohr": 275, "quadrat": 1771, "quadrupoleint": 127, "quantum": 1777, "queue": 1738, "quick": 1748, "quiz": 1737, "r": [1765, 1803], "r4": [875, 1210], "r_converg": [0, 1, 408, 455, 491, 529, 552, 747, 876, 953, 976, 1086, 1197, 1199, 1200, 1202, 1203, 1208, 1210, 1213, 1214, 1219, 1225, 1229, 1287, 1424, 1742, 1755, 1771, 1798], "r_point": [1231, 1597], "radiu": [1231, 1598], "rang": [1701, 1758], "ranged_bend": [1226, 1357], "ranged_dihedr": [1226, 1358], "ranged_dist": [1226, 1359], "ranged_oofp": [1226, 1360], "rapid": 1824, "ras1": [1159, 1221], "ras2": [1160, 1221], "ras3": [1161, 1221], "ras34_max": [877, 1210], "ras3_max": [878, 1210], "ras4": [1162, 1221], "ras4_max": [879, 1210], "reaction": 1802, "read": 1801, "read_opt": 1785, "read_scf_3index": [954, 1213], "rebuild": 1738, "recommend": [1735, 1753, 1756, 1757, 1763, 1838], "ref": [2, 1786], "refer": [0, 1, 409, 421, 456, 492, 553, 560, 565, 748, 880, 1187, 1197, 1198, 1199, 1200, 1203, 1204, 1205, 1208, 1210, 1222, 1231, 1599, 1738, 1742, 1755, 1762, 1781], "reference_sym": [881, 1210], "reg_param": [955, 1213], "regular": [956, 1213], "reiher": 1762, "relat": 1742, "relativist": [1163, 1221, 1762, 1781, 1836], "relax": [1225, 1288], "relax_guess_orbit": [749, 1208], "releas": [1788, 1814], "remigio": 1803, "remot": 1786, "remov": 1786, "remp_a": [957, 1213, 1225, 1289], "renorm": [1746, 1781], "reopen_outfil": 234, "repl_otf": [882, 1210], "report": 1816, "repositori": [1737, 1738], "repres": 1770, "represent": 1833, "requir": [1738, 1815], "respons": 1742, "response_algorithm": [750, 1208], "restart": [457, 530, 554, 883, 1199, 1202, 1203, 1210, 1742, 1767, 1838], "restart_eom_cc3": [493, 1200], "restricted_docc": [1164, 1221, 1755], "restricted_uocc": [1165, 1221, 1755], "restructuredtext": 1764, "result": [1772, 1832, 1837], "retain": 1738, "return": 1832, "review": 1786, "revoke_global_option_chang": 235, "revoke_local_option_chang": 236, "rfo_follow_root": [1226, 1361], "rfo_normalization_max": [1226, 1362], "rfo_root": [1226, 1363], "rgc10": [1692, 1752], "rhf": 128, "rhf_triplet": [494, 1200], "rksfunction": 129, "rms_disp_g_converg": [1226, 1364], "rms_force_g_converg": [1226, 1365], "rms_mograd_converg": [958, 1213, 1225, 1290, 1798], "rohf": 130, "role": 1804, "root": [1210, 1755], "roots_per_irrep": [1, 410, 422, 495, 531, 1197, 1198, 1200, 1202, 1742], "rotate_mo_angl": [1188, 1222], "rotate_mo_irrep": [1189, 1222], "rotate_mo_p": [1190, 1222], "rotate_mo_q": [1191, 1222], "rotational_symmetry_numb": [1232, 1666, 1843], "routin": 1810, "rse42": [1692, 1752], "rsrfo_alpha_max": [1226, 1366], "run": [0, 2, 1736, 1738, 1739, 1742, 1743, 1747, 1750, 1756, 1757, 1759, 1771, 1774, 1781, 1782, 1786, 1788, 1792, 1798, 1828, 1844], "run_ccsd": [1087, 1219, 1771], "run_cctransort": [561, 1204], "run_cepa": [1088, 1219, 1771], "run_mp2": [1089, 1219, 1771], "run_mp3": [1090, 1219, 1771], "run_mp4": [1091, 1219, 1771], "runtim": [1231, 1736, 1738, 1767], "s2": 1837, "s22": [1692, 1752], "s22by5": [1692, 1752], "s66": [1692, 1752], "s66by8": [1692, 1752], "s_cholesky_toler": [1231, 1600], "s_cut": [977, 1214], "s_orthogon": [1231, 1601], "s_toler": [1231, 1602], "sad": 1231, "sad_chol_toler": [1231, 1603], "sad_d_converg": [1231, 1604], "sad_e_converg": [1231, 1605], "sad_frac_occ": [1231, 1606], "sad_maxit": [1231, 1607], "sad_print": [1231, 1608], "sad_scf_typ": [1231, 1609], "sad_spin_averag": [1231, 1610], "sadguess": 131, "salccompon": 134, "sampl": [1788, 1805, 1806, 1842, 1844], "san": [1694, 1695, 1696, 1697, 1699, 1700, 1701, 1702, 1706, 1707, 1708, 1731, 1732, 1733, 1735, 1736, 1737, 1739, 1742, 1743, 1746, 1748, 1758, 1764, 1777, 1778, 1780, 1781, 1797, 1799, 1802, 1804, 1810, 1814, 1815, 1816, 1817, 1818, 1819, 1824, 1825, 1827, 1830, 1833, 1838, 1844], "sanitize_method": [373, 391], "sanitize_nam": 392, "saon": 1770, "sapgau_basi": [1231, 1611], "sapt": [237, 1230, 1231, 1612, 1689, 1770, 1781, 1837], "sapt0": 1837, "sapt0_e10": [1230, 1464], "sapt0_e20disp": [1230, 1465], "sapt0_e20ind": [1230, 1466], "sapt_dft_do_dhf": [1230, 1467, 1837], "sapt_dft_do_hybrid": [1230, 1468, 1837], "sapt_dft_exch_disp_fixed_scal": [1230, 1469, 1837], "sapt_dft_exch_disp_scale_schem": [1230, 1470, 1837], "sapt_dft_funct": [1230, 1471, 1837], "sapt_dft_grac_determin": [1230, 1472], "sapt_dft_grac_shift_a": [1230, 1473, 1837], "sapt_dft_grac_shift_b": [1230, 1474, 1837], "sapt_dft_mp2_disp_alg": [1230, 1475, 1837], "sapt_fdds_disp_leg_lambda": [1230, 1476], "sapt_fdds_disp_num_point": [1230, 1477], "sapt_fdds_v2_rho_cutoff": [1230, 1478], "sapt_level": [1230, 1479, 1837], "sapt_mem_check": [1230, 1480, 1837], "sapt_mem_factor": [1230, 1481], "sapt_mem_safeti": [1230, 1482, 1837], "sapt_quiet": [1230, 1483, 1837], "satisfi": 1738, "save": [1738, 1760, 1767], "save_jk": [1231, 1613], "save_optim": [1226, 1367], "save_uhf_no": [1231, 1614], "savetyp": 135, "sc": 1758, "scalar": [1781, 1836], "scalar_vari": [238, 239], "scale": [1798, 1806, 1837], "scan": [1828, 1844], "scatter": 240, "scf": [1231, 1690, 1757, 1760, 1790, 1838], "scf_helper": 393, "scf_initial_acceler": [1231, 1615], "scf_initial_finish_diis_transit": [1231, 1616], "scf_initial_start_diis_transit": [1231, 1617], "scf_mem_safety_factor": [1231, 1618], "scf_properti": [1231, 1619], "scf_subtyp": [1231, 1620], "scf_type": [721, 1166, 1207, 1221], "scf_wavefunction_factori": 394, "scfconvergenceerror": 276, "scfgrad": 241, "scfhess": 242, "scheme": 1740, "scheurer": [1, 1749], "schmidt_add_residual_toler": [496, 1200, 1742], "scratch": [1738, 1767], "screen": [1167, 1221, 1817], "script": [1750, 1788], "scs_ccsd": [458, 1092, 1199, 1219, 1771], "scs_cepa": [1093, 1219], "scs_mp2": [459, 1094, 1199, 1219, 1771], "scs_type": [959, 1213, 1225, 1291], "scsn_mp2": [460, 1199], "second": 1838, "see": 1738, "sekino": [532, 555, 1202, 1203], "select": [1757, 1829], "selector": [1739, 1742, 1756, 1757, 1771, 1781, 1798], "self": 1789, "semicanon": [461, 497, 562, 566, 1199, 1200, 1204, 1205], "seminumer": 1838, "serif": [1694, 1695, 1696, 1697, 1699, 1700, 1701, 1702, 1706, 1707, 1708, 1731, 1732, 1733, 1735, 1736, 1737, 1739, 1742, 1743, 1746, 1748, 1758, 1764, 1777, 1778, 1780, 1781, 1797, 1799, 1802, 1804, 1810, 1814, 1815, 1816, 1817, 1818, 1819, 1824, 1825, 1827, 1830, 1833, 1838, 1844], "set": [400, 1694, 1707, 1730, 1731, 1732, 1733, 1738, 1740, 1788, 1794, 1802, 1820, 1832, 1836], "set_active_molecul": 243, "set_array_vari": 244, "set_datadir": 245, "set_global_opt": 246, "set_global_option_python": 247, "set_local_opt": 248, "set_local_option_python": 249, "set_memori": [374, 395], "set_memory_byt": 250, "set_module_opt": [375, 396], "set_num_thread": 251, "set_opt": [376, 397], "set_output_fil": 252, "set_psi_file_prefix": 253, "set_scalar_vari": 254, "set_vari": 255, "setup": 1736, "sf_restrict": [885, 1210], "shaw": [1765, 1806], "shell": [662, 1206, 1817, 1837], "shellinfo": 136, "should": 1823, "si": [1694, 1695, 1696, 1697, 1699, 1700, 1701, 1702, 1706, 1707, 1708, 1731, 1732, 1733, 1735, 1736, 1737, 1739, 1742, 1743, 1746, 1748, 1758, 1764, 1777, 1778, 1780, 1781, 1797, 1799, 1802, 1804, 1810, 1814, 1815, 1816, 1817, 1818, 1819, 1824, 1825, 1827, 1830, 1833, 1838, 1844], "siaon": 1770, "siev": 1817, "sigma_overlap": [886, 1210], "simint": [1727, 1839], "simpl": [1751, 1829], "singl": [1739, 1742, 1756, 1757, 1766, 1771, 1798, 1837], "singles_print": [498, 1200, 1742], "site": 1748, "size": [1694, 1695, 1696, 1697, 1699, 1700, 1701, 1702, 1706, 1707, 1708, 1731, 1732, 1733, 1735, 1736, 1737, 1739, 1742, 1743, 1746, 1748, 1758, 1764, 1777, 1778, 1780, 1781, 1797, 1799, 1802, 1804, 1810, 1814, 1815, 1816, 1817, 1818, 1819, 1824, 1825, 1827, 1830, 1833, 1838, 1844], "slack": 1816, "slice": 137, "small_cutoff": [1229, 1425], "smith": 1773, "sn": 1806, "snapshot": 1788, "snlink": 1231, "snlink_basis_toler": [1231, 1621], "snlink_density_toler": [1231, 1622], "snlink_force_cartesian": [1231, 1623], "snlink_gpu_mem": [1231, 1624], "snlink_grid_batch_s": [1231, 1625], "snlink_integrator_kernel": [1231, 1626], "snlink_ints_toler": [1231, 1627], "snlink_load_balancer_kernel": [1231, 1628], "snlink_lwd_kernel": [1231, 1629], "snlink_mol_weights_kernel": [1231, 1630], "snlink_pruning_schem": [1231, 1631], "snlink_radial_point": [1231, 1632], "snlink_radial_schem": [1231, 1633], "snlink_reduction_kernel": [1231, 1634], "snlink_spherical_point": [1231, 1635], "snlink_use_debug_grid": [1231, 1636], "snlink_use_gpu": [1231, 1637], "snsmp2": 1728, "so": 1810, "sobasisset": 132, "socc": [1168, 1192, 1221, 1222], "solv": 1738, "solvat": 1754, "solvent": 1754, "solver": 1754, "solver_converg": [722, 1207, 1231, 1638], "solver_maxit": [723, 1207, 1231, 1639], "solver_n_guess": [724, 1207, 1231, 1640], "solver_n_root": [1231, 1641], "solver_precondit": [725, 1207], "solver_roots_per_irrep": [1231, 1642], "solverengin": 329, "somcscf": 133, "sos_typ": [960, 1213, 1225, 1292], "soscf": [1231, 1643], "soscf_conv": [1231, 1644], "soscf_max_it": [1231, 1645], "soscf_min_it": [1231, 1646], "soscf_print": [1231, 1647], "soscf_start_converg": [1231, 1648], "sourc": [1736, 1738, 1777], "space": [1755, 1789, 1805, 1810, 1829], "span": [1694, 1695, 1696, 1697, 1699, 1700, 1701, 1702, 1706, 1707, 1708, 1731, 1732, 1733, 1735, 1736, 1737, 1739, 1742, 1743, 1746, 1748, 1758, 1764, 1777, 1778, 1780, 1781, 1797, 1799, 1802, 1804, 1810, 1814, 1815, 1816, 1817, 1818, 1819, 1824, 1825, 1827, 1830, 1833, 1838, 1844], "specif": [1738, 1743, 1781, 1782, 1799, 1832, 1833, 1837], "spectra": 1841, "spectroscop": 1761, "spectrum": 377, "sphinx": 1764, "spin": [1755, 1757, 1798, 1805, 1806, 1837, 1838], "spin_scale_typ": [1225, 1293], "src": 1785, "ss_e_converg": [499, 1200], "ss_r_converg": [500, 1200], "ss_scale": [1225, 1294], "ss_skip_diag": [501, 1200], "ss_vecs_per_root": [502, 1200], "ssapt0_scal": [1064, 1218], "ssi": [1692, 1752], "stabil": [1231, 1838], "stability_add_vector": [751, 1208], "stability_analysi": [1231, 1649], "stability_augment_space_tol": [752, 1208], "stability_check": [753, 1208], "stability_converg": [754, 1208], "stability_max_space_s": [755, 1208], "stability_n_eigenvalu": [756, 1208], "stability_n_guess_vector": [757, 1208], "stack": 1788, "stage": 1738, "standard": 1733, "stanton": 1743, "start": 1737, "state": [1742, 1781, 1802], "state_to_atomicinput": 378, "std": 1821, "step": 1815, "step_typ": [1226, 1368, 1802], "stockhold": 1799, "stone": 1775, "strictli": 1738, "structur": [1764, 1785, 1828, 1832, 1844], "style": [1694, 1695, 1696, 1697, 1699, 1700, 1701, 1702, 1706, 1707, 1708, 1731, 1732, 1733, 1735, 1736, 1737, 1739, 1742, 1743, 1746, 1747, 1748, 1758, 1764, 1777, 1778, 1780, 1781, 1797, 1799, 1802, 1804, 1810, 1814, 1815, 1816, 1817, 1818, 1819, 1821, 1822, 1824, 1825, 1827, 1830, 1833, 1838, 1844], "subset": 1738, "substitut": 1833, "suggest": 1737, "suit": [2, 1842], "summari": [1733, 1753, 1781, 1802], "summation_field": [1228, 1394], "superfunct": 138, "superposit": 1794, "support": [1771, 1781], "surfac": [1828, 1844], "symbol": 1738, "symmetr": [1225, 1295], "symmetri": [1757, 1781, 1817, 1833, 1837, 1838], "symmetryoper": 139, "syntax": 1817, "system": 1781, "t": [1232, 1667, 1771, 1843], "t2_coupl": [462, 1199], "t3_ws_incor": [463, 503, 1199, 1200], "t_amp": [509, 1201], "t_cut_clmo": [978, 1214], "t_cut_cpao": [979, 1214], "t_cut_do": [980, 1214], "t_cut_do_ij": [981, 1214], "t_cut_do_pr": [982, 1214], "t_cut_mkn": [983, 1214], "t_cut_pno": [984, 1214], "t_cut_pr": [985, 1214], "tabl": 1832, "tag": [1786, 1788], "tarbal": 1737, "task": 1750, "tdm": [887, 1210, 1755], "tdscf": [398, 1231, 1841], "tdscf_coeff_cutoff": [1231, 1650, 1841], "tdscf_guess": [1231, 1651, 1841], "tdscf_maxit": [1231, 1652, 1841], "tdscf_print": [1231, 1653, 1841], "tdscf_r_converg": [1231, 1654, 1841], "tdscf_state": [1231, 1655, 1841], "tdscf_tda": [1231, 1656, 1841], "tdscf_tdm_print": [1231, 1657, 1841], "tdscf_triplet": [1231, 1658, 1841], "tdscfconvergenceerror": 277, "team": 1735, "technic": 1781, "technologi": 1823, "term": 1837, "test": [2, 1736, 1738, 1785, 1786, 1788, 1842], "test_b": [1226, 1369], "test_derivative_b": [1226, 1370], "test_input": 2, "test_matrix_dpd_interfac": 256, "testcomparisonerror": 278, "text": [1694, 1695, 1696, 1697, 1699, 1700, 1701, 1702, 1706, 1707, 1708, 1731, 1732, 1733, 1735, 1736, 1737, 1739, 1742, 1743, 1746, 1748, 1758, 1764, 1777, 1778, 1780, 1781, 1797, 1799, 1802, 1804, 1810, 1814, 1815, 1816, 1817, 1818, 1819, 1824, 1825, 1827, 1830, 1833, 1838, 1844], "than": 1738, "theoret": [1771, 1781, 1790, 1798], "theori": [1210, 1742, 1753, 1755, 1756, 1757, 1759, 1763, 1771, 1781, 1798, 1829, 1836, 1837, 1838, 1841], "thermo": [390, 1232, 1691], "thermochem": 1843, "theta_point": [1231, 1659], "thick": [1231, 1660], "thread": 1767, "three": 1759, "three_particl": [758, 1208], "threecenteroverlapint": 141, "through": [1746, 1747, 1769, 1771, 1772, 1798], "tikhonow_max": [1229, 1426], "tikhonow_omega": [759, 1208, 1229, 1427], "tikhonow_tripl": [1229, 1428], "tile_sz": [1231, 1661], "time": [1760, 1841], "timer_off": 257, "timer_on": 258, "tlaplacedenomin": 140, "tool": [1738, 1747], "top": [1737, 1786], "tpdm": [888, 1210], "tpdm_abcd_typ": [1225, 1296, 1798], "tracelessquadrupoleint": 142, "transfer": 1837, "transform": [1694, 1695, 1696, 1697, 1699, 1700, 1701, 1702, 1706, 1707, 1708, 1731, 1732, 1733, 1735, 1736, 1737, 1739, 1742, 1743, 1746, 1748, 1758, 1764, 1777, 1778, 1780, 1781, 1797, 1799, 1802, 1804, 1810, 1814, 1815, 1816, 1817, 1818, 1819, 1824, 1825, 1827, 1830, 1833, 1838, 1844], "transit": 1802, "translate_psi4": [713, 1206], "treatment": [1757, 1838], "tree_expansion_ord": [1228, 1395], "tree_theta": [1228, 1396], "triples_algorithm": [1229, 1429], "triples_dii": [1229, 1430], "triples_iabc_typ": [961, 1213], "triples_low_memori": [1095, 1219, 1771], "triplet": 259, "truncat": 1733, "tstart": 260, "tstop": 261, "turn_on_actv": [1193, 1222], "tutori": [1778, 1828, 1844], "tweak": 1788, "twobodyaoint": 143, "twoelectronint": 144, "txt": 2, "type": [1739, 1742, 1756, 1757, 1771, 1781, 1798, 1821, 1838], "uhf": [145, 1231], "uhf_noon": [1231, 1662], "uk": 1231, "uksfunct": 146, "undefin": [1738, 1786], "underlin": [1739, 1742, 1756, 1757, 1771, 1781, 1798], "unfreeze_dihedr": [1226, 1371], "unspecifi": [1739, 1742, 1756, 1757, 1771, 1781, 1798], "up": [1738, 1820], "updat": [889, 1210, 1226, 1736, 1738, 1748, 1764, 1788], "upgradehelp": 279, "us": [1735, 1738, 1748, 1749, 1754, 1757, 1785, 1803, 1808, 1810, 1816, 1817, 1821, 1824, 1828, 1833, 1844], "usag": 1841, "use_df_int": [1096, 1219], "use_spin_sym": [1229, 1431], "use_spin_symmetri": [1229, 1432], "user": [1730, 1735, 1743, 1764, 1802], "usr": 1738, "v": 1828, "v1": 1788, "v2rdm_casscf": [1729, 1807], "val_ex_level": [890, 1210], "valeev": 1783, "validationerror": 280, "valu": [1735, 1832], "variabl": [262, 263, 400, 1709, 1735, 1767, 1776, 1795, 1832], "variant": 1759, "vbase": 147, "vecs_cc3": [504, 1200], "vecs_per_root": [505, 1200], "vector": [148, 1210], "vector3": 149, "versa": 1738, "version": [264, 1738, 1786, 1814], "vi": 1738, "via": 1736, "vib": 1772, "vibanal_wfn": 399, "vibrat": [1772, 1828, 1843, 1844], "vice": 1738, "view": 1797, "virtual": 1821, "visual": [1750, 1770, 1772], "vmd": 1750, "wabei_lowdisk": [510, 1201], "wai": 1824, "wavefunct": [150, 1231, 1767, 1772], "wcombin": [1231, 1663], "welcom": 1825, "wfn": [423, 464, 506, 511, 533, 556, 563, 567, 891, 1169, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1210, 1221, 1231, 1664], "wfn_sym": [1194, 1222, 1229, 1433], "wfn_type": [962, 1213, 1225, 1297, 1798], "what": [1737, 1738, 1748, 1786, 1801], "when": [1735, 1738, 1739, 1742, 1746, 1747, 1756, 1757, 1771, 1781, 1798], "where": [1816, 1823], "why": 1738, "within": 1738, "without": [1738, 1786, 1837], "wolf": 1762, "workflow": [1737, 1814], "worth": 1738, "wouter": 1746, "wrapper": [1810, 1832], "write_no": [424, 1198], "write_opt_histori": [1226, 1372], "write_opt_result": [1226, 1373], "write_trajectori": [1226, 1374], "writer_file_label": [1170, 1221, 1772, 1791], "xi": [425, 1198], "xi_connect": [426, 1198], "yapf": 1747, "year": 1788, "your": [1747, 1820], "zero_internal_amp": [1229, 1434], "zeta": [427, 534, 1198, 1202]}})
\ No newline at end of file
+Search.setIndex({"alltitles": {"<span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span> API: Linking C++ and Python": [[1827, null]], "<span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span> Data Objects with Irreps": [[1797, "psifour-data-objects-with-irreps"]], "<span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span> for Cfour Users": [[1743, "psifour-for-cfour-users"]], "<span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>: Open-Source Quantum Chemistry": [[1777, null]], "A <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span> Tutorial": [[1778, null]], "A First Example": [[1836, "a-first-example"], [1837, "a-first-example"]], "A Simple Example": [[1829, "a-simple-example"]], "A24": [[1692, "a24"], [1752, "a24"]], "A24alt": [[1692, "a24alt"], [1752, "a24alt"]], "ABCD": [[428, null], [465, null], [512, null], [535, null], [1199, "abcd"], [1200, "abcd"], [1202, "abcd"], [1203, "abcd"]], "ACENES": [[1692, "acenes"], [1752, "acenes"]], "ACTIVE": [[1102, null], [1221, "active"]], "ACTIVE_NAT_ORBS": [[1065, null], [1219, "active-nat-orbs"]], "ADC": [[1197, null], [1668, null]], "ADC capabilities of Psi4": [[0, "id8"]], "ADC: Ab Initio Polarization Propagator": [[0, null]], "ADD_AUXILIARY_BONDS": [[1226, "add-auxiliary-bonds"], [1298, null]], "AIO_CPHF": [[1230, "aio-cphf"], [1435, null], [1837, "aio-cphf"]], "AIO_DF_INTS": [[1230, "aio-df-ints"], [1436, null], [1837, "aio-df-ints"]], "ALGORITHM": [[726, null], [1208, "algorithm"]], "ANALYZE": [[429, null], [536, null], [1199, "analyze"], [1203, "analyze"]], "AOShellCombinationsIterator": [[3, null]], "AO_BASIS": [[411, null], [430, null], [513, null], [557, null], [727, null], [1198, "ao-basis"], [1199, "ao-basis"], [1202, "ao-basis"], [1204, "ao-basis"], [1208, "ao-basis"]], "API": [[1740, "api"], [1772, "api"], [1794, "api"]], "AUXILIARY_BOND_FACTOR": [[1226, "auxiliary-bond-factor"], [1299, null]], "AVG_STATES": [[783, null], [1210, "avg-states"]], "AVG_WEIGHTS": [[784, null], [1210, "avg-weights"]], "A_RAS3_MAX": [[782, null], [1210, "a-ras3-max"]], "Accessing integrals": [[1817, "accessing-integrals"]], "Adding Add-Ons": [[1785, null]], "Adding Methods to Driver": [[1809, null]], "Adding New Code to <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1819, null]], "Adding PSIthon Test Cases": [[2, "adding-psithon-test-cases"]], "Adding Point Charges to F/I-SAPT Computations": [[1770, "adding-point-charges-to-f-i-sapt-computations"]], "Adding PsiAPI Test Cases": [[2, "adding-psiapi-test-cases"]], "Additional Notes": [[1770, "additional-notes"]], "Advanced DFOCC Keywords": [[1798, "advanced-dfocc-keywords"]], "Advanced FNOCC Keywords": [[1771, "advanced-fnocc-keywords"]], "Advanced Functional Use and Manipulation": [[1757, "advanced-functional-use-and-manipulation"]], "Advanced I-SAPT Keywords for SAOn/SIAOn Partitionings": [[1770, "advanced-i-sapt-keywords-for-saon-siaon-partitionings"]], "Advanced Keywords for Higher-order SAPT": [[1837, "advanced-keywords-for-higher-order-sapt"]], "Advanced Keywords for SAPT(DFT)": [[1837, "advanced-keywords-for-sapt-dft"]], "Advanced OCC Keywords": [[1798, "advanced-occ-keywords"]], "Advanced Python": [[1833, "advanced-python"]], "Advanced SAPT0 Keywords": [[1837, "advanced-sapt0-keywords"]], "Advanced example": [[1837, "advanced-example"]], "Algebraic-Diagrammatic Construction methods (ADC)": [[1781, "algebraic-diagrammatic-construction-methods-adc"]], "Algorithms used for One Electron Integrals": [[1817, "id1"]], "Aliases": [[1740, "aliases"]], "All Available": [[1758, "all-available"]], "Allowed origin specifications": [[1799, "id3"]], "Analysis of Intermolecular Interactions": [[1844, "analysis-of-intermolecular-interactions"]], "Analytic Gradients": [[1753, "analytic-gradients"]], "AngularMomentumInt": [[4, null]], "Annual": [[1788, "annual"]], "Anticipate next release": [[1788, "anticipate-next-release"]], "Appendices": [[400, null]], "Arbitrary Order Coupled-Cluster Theory": [[1755, "arbitrary-order-coupled-cluster-theory"]], "Arbitrary Order Perturbation Theory": [[1755, "arbitrary-order-perturbation-theory"]], "Array to Matrix": [[1797, "array-to-matrix"]], "Assemble postrelease changes": [[1788, "assemble-postrelease-changes"]], "AtomicComputer": [[265, null]], "Auxiliary Basis Sets": [[1732, null]], "Auxiliary basis set defaults in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1694, null], [1732, "id1"]], "Auxiliary files in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1708, "id1"]], "Available ADC methods": [[0, "available-adc-methods"]], "Available Databases": [[1752, "available-databases"]], "Avoiding the need to modify Psi4, using plugins": [[1824, "avoiding-the-need-to-modify-psi4-using-plugins"]], "BAKERJCC93": [[1692, "bakerjcc93"], [1752, "bakerjcc93"]], "BAKERJCC96": [[1692, null], [1752, "bakerjcc96"]], "BASIC": [[1692, "basic"], [1752, "basic"]], "BASIS": [[898, null], [1195, null], [1212, "basis"], [1223, "basis"], [1230, "basis"], [1231, "basis"], [1437, null], [1484, null], [1771, "basis"], [1837, "basis"], [1837, "id22"]], "BASIS_GUESS": [[1231, "basis-guess"], [1485, null]], "BASIS_RELATIVISTIC": [[1103, null], [1221, "basis-relativistic"], [1836, "basis-relativistic"]], "BBI": [[1692, "bbi"], [1752, "bbi"]], "BCCD_MAXITER": [[431, null], [1199, "bccd-maxiter"]], "BENCH": [[1104, null], [1221, "bench"]], "BENCH12": [[1692, "bench12"], [1752, "bench12"]], "BENDAZZOLI": [[786, null], [1210, "bendazzoli"]], "BLAS Wrappers": [[1810, "blas-wrappers"]], "BORDER": [[1228, "border"], [1378, null], [1749, "border"]], "BORDER_N_REDIST": [[1228, "border-n-redist"], [1379, null], [1749, "border-n-redist"]], "BORDER_REDIST_ORDER": [[1228, "border-redist-order"], [1380, null], [1749, "border-redist-order"]], "BORDER_REDIST_POL": [[1228, "border-redist-pol"], [1381, null], [1749, "border-redist-pol"]], "BORDER_RMIN": [[1228, "border-rmin"], [1382, null], [1749, "border-rmin"]], "BORDER_RMIN_UNIT": [[1228, "border-rmin-unit"], [1383, null], [1749, "border-rmin-unit"]], "BORDER_TYPE": [[1228, "border-type"], [1384, null], [1749, "border-type"]], "BRIANQC": [[1710, null]], "BRIANQC_ENABLE": [[1105, null], [1221, "brianqc-enable"], [1735, "brianqc-enable"]], "BRUECKNER_MAXITER": [[1066, null], [1219, "brueckner-maxiter"]], "BRUECKNER_ORBS_R_CONVERGENCE": [[432, null], [1199, "brueckner-orbs-r-convergence"], [1742, "brueckner-orbs-r-convergence"]], "BSVec": [[5, null]], "B_RAS3_MAX": [[785, null], [1210, "b-ras3-max"]], "Basic DETCI Keywords": [[1755, "basic-detci-keywords"]], "Basic DFOCC Keywords": [[1798, "basic-dfocc-keywords"]], "Basic FNOCC Keywords": [[1771, "basic-fnocc-keywords"]], "Basic Input File Structure": [[1844, "basic-input-file-structure"]], "Basic Keywords": [[1742, "basic-keywords"], [1799, "basic-keywords"], [1802, "basic-keywords"]], "Basic Keywords Controlling MP2 NO Approximations": [[1837, "basic-keywords-controlling-mp2-no-approximations"]], "Basic Keywords for Higher-order SAPT": [[1837, "basic-keywords-for-higher-order-sapt"]], "Basic Keywords for SAPT(DFT)": [[1837, "basic-keywords-for-sapt-dft"]], "Basic MCSCF Keywords": [[1789, "basic-mcscf-keywords"]], "Basic OCC Keywords": [[1798, "basic-occ-keywords"]], "Basic SAPT0 Keywords": [[1837, "basic-sapt0-keywords"]], "Basics": [[1797, "basics"]], "Basis Set Superposition Corrections": [[1794, null]], "Basis Sets": [[400, "basis-sets"], [1730, null], [1832, "basis-sets"]], "Basis Sets by Element": [[1731, null]], "Basis Sets by Family": [[1733, null]], "Basis set availability by element in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1707, null], [1731, "id1"]], "Basis sets options": [[1836, "basis-sets-options"]], "BasisExtents": [[6, null]], "BasisFunctions": [[7, null]], "BasisSet": [[8, null]], "Bibliography": [[1734, null]], "Binary Installer": [[1737, "binary-installer"]], "BlockOPoints": [[9, null]], "BoysLocalizer": [[10, null]], "Broken Symmetry": [[1838, "broken-symmetry"]], "Buffer address": [[1817, "buffer-address"]], "Build & Run FAQ": [[1736, null]], "Build Conda ecosystem stack": [[1788, "build-conda-ecosystem-stack"]], "Build Docker images": [[1788, "build-docker-images"]], "Build Psi4conda set": [[1788, "build-psi4conda-set"]], "Build extra Conda packages for Psi4 channel": [[1788, "build-extra-conda-packages-for-psi4-channel"]], "Building <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span> with BrianQC": [[1735, "building-psifour-with-brianqc"]], "Building BrianQC\u2019s user-built components": [[1735, "building-brianqc-s-user-built-components"]], "Built-In Basis Sets": [[1730, "built-in-basis-sets"]], "C++ Style": [[1821, null]], "C++ Style in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1814, "c-style-in-psifour"]], "CACHELEVEL": [[412, null], [433, null], [466, null], [507, null], [514, null], [537, null], [558, null], [728, null], [1198, "cachelevel"], [1199, "cachelevel"], [1200, "cachelevel"], [1201, "cachelevel"], [1202, "cachelevel"], [1203, "cachelevel"], [1204, "cachelevel"], [1208, "cachelevel"], [1225, "cachelevel"], [1242, null], [1742, "cachelevel"]], "CACHETYPE": [[434, null], [467, null], [1199, "cachetype"], [1200, "cachetype"], [1742, "cachetype"]], "CALC_S_SQUARED": [[787, null], [1210, "calc-s-squared"]], "CANONICALIZE_ACTIVE_FAVG": [[1171, null], [1222, "canonicalize-active-favg"]], "CANONICALIZE_INACTIVE_FAVG": [[1172, null], [1222, "canonicalize-inactive-favg"]], "CARTESIAN_SYM_TOLERANCE": [[1226, "cartesian-sym-tolerance"], [1301, null]], "CART_HESS_READ": [[1226, "cart-hess-read"], [1300, null]], "CC": [[788, null], [1210, "cc"]], "CC3_FOLLOW_ROOT": [[468, null], [1200, "cc3-follow-root"]], "CC: Coupled Cluster Theory": [[1742, null]], "CCDENSITY": [[1198, null]], "CCD_E_CONVERGENCE": [[1230, "ccd-e-convergence"], [1438, null]], "CCD_MAXITER": [[1230, "ccd-maxiter"], [1439, null]], "CCD_T_CONVERGENCE": [[1230, "ccd-t-convergence"], [1440, null]], "CCENERGY": [[1199, null], [1669, null]], "CCEOM": [[1200, null]], "CCHBAR": [[1201, null]], "CCLAMBDA": [[1202, null]], "CCL_ENERGY": [[1225, "ccl-energy"], [1244, null]], "CCRESPONSE": [[1203, null]], "CCTRANSORT": [[1204, null]], "CCTRIPLES": [[1205, null]], "CCWavefunction": [[11, null]], "CC_A_RAS3_MAX": [[789, null], [1210, "cc-a-ras3-max"]], "CC_B_RAS3_MAX": [[790, null], [1210, "cc-b-ras3-max"]], "CC_DIIS_MAX_VECS": [[911, null], [1213, "cc-diis-max-vecs"]], "CC_DIIS_MIN_VECS": [[912, null], [1213, "cc-diis-min-vecs"]], "CC_EX_LEVEL": [[791, null], [1210, "cc-ex-level"]], "CC_FIX_EXTERNAL": [[792, null], [1210, "cc-fix-external"]], "CC_FIX_EXTERNAL_MIN": [[793, null], [1210, "cc-fix-external-min"]], "CC_LAMBDA": [[913, null], [1213, "cc-lambda"]], "CC_MACRO": [[794, null], [1210, "cc-macro"]], "CC_MAXITER": [[914, null], [1213, "cc-maxiter"], [1225, "cc-maxiter"], [1243, null]], "CC_MIXED": [[795, null], [1210, "cc-mixed"]], "CC_NUM_THREADS": [[435, null], [469, null], [564, null], [1199, "cc-num-threads"], [1200, "cc-num-threads"], [1205, "cc-num-threads"], [1229, "cc-num-threads"], [1397, null]], "CC_OS_SCALE": [[436, null], [1199, "cc-os-scale"]], "CC_RAS34_MAX": [[796, null], [1210, "cc-ras34-max"]], "CC_RAS3_MAX": [[797, null], [1210, "cc-ras3-max"]], "CC_RAS4_MAX": [[798, null], [1210, "cc-ras4-max"]], "CC_SCALE_OS": [[1067, null], [1219, "cc-scale-os"], [1771, "cc-scale-os"]], "CC_SCALE_SS": [[1068, null], [1219, "cc-scale-ss"], [1771, "cc-scale-ss"]], "CC_SS_SCALE": [[437, null], [1199, "cc-ss-scale"]], "CC_TIMINGS": [[1069, null], [1219, "cc-timings"], [1771, "cc-timings"]], "CC_TYPE": [[1106, null], [1221, "cc-type"]], "CC_UPDATE_EPS": [[799, null], [1210, "cc-update-eps"]], "CC_VAL_EX_LEVEL": [[800, null], [1210, "cc-val-ex-level"]], "CC_VARIATIONAL": [[801, null], [1210, "cc-variational"]], "CC_VECS_READ": [[802, null], [1210, "cc-vecs-read"]], "CC_VECS_WRITE": [[803, null], [1210, "cc-vecs-write"]], "CEPA_LEVEL": [[1070, null], [1219, "cepa-level"], [1771, "cepa-level"]], "CEPA_NO_SINGLES": [[1071, null], [1219, "cepa-no-singles"], [1771, "cepa-no-singles"]], "CEPA_OS_SCALE": [[1225, "cepa-os-scale"], [1245, null]], "CEPA_SOS_SCALE": [[1225, "cepa-sos-scale"], [1246, null]], "CEPA_SS_SCALE": [[1225, "cepa-ss-scale"], [1247, null]], "CEPA_TYPE": [[1225, "cepa-type"], [1248, null]], "CFOUR": [[1206, null], [1670, null], [1711, null]], "CFOUR Internal": [[1206, "cfour-internal"]], "CFOUR_ABCDTYPE": [[568, null], [1206, "cfour-abcdtype"]], "CFOUR_ACTIVE_ORBI": [[569, null], [1206, "cfour-active-orbi"]], "CFOUR_ANHARMONIC": [[574, null], [1206, "cfour-anharmonic"]], "CFOUR_ANH_ALGORITHM": [[570, null], [1206, "cfour-anh-algorithm"]], "CFOUR_ANH_DERIVATIVES": [[571, null], [1206, "cfour-anh-derivatives"]], "CFOUR_ANH_STEPSIZE": [[572, null], [1206, "cfour-anh-stepsize"]], "CFOUR_ANH_SYMMETRY": [[573, null], [1206, "cfour-anh-symmetry"]], "CFOUR_AO_LADDERS": [[575, null], [1206, "cfour-ao-ladders"]], "CFOUR_AV_SCF": [[576, null], [1206, "cfour-av-scf"]], "CFOUR_BASIS": [[577, null], [1206, "cfour-basis"]], "CFOUR_BRUCK_CONV": [[578, null], [1206, "cfour-bruck-conv"]], "CFOUR_BRUECKNER": [[579, null], [1206, "cfour-brueckner"]], "CFOUR_CACHE_RECS": [[580, null], [1206, "cfour-cache-recs"]], "CFOUR_CALC_LEVEL": [[581, null], [1206, "cfour-calc-level"]], "CFOUR_CC_CONV": [[582, null], [1206, "cfour-cc-conv"]], "CFOUR_CC_EXPORDER": [[583, null], [1206, "cfour-cc-exporder"]], "CFOUR_CC_EXTRAPOLATION": [[584, null], [1206, "cfour-cc-extrapolation"]], "CFOUR_CC_MAXCYC": [[585, null], [1206, "cfour-cc-maxcyc"]], "CFOUR_CC_PROGRAM": [[586, null], [1206, "cfour-cc-program"]], "CFOUR_CHARGE": [[587, null], [1206, "cfour-charge"]], "CFOUR_CIS_CONV": [[588, null], [1206, "cfour-cis-conv"]], "CFOUR_CONTINUUM": [[589, null], [1206, "cfour-continuum"]], "CFOUR_CONTRACTION": [[590, null], [1206, "cfour-contraction"]], "CFOUR_CONVERGENCE": [[591, null], [1206, "cfour-convergence"]], "CFOUR_COORDINATES": [[592, null], [1206, "cfour-coordinates"]], "CFOUR_CORE_ORBITALS": [[593, null], [1206, "cfour-core-orbitals"]], "CFOUR_CPHF_CONVER": [[594, null], [1206, "cfour-cphf-conver"]], "CFOUR_CPHF_MAXCYC": [[595, null], [1206, "cfour-cphf-maxcyc"]], "CFOUR_CURVILINEAR": [[596, null], [1206, "cfour-curvilinear"]], "CFOUR_DBOC": [[597, null], [1206, "cfour-dboc"]], "CFOUR_DCT": [[598, null], [1206, "cfour-dct"]], "CFOUR_DERIV_LEVEL": [[599, null], [1206, "cfour-deriv-level"]], "CFOUR_DIFF_TYPE": [[600, null], [1206, "cfour-diff-type"]], "CFOUR_DROPMO": [[601, null], [1206, "cfour-dropmo"]], "CFOUR_ECP": [[602, null], [1206, "cfour-ecp"]], "CFOUR_EIGENVECTOR": [[603, null], [1206, "cfour-eigenvector"]], "CFOUR_EL_ANHARM": [[604, null], [1206, "cfour-el-anharm"]], "CFOUR_EOM_NONIT": [[605, null], [1206, "cfour-eom-nonit"]], "CFOUR_ESTATE_CONV": [[606, null], [1206, "cfour-estate-conv"]], "CFOUR_ESTATE_MAXCYC": [[607, null], [1206, "cfour-estate-maxcyc"]], "CFOUR_ESTATE_PROP": [[608, null], [1206, "cfour-estate-prop"]], "CFOUR_ESTATE_SYM": [[609, null], [1206, "cfour-estate-sym"]], "CFOUR_ESTATE_TRANS": [[610, null], [1206, "cfour-estate-trans"]], "CFOUR_EVAL_HESS": [[611, null], [1206, "cfour-eval-hess"]], "CFOUR_EXCITATION": [[612, null], [1206, "cfour-excitation"]], "CFOUR_EXCITE": [[613, null], [1206, "cfour-excite"]], "CFOUR_FC_FIELD": [[614, null], [1206, "cfour-fc-field"]], "CFOUR_FD_CALCTYPE": [[615, null], [1206, "cfour-fd-calctype"]], "CFOUR_FD_IRREPS": [[616, null], [1206, "cfour-fd-irreps"]], "CFOUR_FD_PROJECT": [[617, null], [1206, "cfour-fd-project"]], "CFOUR_FD_STEPSIZE": [[618, null], [1206, "cfour-fd-stepsize"]], "CFOUR_FD_USEGROUP": [[619, null], [1206, "cfour-fd-usegroup"]], "CFOUR_FILE_RECSIZ": [[620, null], [1206, "cfour-file-recsiz"]], "CFOUR_FILE_STRIPE": [[621, null], [1206, "cfour-file-stripe"]], "CFOUR_FINITE_PERTURBATION": [[622, null], [1206, "cfour-finite-perturbation"]], "CFOUR_FOCK": [[623, null], [1206, "cfour-fock"]], "CFOUR_FREQ_ALGORITHM": [[624, null], [1206, "cfour-freq-algorithm"]], "CFOUR_FROZEN_CORE": [[625, null], [1206, "cfour-frozen-core"]], "CFOUR_FROZEN_VIRT": [[626, null], [1206, "cfour-frozen-virt"]], "CFOUR_GAMMA_ABCD": [[627, null], [1206, "cfour-gamma-abcd"]], "CFOUR_GENBAS_1": [[628, null], [1206, "cfour-genbas-1"]], "CFOUR_GENBAS_2": [[629, null], [1206, "cfour-genbas-2"]], "CFOUR_GENBAS_3": [[630, null], [1206, "cfour-genbas-3"]], "CFOUR_GENBAS_4": [[631, null], [1206, "cfour-genbas-4"]], "CFOUR_GEO_CONV": [[632, null], [1206, "cfour-geo-conv"]], "CFOUR_GEO_MAXCYC": [[633, null], [1206, "cfour-geo-maxcyc"]], "CFOUR_GEO_MAXSTEP": [[634, null], [1206, "cfour-geo-maxstep"]], "CFOUR_GEO_METHOD": [[635, null], [1206, "cfour-geo-method"]], "CFOUR_GIAO": [[636, null], [1206, "cfour-giao"]], "CFOUR_GRID": [[637, null], [1206, "cfour-grid"]], "CFOUR_GUESS": [[638, null], [1206, "cfour-guess"]], "CFOUR_HBAR": [[639, null], [1206, "cfour-hbar"]], "CFOUR_HFSTABILITY": [[640, null], [1206, "cfour-hfstability"]], "CFOUR_INCORE": [[641, null], [1206, "cfour-incore"]], "CFOUR_INPUT_MRCC": [[642, null], [1206, "cfour-input-mrcc"]], "CFOUR_INTEGRALS": [[643, null], [1206, "cfour-integrals"]], "CFOUR_JODA_PRINT": [[644, null], [1206, "cfour-joda-print"]], "CFOUR_LINEQ_CONV": [[645, null], [1206, "cfour-lineq-conv"]], "CFOUR_LINEQ_MAXCY": [[646, null], [1206, "cfour-lineq-maxcy"]], "CFOUR_LINEQ_TYPE": [[647, null], [1206, "cfour-lineq-type"]], "CFOUR_LOCK_ORBOCC": [[648, null], [1206, "cfour-lock-orbocc"]], "CFOUR_MAXSTEP": [[649, null], [1206, "cfour-maxstep"]], "CFOUR_MEMORY_SIZE": [[651, null], [1206, "cfour-memory-size"]], "CFOUR_MEM_UNIT": [[650, null], [1206, "cfour-mem-unit"]], "CFOUR_METHOD": [[652, null], [1206, "cfour-method"]], "CFOUR_MRCC": [[653, null], [1206, "cfour-mrcc"]], "CFOUR_MULTIPLICITY": [[654, null], [1206, "cfour-multiplicity"]], "CFOUR_NACOUPLING": [[655, null], [1206, "cfour-nacoupling"]], "CFOUR_NEGEVAL": [[656, null], [1206, "cfour-negeval"]], "CFOUR_NEWNORM": [[657, null], [1206, "cfour-newnorm"]], "CFOUR_NONHF": [[658, null], [1206, "cfour-nonhf"]], "CFOUR_NTOP_TAMP": [[659, null], [1206, "cfour-ntop-tamp"]], "CFOUR_OCCUPATION": [[660, null], [1206, "cfour-occupation"]], "CFOUR_OMP_NUM_THREADS": [[661, null], [1206, "cfour-omp-num-threads"]], "CFOUR_OPEN-SHELL": [[662, null], [1206, "cfour-open-shell"]], "CFOUR_OPT_MAXCYC": [[663, null], [1206, "cfour-opt-maxcyc"]], "CFOUR_ORBITALS": [[664, null], [1206, "cfour-orbitals"]], "CFOUR_PERT_ORB": [[665, null], [1206, "cfour-pert-orb"]], "CFOUR_POINTS": [[666, null], [1206, "cfour-points"]], "CFOUR_PRINT": [[667, null], [1206, "cfour-print"]], "CFOUR_PROPS": [[669, null], [1206, "cfour-props"]], "CFOUR_PROP_INTEGRAL": [[668, null], [1206, "cfour-prop-integral"]], "CFOUR_QRHFGUES": [[672, null], [1206, "cfour-qrhfgues"]], "CFOUR_QRHF_GENERAL": [[670, null], [1206, "cfour-qrhf-general"]], "CFOUR_QRHF_ORBITAL": [[671, null], [1206, "cfour-qrhf-orbital"]], "CFOUR_RAMAN_INT": [[673, null], [1206, "cfour-raman-int"]], "CFOUR_RAMAN_ORB": [[674, null], [1206, "cfour-raman-orb"]], "CFOUR_RDO": [[675, null], [1206, "cfour-rdo"]], "CFOUR_REFERENCE": [[676, null], [1206, "cfour-reference"]], "CFOUR_RELATIVISTIC": [[677, null], [1206, "cfour-relativistic"]], "CFOUR_RELAX_DENS": [[678, null], [1206, "cfour-relax-dens"]], "CFOUR_RESTART_CC": [[680, null], [1206, "cfour-restart-cc"]], "CFOUR_RES_RAMAN": [[679, null], [1206, "cfour-res-raman"]], "CFOUR_ROT_EVEC": [[681, null], [1206, "cfour-rot-evec"]], "CFOUR_SAVE_INTS": [[682, null], [1206, "cfour-save-ints"]], "CFOUR_SCALE_ON": [[683, null], [1206, "cfour-scale-on"]], "CFOUR_SCF_CONV": [[684, null], [1206, "cfour-scf-conv"]], "CFOUR_SCF_DAMPING": [[685, null], [1206, "cfour-scf-damping"]], "CFOUR_SCF_EXPORDER": [[686, null], [1206, "cfour-scf-exporder"]], "CFOUR_SCF_EXPSTART": [[687, null], [1206, "cfour-scf-expstart"]], "CFOUR_SCF_EXTRAPOLATION": [[688, null], [1206, "cfour-scf-extrapolation"]], "CFOUR_SCF_MAXCYC": [[689, null], [1206, "cfour-scf-maxcyc"]], "CFOUR_SD_FIELD": [[690, null], [1206, "cfour-sd-field"]], "CFOUR_SPHERICAL": [[691, null], [1206, "cfour-spherical"]], "CFOUR_SPINROTATION": [[695, null], [1206, "cfour-spinrotation"]], "CFOUR_SPIN_FLIP": [[692, null], [1206, "cfour-spin-flip"]], "CFOUR_SPIN_ORBIT": [[693, null], [1206, "cfour-spin-orbit"]], "CFOUR_SPIN_SCAL": [[694, null], [1206, "cfour-spin-scal"]], "CFOUR_SUBGROUP": [[696, null], [1206, "cfour-subgroup"]], "CFOUR_SYMMETRY": [[698, null], [1206, "cfour-symmetry"]], "CFOUR_SYM_CHECK": [[697, null], [1206, "cfour-sym-check"]], "CFOUR_T3_EXTRAPOL": [[699, null], [1206, "cfour-t3-extrapol"]], "CFOUR_TAMP_SUM": [[700, null], [1206, "cfour-tamp-sum"]], "CFOUR_THERMOCHEMISTRY": [[701, null], [1206, "cfour-thermochemistry"]], "CFOUR_TRANS_INV": [[702, null], [1206, "cfour-trans-inv"]], "CFOUR_TREAT_PERT": [[703, null], [1206, "cfour-treat-pert"]], "CFOUR_UIJ_THRESHOLD": [[704, null], [1206, "cfour-uij-threshold"]], "CFOUR_UNITS": [[705, null], [1206, "cfour-units"]], "CFOUR_UPDATE_HESSIAN": [[706, null], [1206, "cfour-update-hessian"]], "CFOUR_VIBRATION": [[707, null], [1206, "cfour-vibration"]], "CFOUR_VTRAN": [[708, null], [1206, "cfour-vtran"]], "CFOUR_XFIELD": [[709, null], [1206, "cfour-xfield"]], "CFOUR_XFORM_TOL": [[710, null], [1206, "cfour-xform-tol"]], "CFOUR_YFIELD": [[711, null], [1206, "cfour-yfield"]], "CFOUR_ZFIELD": [[712, null], [1206, "cfour-zfield"]], "CHEMPS2": [[1712, null]], "CHOLESKY": [[915, null], [1213, "cholesky"]], "CHOLESKY_TOLERANCE": [[916, null], [1072, null], [1213, "cholesky-tolerance"], [1219, "cholesky-tolerance"], [1231, "cholesky-tolerance"], [1486, null], [1771, "cholesky-tolerance"]], "CI: Configuration Interaction": [[1755, null]], "CIBLKS_PRINT": [[807, null], [1210, "ciblks-print"]], "CIVector": [[12, null]], "CIWavefunction": [[13, null]], "CI_DIIS": [[1173, null], [1222, "ci-diis"]], "CI_FILE_START": [[804, null], [1210, "ci-file-start"]], "CI_MAXITER": [[805, null], [1210, "ci-maxiter"], [1755, "ci-maxiter"]], "CI_NUM_THREADS": [[806, null], [1210, "ci-num-threads"]], "CI_TYPE": [[1107, null], [1221, "ci-type"]], "CMakeLists.txt": [[2, "cmakelists-txt"]], "COLLAPSE_SIZE": [[808, null], [1210, "collapse-size"]], "COLLAPSE_WITH_LAST": [[470, null], [1200, "collapse-with-last"]], "COLLAPSE_WITH_LAST_CC3": [[471, null], [1200, "collapse-with-last-cc3"]], "COMPLEX_TOLERANCE": [[472, null], [1200, "complex-tolerance"]], "COMPUTE_MP4_TRIPLES": [[1073, null], [1219, "compute-mp4-triples"], [1771, "compute-mp4-triples"]], "COMPUTE_TRIPLES": [[1074, null], [1219, "compute-triples"], [1771, "compute-triples"]], "COMPUT_S2": [[917, null], [1213, "comput-s2"]], "CONSECUTIVE_BACKSTEPS": [[1226, "consecutive-backsteps"], [1302, null]], "COOKBOOK": [[1713, null]], "CORE": [[1692, "core"], [1752, "core"]], "CORR_ANSATZ": [[1229, "corr-ansatz"], [1398, null]], "CORR_CCSD_T": [[1229, "corr-ccsd-t"], [1399, null]], "CORR_CHARGE": [[1229, "corr-charge"], [1400, null]], "CORR_MULTP": [[1229, "corr-multp"], [1401, null]], "CORR_WFN": [[1229, "corr-wfn"], [1402, null]], "COSX Algorithm": [[1231, "cosx-algorithm"]], "COSX Exchange": [[1838, "cosx-exchange"]], "COSX_BASIS_TOLERANCE": [[1231, "cosx-basis-tolerance"], [1487, null]], "COSX_DENSITY_TOLERANCE": [[1231, "cosx-density-tolerance"], [1488, null]], "COSX_INTS_TOLERANCE": [[1231, "cosx-ints-tolerance"], [1489, null]], "COSX_MAXITER_FINAL": [[1231, "cosx-maxiter-final"], [1490, null]], "COSX_OVERLAP_FITTING": [[1231, "cosx-overlap-fitting"], [1491, null]], "COSX_PRUNING_SCHEME": [[1231, "cosx-pruning-scheme"], [1492, null]], "COSX_RADIAL_POINTS_FINAL": [[1231, "cosx-radial-points-final"], [1493, null]], "COSX_RADIAL_POINTS_INITIAL": [[1231, "cosx-radial-points-initial"], [1494, null]], "COSX_SPHERICAL_POINTS_FINAL": [[1231, "cosx-spherical-points-final"], [1495, null]], "COSX_SPHERICAL_POINTS_INITIAL": [[1231, "cosx-spherical-points-initial"], [1496, null]], "COUPLED_INDUCTION": [[1230, "coupled-induction"], [1441, null], [1837, "coupled-induction"], [1837, "id13"]], "COUPLING": [[1229, "coupling"], [1403, null]], "COUPLING_TERMS": [[1229, "coupling-terms"], [1404, null]], "COVALENT_CONNECT": [[1226, "covalent-connect"], [1303, null]], "CPHF": [[1207, null]], "CPHF_MEM_SAFETY_FACTOR": [[714, null], [1207, "cphf-mem-safety-factor"]], "CPHF_R_CONVERGENCE": [[1029, null], [1218, "cphf-r-convergence"], [1230, "cphf-r-convergence"], [1442, null], [1837, "cphf-r-convergence"]], "CPHF_TASKS": [[715, null], [1207, "cphf-tasks"]], "CTest and pytest, PSIthon and PsiAPI": [[2, "ctest-and-pytest-psithon-and-psiapi"]], "CUBEPROP_BASIS_FUNCTIONS": [[1108, null], [1221, "cubeprop-basis-functions"], [1750, "cubeprop-basis-functions"]], "CUBEPROP_FILEPATH": [[1109, null], [1221, "cubeprop-filepath"], [1750, "cubeprop-filepath"]], "CUBEPROP_ISOCONTOUR_THRESHOLD": [[1110, null], [1221, "cubeprop-isocontour-threshold"]], "CUBEPROP_ORBITALS": [[1111, null], [1221, "cubeprop-orbitals"], [1750, "cubeprop-orbitals"]], "CUBEPROP_TASKS": [[1112, null], [1221, "cubeprop-tasks"], [1750, "id3"]], "CUBIC_BASIS_TOLERANCE": [[1030, null], [1113, null], [1218, "cubic-basis-tolerance"], [1221, "cubic-basis-tolerance"]], "CUBIC_BLOCK_MAX_POINTS": [[1031, null], [1114, null], [1218, "cubic-block-max-points"], [1221, "cubic-block-max-points"]], "CUBIC_GRID_OVERAGE": [[1032, null], [1115, null], [1218, "cubic-grid-overage"], [1221, "cubic-grid-overage"], [1750, "cubic-grid-overage"]], "CUBIC_GRID_SPACING": [[1033, null], [1116, null], [1218, "cubic-grid-spacing"], [1221, "cubic-grid-spacing"], [1750, "cubic-grid-spacing"]], "CUHF": [[14, null]], "CUSTOM_COORDS": [[1226, "custom-coords"], [1304, null]], "CUTOFF": [[918, null], [1213, "cutoff"], [1225, "cutoff"], [1249, null]], "CUTOFF_AMPS_PRINT": [[0, "cutoff-amps-print"], [1, "cutoff-amps-print"], [401, null], [1197, "cutoff-amps-print"]], "Calling compute_shell(int P, int Q)": [[1817, "calling-compute-shell-int-p-int-q"]], "Capabilities": [[1781, "capabilities"]], "Capabilities and Alternate Implementations": [[1739, null]], "Capabilities of <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>, including details of overlapping modules. \u201c\u2713\u201d runs analytically. \u201c\u2237\u201d runs derivative with internal finite difference. Single underline \u201c\u2713\u0332\u201d or \u201c\u2237\u0332\u201d is default module when QC_MODULE unspecified. Double underline \u201c\u2713\u0333\u201d or \u201c\u2237\u0333\u201d is default algorithm type when type selector (e.g., CC_TYPE) unspecified.": [[1739, "id18"]], "CdSalc": [[15, null]], "CdSalcList": [[16, null]], "Cfour for <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span> Users": [[1743, "cfour-for-psifour-users"]], "Changes to External Potential Engines": [[1817, "changes-to-external-potential-engines"]], "CharacterTable": [[17, null]], "Charge-Transfer in SAPT": [[1837, "charge-transfer-in-sapt"]], "Citing <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1781, "citing-psifour"]], "Class Inheritance Diagram": [[1827, "class-inheritance-diagram"], [1827, "id3"], [1827, "id6"]], "Classes": [[1827, "classes"], [1827, "id2"], [1827, "id5"]], "Clone from GitHub Repository": [[1737, "clone-from-github-repository"]], "Code style conventions": [[1747, null]], "Collect documentation snapshot": [[1788, "collect-documentation-snapshot"]], "Collect new authors": [[1788, "collect-new-authors"]], "Command Line Options": [[1767, "command-line-options"]], "Comments": [[1804, "comments"]], "Community Code of Conduct": [[1811, null]], "Comparison Functions": [[2, "comparison-functions"]], "Compiling and Installing from Source": [[1738, null]], "Complete Basis Set": [[1740, null]], "Completely new methods": [[1823, "completely-new-methods"]], "CompositeJK": [[18, null]], "Computations with Mid-bonds": [[1837, "computations-with-mid-bonds"]], "Conda Binary Distribution": [[1748, null]], "Conda Binary Package": [[1737, "conda-binary-package"]], "Configuration Interaction (CI)": [[1781, "configuration-interaction-ci"]], "Configuring and Installing <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span> via Binary": [[1736, "configuring-and-installing-psifour-via-binary"]], "Configuring, Building, and Installing <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span> via Source": [[1736, "configuring-building-and-installing-psifour-via-source"]], "Constrained Optimizations": [[1802, "constrained-optimizations"]], "Contents:": [[1777, null]], "Conventional (Non-OO) Coupled-Cluster and M\u00f8ller\u2013Plesset Perturbation Theories": [[1798, "conventional-non-oo-coupled-cluster-and-mollerplesset-perturbation-theories"]], "Convergence Control": [[1226, "convergence-control"]], "Convergence Control/Stabilization": [[1231, "convergence-control-stabilization"]], "Convergence Criteria": [[1802, "convergence-criteria"]], "Convergence Problems": [[1798, "convergence-problems"]], "Convergence Stabilization": [[1838, "convergence-stabilization"]], "Convergence and Algorithm Defaults": [[1838, "convergence-and-algorithm-defaults"]], "ConvergenceError": [[266, null]], "Coordinates": [[1833, "coordinates"]], "CorrelationFactor": [[19, null]], "CorrelationTable": [[20, null]], "Coupled Cluster (CC)": [[1781, "coupled-cluster-cc"]], "Coupled electron pair approximation": [[1771, "coupled-electron-pair-approximation"]], "Creating New Plugins": [[1808, null]], "Creating a Database": [[1835, null]], "Creating a New Plugin": [[1808, "creating-a-new-plugin"]], "Creating a New Plugin Using a Conda Pre-compiled Binary": [[1808, "creating-a-new-plugin-using-a-conda-pre-compiled-binary"]], "Cube File Visualization with PyMol": [[1770, "cube-file-visualization-with-pymol"]], "CubeProperties": [[21, null]], "Cubeprop Tasks": [[1750, "cubeprop-tasks"]], "Current coupled cluster capabilities of <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1742, "id14"]], "Current one-electron property capabilities of <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1799, "id2"]], "Customization: Adding Simple Extensions": [[1751, null]], "DAMPING_CONVERGENCE": [[1231, "damping-convergence"], [1498, null]], "DAMPING_FACTOR_INDUCED": [[1228, "damping-factor-induced"], [1387, null]], "DAMPING_FACTOR_MULTIPOLE": [[1228, "damping-factor-multipole"], [1388, null]], "DAMPING_PERCENTAGE": [[729, null], [1208, "damping-percentage"], [1229, "damping-percentage"], [1231, "damping-percentage"], [1405, null], [1499, null]], "DAMP_INDUCED": [[1228, "damp-induced"], [1385, null]], "DAMP_MULTIPOLE": [[1228, "damp-multipole"], [1386, null]], "DASUM": [[22, null]], "DAXPY": [[23, null]], "DCOPY": [[24, null]], "DCT": [[1208, null], [1671, null]], "DCT: Density Cumulant Theory": [[1753, null]], "DCT_FUNCTIONAL": [[730, null], [1208, "dct-functional"]], "DCT_GUESS": [[731, null], [1208, "dct-guess"]], "DCT_TYPE": [[732, null], [1208, "dct-type"]], "DDOT": [[25, null]], "DDX": [[1117, null], [1209, null], [1221, "ddx"], [1672, null], [1754, "ddx"]], "DDX_DIIS_MAX_VECS": [[760, null], [1209, "ddx-diis-max-vecs"], [1754, "ddx-diis-max-vecs"]], "DDX_ETA": [[761, null], [1209, "ddx-eta"], [1754, "ddx-eta"]], "DDX_FMM": [[762, null], [1209, "ddx-fmm"], [1754, "ddx-fmm"]], "DDX_FMM_LOCAL_LMAX": [[763, null], [1209, "ddx-fmm-local-lmax"], [1754, "ddx-fmm-local-lmax"]], "DDX_FMM_MULTIPOLE_LMAX": [[764, null], [1209, "ddx-fmm-multipole-lmax"], [1754, "ddx-fmm-multipole-lmax"]], "DDX_INCORE": [[765, null], [1209, "ddx-incore"], [1754, "ddx-incore"]], "DDX_LMAX": [[766, null], [1209, "ddx-lmax"], [1754, "ddx-lmax"]], "DDX_LOGFILE": [[767, null], [1209, "ddx-logfile"], [1754, "ddx-logfile"]], "DDX_MAXITER": [[768, null], [1209, "ddx-maxiter"], [1754, "ddx-maxiter"]], "DDX_MODEL": [[769, null], [1209, "ddx-model"], [1754, "ddx-model"]], "DDX_N_LEBEDEV": [[770, null], [1209, "ddx-n-lebedev"], [1754, "ddx-n-lebedev"]], "DDX_RADII": [[771, null], [1209, "ddx-radii"], [1754, "ddx-radii"]], "DDX_RADII_SCALING": [[772, null], [1209, "ddx-radii-scaling"], [1754, "ddx-radii-scaling"]], "DDX_RADII_SET": [[773, null], [1209, "ddx-radii-set"], [1754, "ddx-radii-set"]], "DDX_SHIFT": [[774, null], [1209, "ddx-shift"], [1754, "ddx-shift"]], "DDX_SOLUTE_RADIAL_POINTS": [[775, null], [1209, "ddx-solute-radial-points"], [1754, "ddx-solute-radial-points"]], "DDX_SOLUTE_SPHERICAL_POINTS": [[776, null], [1209, "ddx-solute-spherical-points"], [1754, "ddx-solute-spherical-points"]], "DDX_SOLVATION_CONVERGENCE": [[777, null], [1209, "ddx-solvation-convergence"], [1754, "ddx-solvation-convergence"]], "DDX_SOLVENT": [[778, null], [1209, "ddx-solvent"], [1754, "ddx-solvent"]], "DDX_SOLVENT_EPSILON": [[779, null], [1209, "ddx-solvent-epsilon"], [1754, "ddx-solvent-epsilon"]], "DDX_SOLVENT_EPSILON_OPTICAL": [[780, null], [1209, "ddx-solvent-epsilon-optical"]], "DDX_SOLVENT_KAPPA": [[781, null], [1209, "ddx-solvent-kappa"], [1754, "ddx-solvent-kappa"]], "DEBUG": [[413, null], [716, null], [1118, null], [1198, "debug"], [1207, "debug"], [1221, "debug"], [1837, "debug"], [1837, "id27"]], "DELETE_TEI": [[559, null], [1204, "delete-tei"]], "DENOMINATOR_ALGORITHM": [[1230, "denominator-algorithm"], [1443, null], [1837, "denominator-algorithm"]], "DENOMINATOR_DELTA": [[1230, "denominator-delta"], [1444, null], [1837, "denominator-delta"]], "DERTYPE": [[1011, null], [1119, null], [1216, "dertype"], [1221, "dertype"]], "DETCI": [[1210, null], [1673, null]], "DETCI_FREEZE_CORE": [[809, null], [1210, "detci-freeze-core"]], "DF-MP2: Density-Fitted 2nd-Order M\u00f8ller\u2013Plesset Perturbation Theory": [[1756, null]], "DFCC": [[1076, null], [1219, "dfcc"], [1771, "dfcc"]], "DFEP2": [[1211, null]], "DFEP2Wavefunction": [[26, null]], "DFHelper": [[27, null]], "DFMP2": [[1212, null], [1674, null]], "DFMP2_MEM_FACTOR": [[902, null], [1212, "dfmp2-mem-factor"]], "DFMP2_P2_TOLERANCE": [[903, null], [1212, "dfmp2-p2-tolerance"]], "DFMP2_P_TOLERANCE": [[904, null], [1212, "dfmp2-p-tolerance"]], "DFOCC": [[1213, null], [1675, null]], "DFSCF Algorithm": [[1231, "dfscf-algorithm"]], "DFSOMCSCF": [[28, null]], "DFT": [[1231, "dft"]], "DFT Functionals": [[1758, null]], "DFT functionals available in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1695, null], [1758, "id1"]], "DFT-NL": [[1760, null]], "DFT: Density Functional Theory": [[1757, null]], "DFTD3": [[1715, null]], "DFTD4": [[1716, null]], "DFTGrid": [[29, null]], "DFT_ALPHA": [[1231, "dft-alpha"], [1512, null]], "DFT_ALPHA_C": [[1231, "dft-alpha-c"], [1513, null]], "DFT_BASIS_TOLERANCE": [[1231, "dft-basis-tolerance"], [1514, null]], "DFT_BLOCK_MAX_POINTS": [[1231, "dft-block-max-points"], [1515, null]], "DFT_BLOCK_MAX_RADIUS": [[1231, "dft-block-max-radius"], [1516, null]], "DFT_BLOCK_MIN_POINTS": [[1231, "dft-block-min-points"], [1517, null]], "DFT_BLOCK_SCHEME": [[1231, "dft-block-scheme"], [1518, null]], "DFT_BS_RADIUS_ALPHA": [[1231, "dft-bs-radius-alpha"], [1519, null]], "DFT_DENSITY_TOLERANCE": [[1231, "dft-density-tolerance"], [1520, null]], "DFT_DISPERSION_PARAMETERS": [[1231, "dft-dispersion-parameters"], [1521, null]], "DFT_GRAC_ALPHA": [[1231, "dft-grac-alpha"], [1522, null]], "DFT_GRAC_BETA": [[1231, "dft-grac-beta"], [1523, null]], "DFT_GRAC_C_FUNC": [[1231, "dft-grac-c-func"], [1524, null]], "DFT_GRAC_SHIFT": [[1231, "dft-grac-shift"], [1525, null]], "DFT_GRAC_X_FUNC": [[1231, "dft-grac-x-func"], [1526, null]], "DFT_GRID_NAME": [[1231, "dft-grid-name"], [1527, null]], "DFT_NUCLEAR_SCHEME": [[1231, "dft-nuclear-scheme"], [1528, null]], "DFT_OMEGA": [[1231, "dft-omega"], [1529, null]], "DFT_OMEGA_C": [[1231, "dft-omega-c"], [1530, null]], "DFT_PRUNING_ALPHA": [[1231, "dft-pruning-alpha"], [1531, null]], "DFT_PRUNING_SCHEME": [[1231, "dft-pruning-scheme"], [1532, null]], "DFT_RADIAL_POINTS": [[1231, "dft-radial-points"], [1533, null]], "DFT_RADIAL_SCHEME": [[1231, "dft-radial-scheme"], [1534, null]], "DFT_REMOVE_DISTANT_POINTS": [[1231, "dft-remove-distant-points"], [1535, null]], "DFT_SPHERICAL_POINTS": [[1231, "dft-spherical-points"], [1536, null]], "DFT_SPHERICAL_SCHEME": [[1231, "dft-spherical-scheme"], [1537, null]], "DFT_V2_RHO_CUTOFF": [[1231, "dft-v2-rho-cutoff"], [1538, null]], "DFT_VV10_B": [[1231, "dft-vv10-b"], [1539, null]], "DFT_VV10_C": [[1231, "dft-vv10-c"], [1540, null]], "DFT_VV10_POSTSCF": [[1231, "dft-vv10-postscf"], [1541, null]], "DFT_VV10_RADIAL_POINTS": [[1231, "dft-vv10-radial-points"], [1542, null]], "DFT_VV10_RHO_CUTOFF": [[1231, "dft-vv10-rho-cutoff"], [1543, null]], "DFT_VV10_SPHERICAL_POINTS": [[1231, "dft-vv10-spherical-points"], [1544, null]], "DFT_WEIGHTS_TOLERANCE": [[1231, "dft-weights-tolerance"], [1545, null]], "DFTensor": [[30, null]], "DF_BASIS_CC": [[1075, null], [1120, null], [1219, "df-basis-cc"], [1221, "df-basis-cc"], [1771, "df-basis-cc"]], "DF_BASIS_DCT": [[733, null], [1208, "df-basis-dct"]], "DF_BASIS_ELST": [[1230, "df-basis-elst"], [1445, null], [1837, "df-basis-elst"]], "DF_BASIS_EP2": [[892, null], [1211, "df-basis-ep2"]], "DF_BASIS_GUESS": [[1231, "df-basis-guess"], [1500, null]], "DF_BASIS_MCSCF": [[810, null], [1210, "df-basis-mcscf"]], "DF_BASIS_MP2": [[899, null], [963, null], [1212, "df-basis-mp2"], [1214, "df-basis-mp2"]], "DF_BASIS_SAD": [[1231, "df-basis-sad"], [1501, null]], "DF_BASIS_SAPT": [[1230, "df-basis-sapt"], [1446, null], [1837, "df-basis-sapt"], [1837, "id23"]], "DF_BASIS_SCF": [[717, null], [1207, "df-basis-scf"], [1231, "df-basis-scf"], [1502, null]], "DF_BUMP_R0": [[1231, "df-bump-r0"], [1503, null]], "DF_BUMP_R1": [[1231, "df-bump-r1"], [1504, null]], "DF_DOMAINS": [[1231, "df-domains"], [1505, null]], "DF_FITTING_CONDITION": [[1231, "df-fitting-condition"], [1506, null]], "DF_INTS_IO": [[900, null], [1212, "df-ints-io"], [1231, "df-ints-io"], [1507, null]], "DF_INTS_NUM_THREADS": [[901, null], [1212, "df-ints-num-threads"], [1231, "df-ints-num-threads"], [1508, null]], "DF_METRIC": [[1231, "df-metric"], [1509, null]], "DF_SCF_GUESS": [[1231, "df-scf-guess"], [1510, null]], "DF_THETA": [[1231, "df-theta"], [1511, null]], "DGBMV": [[31, null]], "DGEEV": [[32, null]], "DGEMM": [[33, null]], "DGEMV": [[34, null]], "DGER": [[35, null]], "DGETRF": [[36, null]], "DGETRI": [[37, null]], "DGETRS": [[38, null]], "DIAGONALIZE_HEFF": [[1229, "diagonalize-heff"], [1407, null]], "DIAGONAL_CCSD_T": [[1229, "diagonal-ccsd-t"], [1406, null]], "DIAG_METHOD": [[811, null], [1210, "diag-method"], [1755, "diag-method"]], "DIE_IF_NOT_CONVERGED": [[1121, null], [1221, "die-if-not-converged"]], "DIIS": [[321, null], [438, null], [515, null], [538, null], [812, null], [1175, null], [1199, "diis"], [1202, "diis"], [1203, "diis"], [1210, "diis"], [1222, "diis"], [1231, "diis"], [1546, null]], "DIIS_FREQ": [[813, null], [1210, "diis-freq"]], "DIIS_MAX_VECS": [[734, null], [814, null], [1077, null], [1176, null], [1208, "diis-max-vecs"], [1210, "diis-max-vecs"], [1219, "diis-max-vecs"], [1222, "diis-max-vecs"], [1225, "diis-max-vecs"], [1229, "diis-max-vecs"], [1231, "diis-max-vecs"], [1250, null], [1408, null], [1547, null], [1771, "diis-max-vecs"]], "DIIS_MIN_VECS": [[735, null], [815, null], [1208, "diis-min-vecs"], [1210, "diis-min-vecs"], [1225, "diis-min-vecs"], [1231, "diis-min-vecs"], [1251, null], [1548, null]], "DIIS_RMS_ERROR": [[1231, "diis-rms-error"], [1549, null]], "DIIS_START": [[1229, "diis-start"], [1231, "diis-start"], [1409, null], [1550, null]], "DIIS_START_CONVERGENCE": [[736, null], [1208, "diis-start-convergence"]], "DIIS_START_ITER": [[816, null], [1210, "diis-start-iter"]], "DIPMOM": [[817, null], [1078, null], [1210, "dipmom"], [1219, "dipmom"], [1755, "dipmom"], [1771, "dipmom"]], "DISP_SIZE": [[1023, null], [1217, "disp-size"]], "DISTRIBUTED_MATRIX": [[1231, "distributed-matrix"], [1551, null]], "DKH": [[1717, null]], "DKH_ORDER": [[1122, null], [1221, "dkh-order"], [1762, "dkh-order"]], "DLPNO": [[1214, null], [1676, null]], "DLPNO-MP2: Domain-Based Local Pair Natural Orbital MP2": [[1763, null]], "DLPNO_ALGORITHM": [[964, null], [1214, "dlpno-algorithm"]], "DLPNO_LOCAL_ORBITALS": [[965, null], [1214, "dlpno-local-orbitals"]], "DLPNO_MAXITER": [[966, null], [1214, "dlpno-maxiter"]], "DMRG": [[1215, null], [1677, null]], "DMRG Keywords": [[1746, "dmrg-keywords"]], "DMRG_CASPT2_CALC": [[986, null], [1215, "dmrg-caspt2-calc"], [1746, "dmrg-caspt2-calc"]], "DMRG_CASPT2_IMAG": [[987, null], [1215, "dmrg-caspt2-imag"], [1746, "dmrg-caspt2-imag"]], "DMRG_CASPT2_IPEA": [[988, null], [1215, "dmrg-caspt2-ipea"], [1746, "dmrg-caspt2-ipea"]], "DMRG_CASPT2_ORBS": [[989, null], [1215, "dmrg-caspt2-orbs"], [1746, "dmrg-caspt2-orbs"]], "DMRG_DIIS": [[990, null], [1215, "dmrg-diis"], [1746, "dmrg-diis"]], "DMRG_DIIS_WRITE": [[991, null], [1215, "dmrg-diis-write"], [1746, "dmrg-diis-write"]], "DMRG_EXCITATION": [[992, null], [1215, "dmrg-excitation"], [1746, "dmrg-excitation"]], "DMRG_IRREP": [[993, null], [1215, "dmrg-irrep"], [1746, "dmrg-irrep"]], "DMRG_LOCAL_INIT": [[994, null], [1215, "dmrg-local-init"], [1746, "dmrg-local-init"]], "DMRG_MOLDEN_WRITE": [[995, null], [1215, "dmrg-molden-write"], [1746, "dmrg-molden-write"]], "DMRG_MPS_WRITE": [[996, null], [1215, "dmrg-mps-write"], [1746, "dmrg-mps-write"]], "DMRG_MULTIPLICITY": [[997, null], [1215, "dmrg-multiplicity"], [1746, "dmrg-multiplicity"]], "DMRG_OPDM_AO_PRINT": [[998, null], [1215, "dmrg-opdm-ao-print"], [1746, "dmrg-opdm-ao-print"]], "DMRG_PRINT_CORR": [[999, null], [1215, "dmrg-print-corr"], [1746, "dmrg-print-corr"]], "DMRG_SCF_ACTIVE_SPACE": [[1000, null], [1215, "dmrg-scf-active-space"], [1746, "dmrg-scf-active-space"]], "DMRG_SCF_DIIS_THR": [[1001, null], [1215, "dmrg-scf-diis-thr"], [1746, "dmrg-scf-diis-thr"]], "DMRG_SCF_GRAD_THR": [[1002, null], [1215, "dmrg-scf-grad-thr"], [1746, "dmrg-scf-grad-thr"]], "DMRG_SCF_MAX_ITER": [[1003, null], [1215, "dmrg-scf-max-iter"], [1746, "dmrg-scf-max-iter"]], "DMRG_SCF_STATE_AVG": [[1004, null], [1215, "dmrg-scf-state-avg"], [1746, "dmrg-scf-state-avg"]], "DMRG_SWEEP_DVDSON_RTOL": [[1005, null], [1215, "dmrg-sweep-dvdson-rtol"], [1746, "dmrg-sweep-dvdson-rtol"]], "DMRG_SWEEP_ENERGY_CONV": [[1006, null], [1215, "dmrg-sweep-energy-conv"], [1746, "dmrg-sweep-energy-conv"]], "DMRG_SWEEP_MAX_SWEEPS": [[1007, null], [1215, "dmrg-sweep-max-sweeps"], [1746, "dmrg-sweep-max-sweeps"]], "DMRG_SWEEP_NOISE_PREFAC": [[1008, null], [1215, "dmrg-sweep-noise-prefac"], [1746, "dmrg-sweep-noise-prefac"]], "DMRG_SWEEP_STATES": [[1009, null], [1215, "dmrg-sweep-states"], [1746, "dmrg-sweep-states"]], "DMRG_UNITARY_WRITE": [[1010, null], [1215, "dmrg-unitary-write"], [1746, "dmrg-unitary-write"]], "DNRM2": [[39, null]], "DOCC": [[1123, null], [1177, null], [1221, "docc"], [1222, "docc"]], "DOI_BASIS_TOLERANCE": [[967, null], [1214, "doi-basis-tolerance"]], "DOI_PRUNING_SCHEME": [[968, null], [1214, "doi-pruning-scheme"]], "DOI_RADIAL_POINTS": [[969, null], [1214, "doi-radial-points"]], "DOI_SPHERICAL_POINTS": [[970, null], [1214, "doi-spherical-points"]], "DO_CCD_DISP": [[1230, "do-ccd-disp"], [1447, null], [1837, "do-ccd-disp"]], "DO_DIIS": [[919, null], [1213, "do-diis"], [1225, "do-diis"], [1252, null], [1798, "do-diis"], [1798, "id42"]], "DO_DISP_EXCH_SINF": [[1230, "do-disp-exch-sinf"], [1448, null], [1837, "do-disp-exch-sinf"]], "DO_IND30_EXCH_SINF": [[1230, "do-ind30-exch-sinf"], [1449, null], [1837, "do-ind30-exch-sinf"]], "DO_IND_EXCH_SINF": [[1230, "do-ind-exch-sinf"], [1450, null], [1837, "do-ind-exch-sinf"]], "DO_LEVEL_SHIFT": [[920, null], [1213, "do-level-shift"], [1225, "do-level-shift"], [1253, null], [1798, "do-level-shift"], [1798, "id43"]], "DO_MBPT_DISP": [[1230, "do-mbpt-disp"], [1451, null], [1837, "do-mbpt-disp"]], "DO_SCS": [[921, null], [1213, "do-scs"], [1225, "do-scs"], [1254, null]], "DO_SOS": [[922, null], [1213, "do-sos"], [1225, "do-sos"], [1255, null]], "DO_THIRD_ORDER": [[1230, "do-third-order"], [1452, null], [1837, "do-third-order"]], "DPOTRF": [[40, null]], "DPOTRI": [[41, null]], "DPOTRS": [[42, null]], "DROT": [[43, null]], "DSBMV": [[44, null]], "DSCAL": [[45, null]], "DSWAP": [[46, null]], "DSYEV": [[47, null]], "DSYMM": [[48, null]], "DSYMV": [[49, null]], "DSYR": [[50, null]], "DSYR2": [[51, null]], "DSYR2K": [[52, null]], "DSYRK": [[53, null]], "DSYSV": [[54, null]], "DTBMV": [[55, null]], "DTBSV": [[56, null]], "DTRMM": [[57, null]], "DTRMV": [[58, null]], "DTRSM": [[59, null]], "DTRSV": [[60, null]], "DYNAMIC_LEVEL": [[1226, "dynamic-level"], [1305, null]], "D_CONVERGENCE": [[1174, null], [1222, "d-convergence"], [1231, "d-convergence"], [1497, null]], "Database \u2014 database()": [[1752, null]], "Dealing with problematic optimizations": [[1802, "dealing-with-problematic-optimizations"]], "Debugging": [[1813, "debugging"]], "Debugging and Profiling": [[1813, null]], "Declaring Options": [[1801, "declaring-options"]], "Decontracted Basis Sets": [[1730, "decontracted-basis-sets"]], "Defining a Method Alias": [[1834, null]], "Density Cumulant Theory (DCT)": [[1781, "density-cumulant-theory-dct"]], "Density Matrices": [[1210, "density-matrices"]], "Density Matrix Renormalization Group (DMRG)": [[1781, "density-matrix-renormalization-group-dmrg"]], "Density Screening": [[1817, "density-screening"]], "Density matrix renormalization group capabilities of <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span> through CheMPS2": [[1746, "id1"]], "Density-fitted coupled cluster": [[1771, "density-fitted-coupled-cluster"]], "Deriv": [[61, null]], "DerivCalcType": [[62, null]], "Derivative Integrals": [[1817, "derivative-integrals"]], "Detailed Installation of <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1748, "detailed-installation-of-psifour"]], "Detailed Installation of Miniconda": [[1748, "detailed-installation-of-miniconda"]], "Detailed capabilities of CCENERGY and related modules. \u201c\u2713\u201d runs analytically. Single underline \u201c\u2713\u0332\u201d is default module when QC_MODULE unspecified. Double underline \u201c\u2713\u0333\u201d is default algorithm type when type selector (e.g., CC_TYPE) unspecified.": [[1742, "id15"]], "Detailed capabilities of the DFMP2 module. \u201c\u2713\u201d runs analytically. Single underline \u201c\u2713\u0332\u201d is default module when QC_MODULE unspecified. Double underline \u201c\u2713\u0333\u201d is default algorithm type when type selector (e.g., CC_TYPE) unspecified.": [[1756, "id7"]], "Detailed capabilities of the FNOCC module. \u201c\u2713\u201d runs analytically. Single underline \u201c\u2713\u0332\u201d is default module when QC_MODULE unspecified. Double underline \u201c\u2713\u0333\u201d is default algorithm type when type selector (e.g., CC_TYPE) unspecified.": [[1771, "id13"]], "Detailed capabilities of the SCF module. \u201c\u2713\u201d runs analytically. Single underline \u201c\u2713\u0332\u201d is default module when QC_MODULE unspecified. Double underline \u201c\u2713\u0333\u201d is default algorithm type when type selector (e.g., CC_TYPE) unspecified.": [[1757, "id15"]], "Detailed non-orbital-optimized capabilities of the OCC module. \u201c\u2713\u201d runs analytically. Single underline \u201c\u2713\u0332\u201d is default module when QC_MODULE unspecified. Double underline \u201c\u2713\u0333\u201d is default algorithm type when type selector (e.g., CC_TYPE) unspecified.": [[1798, "id73"]], "Detailed orbital-optimized capabilities of the OCC module. \u201c\u2713\u201d runs analytically. Single underline \u201c\u2713\u0332\u201d is default module when QC_MODULE unspecified. Double underline \u201c\u2713\u0333\u201d is default algorithm type when type selector (e.g., CC_TYPE) unspecified.": [[1798, "id70"]], "Diagonalization Methods": [[1210, "diagonalization-methods"]], "DiagonalizeOrder": [[63, null]], "Difference F-SAPT Analysis": [[1770, "difference-f-sapt-analysis"]], "Dimension": [[64, null]], "Dimer coordinates": [[1802, "id25"]], "DipoleInt": [[65, null]], "DirectJK": [[66, null]], "DiskSOMCSCF": [[67, null]], "Dispersion": [[68, null]], "Dispersion Corrections": [[1757, "dispersion-corrections"]], "Dispersion-Corrected": [[1758, "dispersion-corrected"]], "Dispersion-Corrected functionals available in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1697, null], [1758, "id7"]], "Do final pass before release tag": [[1788, "do-final-pass-before-release-tag"]], "Documentation Structure": [[1764, "documentation-structure"]], "Double-Hybrid": [[1758, "double-hybrid"]], "Double-Hybrid functionals available in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1696, null], [1758, "id6"]], "E3_SCALE": [[923, null], [1213, "e3-scale"], [1225, "e3-scale"], [1256, null]], "EA_POLES": [[1225, "ea-poles"], [1258, null]], "EFP": [[1216, null], [1678, null]], "EFP Fragments": [[1782, "efp-fragments"]], "EFP_DISP": [[1012, null], [1216, "efp-disp"]], "EFP_DISP_DAMPING": [[1013, null], [1216, "efp-disp-damping"]], "EFP_ELST": [[1014, null], [1216, "efp-elst"]], "EFP_ELST_DAMPING": [[1015, null], [1216, "efp-elst-damping"]], "EFP_EXCH": [[1016, null], [1216, "efp-exch"]], "EFP_IND": [[1017, null], [1216, "efp-ind"]], "EFP_IND_DAMPING": [[1018, null], [1216, "efp-ind-damping"]], "EFP_QM_ELST": [[1019, null], [1216, "efp-qm-elst"]], "EFP_QM_IND": [[1020, null], [1216, "efp-qm-ind"]], "EKT_EA": [[1225, "ekt-ea"], [1259, null]], "EKT_IP": [[925, null], [1213, "ekt-ip"], [1225, "ekt-ip"], [1260, null]], "ENERGY_LEVEL_SHIFT": [[738, null], [1208, "energy-level-shift"]], "ENSURE_BT_CONVERGENCE": [[1226, "ensure-bt-convergence"], [1306, null]], "EOM_GUESS": [[474, null], [1200, "eom-guess"], [1742, "eom-guess"]], "EOM_REFERENCE": [[475, null], [508, null], [1200, "eom-reference"], [1201, "eom-reference"]], "EP2_CONVERGENCE": [[893, null], [1211, "ep2-convergence"]], "EP2_MAXITER": [[894, null], [1211, "ep2-maxiter"]], "EP2_NUM_EA": [[895, null], [1211, "ep2-num-ea"]], "EP2_NUM_IP": [[896, null], [1211, "ep2-num-ip"]], "EP2_ORBITALS": [[897, null], [1211, "ep2-orbitals"]], "EP_EA_POLES": [[1225, "ep-ea-poles"], [1261, null]], "EP_IP_POLES": [[1225, "ep-ip-poles"], [1262, null]], "EP_MAXITER": [[1225, "ep-maxiter"], [1263, null]], "ERI": [[69, null]], "ERI Algorithms": [[1757, "eri-algorithms"], [1838, "eri-algorithms"]], "ESPPropCalc": [[70, null]], "EXCH_SCALE_ALPHA": [[1230, "exch-scale-alpha"], [1453, null], [1837, "exch-scale-alpha"]], "EXCITATION_RANGE": [[476, null], [1200, "excitation-range"]], "EXPLICIT_HAMILTONIAN": [[718, null], [1207, "explicit-hamiltonian"]], "EXTERN": [[1231, "extern"], [1553, null]], "EXTERNAL_POTENTIAL_SYMMETRY": [[1124, null], [1221, "external-potential-symmetry"]], "EXT_FORCE_BEND": [[1226, "ext-force-bend"], [1307, null]], "EXT_FORCE_CARTESIAN": [[1226, "ext-force-cartesian"], [1308, null]], "EXT_FORCE_DIHEDRAL": [[1226, "ext-force-dihedral"], [1309, null]], "EXT_FORCE_DISTANCE": [[1226, "ext-force-distance"], [1310, null]], "EXT_FORCE_OOFP": [[1226, "ext-force-oofp"], [1311, null]], "EX_ALLOW": [[819, null], [1210, "ex-allow"]], "EX_LEVEL": [[820, null], [1210, "ex-level"], [1755, "ex-level"]], "E_CONVERGENCE": [[439, null], [473, null], [737, null], [818, null], [924, null], [971, null], [1079, null], [1178, null], [1199, "e-convergence"], [1200, "e-convergence"], [1208, "e-convergence"], [1210, "e-convergence"], [1213, "e-convergence"], [1214, "e-convergence"], [1219, "e-convergence"], [1222, "e-convergence"], [1224, "e-convergence"], [1225, "e-convergence"], [1229, "e-convergence"], [1231, "e-convergence"], [1233, null], [1257, null], [1410, null], [1552, null], [1742, "e-convergence"], [1771, "e-convergence"], [1798, "e-convergence"], [1798, "id34"]], "Easier and more rapid development": [[1824, "easier-and-more-rapid-development"]], "Effective core potentials (ECPs)": [[1838, "effective-core-potentials-ecps"]], "ElectricFieldInt": [[71, null]], "ElectrostaticInt": [[72, null]], "Elementary Restart": [[1767, "elementary-restart"]], "Embarrassing Parallelism": [[1840, null]], "Empirical Dispersion Implementations": [[1759, "empirical-dispersion-implementations"]], "Empirical dispersion correction packages": [[1759, "id35"]], "EmpiricalDispersion": [[267, null]], "Environment Variables": [[1735, "environment-variables"], [1767, "environment-variables"]], "Environmental Effects": [[1231, "environmental-effects"]], "Evaluation of One-Electron Properties \u2014 oeprop()": [[1799, null]], "Examples": [[1843, "examples"]], "Excited State Coupled Cluster Calculations": [[1742, "excited-state-coupled-cluster-calculations"]], "Expert": [[1198, "expert"], [1199, "expert"], [1200, "expert"], [1201, "expert"], [1202, "expert"], [1203, "expert"], [1204, "expert"], [1205, "expert"], [1208, "expert"], [1209, "expert"], [1212, "expert"], [1216, "expert"], [1218, "expert"], [1219, "expert"], [1221, "expert"], [1222, "expert"], [1224, "expert"], [1225, "expert"], [1227, "expert"], [1229, "expert"]], "Expert Alternative Algorithms": [[1210, "expert-alternative-algorithms"]], "Expert COSX Algorithm": [[1231, "expert-cosx-algorithm"]], "Expert Convergence Control/Stabilization": [[1231, "expert-convergence-control-stabilization"]], "Expert DFSCF Algorithm": [[1231, "expert-dfscf-algorithm"]], "Expert DFT": [[1231, "expert-dft"]], "Expert DOI Grid Options": [[1214, "expert-doi-grid-options"]], "Expert Density Matrices": [[1210, "expert-density-matrices"]], "Expert Diagonalization Methods": [[1210, "expert-diagonalization-methods"]], "Expert Expert Options": [[1214, "expert-expert-options"]], "Expert File Handling": [[1210, "expert-file-handling"]], "Expert General Options": [[1210, "expert-general-options"]], "Expert General Wavefunction Info": [[1231, "expert-general-wavefunction-info"]], "Expert General-Order Coupled-Cluster": [[1210, "expert-general-order-coupled-cluster"]], "Expert General-Order Perturbation Theory": [[1210, "expert-general-order-perturbation-theory"]], "Expert Guess Vectors": [[1210, "expert-guess-vectors"]], "Expert Misc.": [[1231, "expert-misc"]], "Expert Parallel Runtime": [[1231, "expert-parallel-runtime"]], "Expert Psi4 Control of CFOUR": [[1206, "expert-psi4-control-of-cfour"]], "Expert Root Following": [[1210, "expert-root-following"]], "Expert SAD Guess Algorithm": [[1231, "expert-sad-guess-algorithm"]], "Expert SAPT(DFT)": [[1230, "expert-sapt-dft"]], "Expert SAPT(HF)": [[1230, "expert-sapt-hf"]], "Expert snLinK Algorithm": [[1231, "expert-snlink-algorithm"]], "Exposing C++ code to Python": [[1823, "exposing-c-code-to-python"]], "External API Objects": [[1768, null]], "External potentials and QM/MM": [[1838, "external-potentials-and-qm-mm"]], "ExternalPotential": [[73, null]], "Extra QCA Functions": [[2, "extra-qca-functions"]], "Extrapolation Schemes": [[1740, "extrapolation-schemes"]], "F-SAPT: A Representative Example": [[1770, "f-sapt-a-representative-example"]], "F/I-SAPT: Functional Group and/or Intramolecular SAPT": [[1770, null]], "FAIL_ON_MAXITER": [[1231, "fail-on-maxiter"], [1554, null]], "FAVG": [[1179, null], [1222, "favg"]], "FAVG_CCSD_T": [[1229, "favg-ccsd-t"], [1411, null]], "FAVG_START": [[1180, null], [1222, "favg-start"]], "FCHKWriter": [[74, null]], "FCI": [[821, null], [1210, "fci"], [1755, "fci"]], "FCI_STRINGS": [[822, null], [1210, "fci-strings"]], "FDDS_Dispersion": [[75, null]], "FD_PROJECT": [[1024, null], [1217, "fd-project"]], "FILTER_GUESS": [[823, null], [1210, "filter-guess"]], "FILTER_GUESS_DET1": [[824, null], [1210, "filter-guess-det1"]], "FILTER_GUESS_DET2": [[825, null], [1210, "filter-guess-det2"]], "FILTER_GUESS_SIGN": [[826, null], [1210, "filter-guess-sign"]], "FILTER_ZERO_DET": [[827, null], [1210, "filter-zero-det"]], "FINDIF": [[1217, null]], "FISAPT": [[76, null], [1218, null], [1679, null]], "FISAPT_CHARGE_COMPLETENESS": [[1034, null], [1218, "fisapt-charge-completeness"]], "FISAPT_CUBE_DENSMAT": [[1035, null], [1218, "fisapt-cube-densmat"], [1770, "fisapt-cube-densmat"]], "FISAPT_CUBE_LINKIBOS": [[1036, null], [1218, "fisapt-cube-linkibos"], [1770, "fisapt-cube-linkibos"]], "FISAPT_CUBE_LINKIHOS": [[1037, null], [1218, "fisapt-cube-linkihos"], [1770, "fisapt-cube-linkihos"]], "FISAPT_DO_FSAPT": [[1038, null], [1218, "fisapt-do-fsapt"]], "FISAPT_DO_FSAPT_DISP": [[1039, null], [1218, "fisapt-do-fsapt-disp"]], "FISAPT_DO_PLOT": [[1040, null], [1218, "fisapt-do-plot"]], "FISAPT_EXCH_PARPERP": [[1041, null], [1218, "fisapt-exch-parperp"], [1770, "fisapt-exch-parperp"]], "FISAPT_FSAPT_EXCH_SCALE": [[1042, null], [1218, "fisapt-fsapt-exch-scale"]], "FISAPT_FSAPT_FILEPATH": [[1043, null], [1218, "fisapt-fsapt-filepath"]], "FISAPT_FSAPT_IND_RESPONSE": [[1044, null], [1218, "fisapt-fsapt-ind-response"]], "FISAPT_FSAPT_IND_SCALE": [[1045, null], [1218, "fisapt-fsapt-ind-scale"]], "FISAPT_FSSAPT_FILEPATH": [[1046, null], [1218, "fisapt-fssapt-filepath"]], "FISAPT_LINK_ASSIGNMENT": [[1047, null], [1218, "fisapt-link-assignment"]], "FISAPT_LINK_ORTHO": [[1048, null], [1218, "fisapt-link-ortho"], [1770, "fisapt-link-ortho"]], "FISAPT_LINK_SELECTION": [[1049, null], [1218, "fisapt-link-selection"]], "FISAPT_MANUAL_LINKS": [[1050, null], [1218, "fisapt-manual-links"]], "FISAPT_MEM_SAFETY_FACTOR": [[1051, null], [1218, "fisapt-mem-safety-factor"]], "FISAPT_PLOT_FILEPATH": [[1052, null], [1218, "fisapt-plot-filepath"]], "FLEXIBLE_G_CONVERGENCE": [[1226, "flexible-g-convergence"], [1312, null]], "FNOCC": [[1219, null], [1680, null]], "FNOCC: Frozen natural orbitals for CCSD(T), QCISD(T), CEPA, and MP4": [[1771, null]], "FOLLOW_ROOT": [[828, null], [1181, null], [1210, "follow-root"], [1222, "follow-root"], [1229, "follow-root"], [1412, null]], "FOLLOW_STEP_INCREMENT": [[1231, "follow-step-increment"], [1555, null]], "FOLLOW_STEP_SCALE": [[1231, "follow-step-scale"], [1556, null]], "FOLLOW_VECTOR": [[829, null], [1210, "follow-vector"]], "FORCE_RESTART": [[440, null], [1199, "force-restart"]], "FORCE_TWOCON": [[1182, null], [1222, "force-twocon"]], "FRAC_DIIS": [[1231, "frac-diis"], [1557, null]], "FRAC_LOAD": [[1231, "frac-load"], [1558, null]], "FRAC_OCC": [[1231, "frac-occ"], [1559, null]], "FRAC_RENORMALIZE": [[1231, "frac-renormalize"], [1560, null]], "FRAC_START": [[1231, "frac-start"], [1561, null]], "FRAC_VAL": [[1231, "frac-val"], [1562, null]], "FRAG_MODE": [[1226, "frag-mode"], [1313, null]], "FRAG_REF_ATOMS": [[1226, "frag-ref-atoms"], [1314, null]], "FREEZE_ALL_DIHEDRALS": [[1226, "freeze-all-dihedrals"], [1315, null]], "FREEZE_CORE": [[1125, null], [1221, "freeze-core"], [1230, "freeze-core"], [1454, null], [1771, "freeze-core"], [1837, "freeze-core"], [1837, "id24"]], "FREEZE_CORE_POLICY": [[1126, null], [1221, "freeze-core-policy"]], "FREEZE_INTERFRAG": [[1226, "freeze-interfrag"], [1316, null]], "FREEZE_INTRAFRAG": [[1226, "freeze-intrafrag"], [1317, null]], "FROZEN_BEND": [[1226, "frozen-bend"], [1318, null]], "FROZEN_CARTESIAN": [[1226, "frozen-cartesian"], [1319, null]], "FROZEN_DIHEDRAL": [[1226, "frozen-dihedral"], [1320, null]], "FROZEN_DISTANCE": [[1226, "frozen-distance"], [1321, null]], "FROZEN_DOCC": [[1127, null], [1221, "frozen-docc"], [1755, "frozen-docc"]], "FROZEN_OOFP": [[1226, "frozen-oofp"], [1322, null]], "FROZEN_UOCC": [[1128, null], [1221, "frozen-uocc"], [1755, "frozen-uocc"]], "FULL_HESS_EVERY": [[1226, "full-hess-every"], [1323, null], [1802, "full-hess-every"]], "FULL_MATRIX": [[477, null], [1200, "full-matrix"]], "F_CUT": [[972, null], [1214, "f-cut"]], "File Formats": [[2, "file-formats"]], "File Handling": [[1210, "file-handling"]], "Files in a Plugin Directory": [[1808, "files-in-a-plugin-directory"]], "Finalize release": [[1788, "finalize-release"]], "Find-the-code Quiz": [[1737, "find-the-code-quiz"]], "FittedSlaterCorrelationFactor": [[77, null]], "FittingMetric": [[78, null]], "Fork from GitHub Repository": [[1737, "fork-from-github-repository"]], "Fractional Occupation UHF/UKS": [[1231, "fractional-occupation-uhf-uks"]], "Fractional Particle Curves": [[1757, "fractional-particle-curves"]], "Fragment Library": [[1782, "fragment-library"]], "Fragment/Internal Coordinate Control": [[1226, "fragment-internal-coordinate-control"]], "FragmentType": [[79, null]], "Frozen natural orbitals (FNO)": [[1771, "frozen-natural-orbitals-fno"]], "Function Intercalls": [[1779, null]], "Functional": [[80, null]], "Functional Selection": [[1757, "functional-selection"]], "Functionality": [[1743, "functionality"]], "Functions": [[1772, "functions"], [1827, "functions"], [1827, "id1"], [1827, "id4"]], "Further keywords for ddx": [[1754, "further-keywords-for-ddx"]], "GAUGE": [[402, null], [414, null], [539, null], [1197, "gauge"], [1198, "gauge"], [1203, "gauge"], [1742, "gauge"]], "GCP": [[1718, null]], "GDMA": [[1220, null], [1681, null], [1719, null]], "GDMA_LIMIT": [[1097, null], [1220, "gdma-limit"], [1775, "gdma-limit"]], "GDMA_MULTIPOLE_UNITS": [[1098, null], [1220, "gdma-multipole-units"], [1775, "gdma-multipole-units"]], "GDMA_ORIGIN": [[1099, null], [1220, "gdma-origin"], [1775, "gdma-origin"]], "GDMA_RADIUS": [[1100, null], [1220, "gdma-radius"], [1775, "gdma-radius"]], "GDMA_SWITCH": [[1101, null], [1220, "gdma-switch"], [1775, "gdma-switch"]], "GEOM_MAXITER": [[1226, "geom-maxiter"], [1325, null], [1802, "geom-maxiter"]], "GGA": [[1758, "gga"]], "GGA functionals available in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1699, null], [1758, "id2"]], "GLOBALS": [[1221, null]], "GPU_DFCC": [[1720, null]], "GRADIENT_WRITE": [[1025, null], [1217, "gradient-write"]], "GUESS": [[1231, "guess"], [1563, null]], "GUESS_MIX": [[1231, "guess-mix"], [1564, null]], "GUESS_PERSIST": [[1231, "guess-persist"], [1565, null]], "GUESS_R_CONVERGENCE": [[739, null], [1208, "guess-r-convergence"]], "GUESS_VECTOR": [[830, null], [1210, "guess-vector"]], "G_CONVERGENCE": [[1226, "g-convergence"], [1324, null], [1802, "g-convergence"]], "Gaussian": [[322, null]], "GaussianShell": [[81, null]], "GaussianType": [[82, null]], "General": [[1197, "general"], [1198, "general"], [1199, "general"], [1200, "general"], [1201, "general"], [1202, "general"], [1203, "general"], [1204, "general"], [1205, "general"], [1207, "general"], [1208, "general"], [1209, "general"], [1211, "general"], [1212, "general"], [1213, "general"], [1215, "general"], [1216, "general"], [1217, "general"], [1218, "general"], [1219, "general"], [1220, "general"], [1221, "general"], [1222, "general"], [1223, "general"], [1224, "general"], [1225, "general"], [1227, "general"], [1228, "general"], [1229, "general"], [1232, "general"]], "General Options": [[1210, "general-options"], [1214, "general-options"]], "General Wavefunction Info": [[1231, "general-wavefunction-info"]], "General layout of the core: where new C++ code should live": [[1823, null]], "General-Order Coupled-Cluster": [[1210, "general-order-coupled-cluster"]], "General-Order Perturbation Theory": [[1210, "general-order-perturbation-theory"]], "Generate download page for psicode.org": [[1788, "generate-download-page-for-psicode-org"]], "Generation of Cube Files \u2014 cubeprop()": [[1750, null]], "Geometry Optimization": [[1802, null]], "Geometry Optimization and Vibrational Frequency Analysis": [[1844, "geometry-optimization-and-vibrational-frequency-analysis"]], "Geometry Optimization \u2014 optimize() and gradient()": [[1800, null]], "GeometryUnits": [[83, null]], "Ghost Atoms": [[1833, "ghost-atoms"]], "Git, Versioning": [[1786, null]], "Gn theory": [[1771, "gn-theory"]], "Grid Selection": [[1757, "grid-selection"]], "Guess Vectors": [[1210, "guess-vectors"]], "H0_BLOCKSIZE": [[833, null], [1210, "h0-blocksize"]], "H0_BLOCK_COUPLING": [[831, null], [1210, "h0-block-coupling"]], "H0_BLOCK_COUPLING_SIZE": [[832, null], [1210, "h0-block-coupling-size"]], "H0_GUESS_SIZE": [[834, null], [1210, "h0-guess-size"]], "HBC6": [[1692, "hbc6"], [1752, "hbc6"]], "HD_AVG": [[835, null], [1210, "hd-avg"]], "HD_OTF": [[836, null], [1210, "hd-otf"]], "HEFF4": [[1229, "heff4"], [1413, null]], "HEFF_PRINT": [[1229, "heff-print"], [1414, null]], "HESSIAN_WRITE": [[1026, null], [1217, "hessian-write"]], "HESS_TYPE": [[926, null], [1213, "hess-type"], [1798, "hess-type"]], "HESS_UPDATE": [[1226, "hess-update"], [1329, null]], "HESS_UPDATE_LIMIT": [[1226, "hess-update-limit"], [1330, null]], "HESS_UPDATE_LIMIT_MAX": [[1226, "hess-update-limit-max"], [1331, null]], "HESS_UPDATE_LIMIT_SCALE": [[1226, "hess-update-limit-scale"], [1332, null]], "HESS_UPDATE_USE_LAST": [[1226, "hess-update-use-last"], [1333, null]], "HF": [[84, null]], "HF: Hartree\u2013Fock Theory": [[1838, null]], "HSG": [[1692, "hsg"], [1752, "hsg"]], "HTBH": [[1692, "htbh"], [1752, "htbh"]], "HTR40": [[1692, "htr40"], [1752, "htr40"]], "H_BOND_CONNECT": [[1226, "h-bond-connect"], [1326, null]], "H_GUESS_EVERY": [[1226, "h-guess-every"], [1327, null]], "H_UPDATE_DEN_TOL": [[1226, "h-update-den-tol"], [1328, null]], "Handling Options in Driver": [[1801, "handling-options-in-driver"]], "Harmonic Vibrational Analysis and Visualization of Normal Modes \u2014 frequency() and hessian()": [[1772, null]], "Header": [[1820, "header"]], "Hessian": [[1802, "hessian"]], "Hessian Update": [[1226, "hessian-update"]], "Higher-Order Exchange Terms without Single-Exchange Approximation": [[1837, "higher-order-exchange-terms-without-single-exchange-approximation"]], "Higher-Order SAPT": [[1837, "higher-order-sapt"]], "How and when to not apply code styling to your contributions": [[1747, "how-and-when-to-not-apply-code-styling-to-your-contributions"]], "How do I retain specific Psi4 scratch files": [[1738, "how-do-i-retain-specific-psi4-scratch-files"]], "How to Ignore the Bots": [[1822, "how-to-ignore-the-bots"]], "How to build and install Psi4, the compact version": [[1738, "how-to-build-and-install-psi4-the-compact-version"]], "How to build, test, and install Psi4, in detail": [[1738, "how-to-build-test-and-install-psi4-in-detail"]], "How to bump a version": [[1786, "how-to-bump-a-version"]], "How to call BLAS & LAPACK in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1810, "how-to-call-blas-lapack-in-psifour"]], "How to choose the compilation directory, {objdir}": [[1738, "how-to-choose-the-compilation-directory-objdir"]], "How to compile for debugging": [[1738, "how-to-compile-for-debugging"]], "How to configure BLAS/LAPACK for building Psi4": [[1738, "how-to-configure-blas-lapack-for-building-psi4"]], "How to configure C++ and C compilers for building Psi4": [[1738, "how-to-configure-c-and-c-compilers-for-building-psi4"]], "How to configure CPPE for building Psi4": [[1749, "how-to-configure-cppe-for-building-psi4"]], "How to configure CheMPS2 for building Psi4": [[1746, "how-to-configure-chemps2-for-building-psi4"]], "How to configure Fortran compilers for building Psi4": [[1738, "how-to-configure-fortran-compilers-for-building-psi4"]], "How to configure LibECPInt for building Psi4": [[1765, "how-to-configure-libecpint-for-building-psi4"]], "How to configure Libint for building Psi4": [[1783, "how-to-configure-libint-for-building-psi4"]], "How to configure Libxc for building Psi4": [[1784, "how-to-configure-libxc-for-building-psi4"]], "How to configure PCMSolver for building Psi4": [[1803, "how-to-configure-pcmsolver-for-building-psi4"]], "How to configure Python for building Psi4": [[1738, "how-to-configure-python-for-building-psi4"]], "How to configure a Psi4 build on Cray": [[1738, "how-to-configure-a-psi4-build-on-cray"]], "How to configure adcc for building Psi4": [[1, "how-to-configure-adcc-for-building-psi4"]], "How to configure code to use high angular momentum basis sets": [[1738, "how-to-configure-code-to-use-high-angular-momentum-basis-sets"]], "How to configure ddx for building Psi4": [[1754, "how-to-configure-ddx-for-building-psi4"]], "How to configure dkh for building Psi4": [[1762, "how-to-configure-dkh-for-building-psi4"]], "How to configure gau2gridfor building Psi4": [[1773, "how-to-configure-gau2gridfor-building-psi4"]], "How to configure gdma for building Psi4": [[1775, "how-to-configure-gdma-for-building-psi4"]], "How to configure libefp for building Psi4": [[1782, "how-to-configure-libefp-for-building-psi4"]], "How to configure paths for PsiAPI": [[1738, "how-to-configure-paths-for-psiapi"]], "How to configure simint for building Psi4": [[1839, "how-to-configure-simint-for-building-psi4"]], "How to create and remove an annotated Git tag on a remote": [[1786, "how-to-create-and-remove-an-annotated-git-tag-on-a-remote"]], "How to do GitHub issue management and code review": [[1786, "how-to-do-github-issue-management-and-code-review"]], "How to find tests without output.ref": [[1786, "how-to-find-tests-without-output-ref"]], "How to find the Psi4 module from the executable and vice versa": [[1738, "how-to-find-the-psi4-module-from-the-executable-and-vice-versa"]], "How to fix \u201cPsi4 undefined\u201d version": [[1786, "how-to-fix-psi4-undefined-version"]], "How to fix \u201ccannot import name \u2018core\u2019 from {top-level-psi4-dir}": [[1786, "how-to-fix-cannot-import-name-core-from-top-level-psi4-dir"]], "How to fix \u201cplugin needed to handle lto object\u201d when building CheMPS2": [[1746, "how-to-fix-plugin-needed-to-handle-lto-object-when-building-chemps2"]], "How to fix \u201cundefined symbol: _Py_FalseStruct\u201d": [[1738, "how-to-fix-undefined-symbol-py-falsestruct"]], "How to get a Psi4 logo file": [[1738, "how-to-get-a-psi4-logo-file"]], "How to get high angular momentum integrals from conda": [[1738, "how-to-get-high-angular-momentum-integrals-from-conda"]], "How to handle \u201cruntime library may be hidden\u201d when building with Anaconda Python": [[1738, "how-to-handle-runtime-library-may-be-hidden-when-building-with-anaconda-python"]], "How to highlight git merge conflicts in vi": [[1738, "how-to-highlight-git-merge-conflicts-in-vi"]], "How to impose code style through Git hooks": [[1747, "how-to-impose-code-style-through-git-hooks"]], "How to impose code style through your editor": [[1747, "how-to-impose-code-style-through-your-editor"]], "How to install a Psi4 binary into an Ana/Miniconda distribution": [[1748, "how-to-install-a-psi4-binary-into-an-ana-miniconda-distribution"]], "How to install a Psi4 binary with the Psi4conda installer, command-line": [[1748, "how-to-install-a-psi4-binary-with-the-psi4conda-installer-command-line"]], "How to install a Psi4 binary with the Psi4conda installer, download site": [[1748, "how-to-install-a-psi4-binary-with-the-psi4conda-installer-download-site"]], "How to install elsewhere than /usr/local/psi4": [[1738, "how-to-install-elsewhere-than-usr-local-psi4"]], "How to integrate an Add-On into build, testing, and docs": [[1785, "how-to-integrate-an-add-on-into-build-testing-and-docs"]], "How to locate non-ascii characters in the codebase": [[1786, "how-to-locate-non-ascii-characters-in-the-codebase"]], "How to name keywords in psi4/src/read_options.cc": [[1785, "how-to-name-keywords-in-psi4-src-read-options-cc"]], "How to name orbital bases (e.g., AO & SO)": [[1810, "how-to-name-orbital-bases-e-g-ao-so"]], "How to name orbital dimensions": [[1810, "how-to-name-orbital-dimensions"]], "How to name orbital spaces (e.g., docc)": [[1810, "how-to-name-orbital-spaces-e-g-docc"]], "How to obtain C and C++ compilers for Mac without Fink, MacPorts, or Homebrew": [[1738, "how-to-obtain-c-and-c-compilers-for-mac-without-fink-macports-or-homebrew"]], "How to obtain Psi4: start with find-the-code quiz, end in {top-level-psi4-dir}": [[1737, "how-to-obtain-psi4-start-with-find-the-code-quiz-end-in-top-level-psi4-dir"]], "How to obtain a Fortran compiler for Mac without Fink, MacPorts, or Homebrew": [[1738, "how-to-obtain-a-fortran-compiler-for-mac-without-fink-macports-or-homebrew"]], "How to refer to Psi4": [[1738, "how-to-refer-to-psi4"]], "How to run Psi4 as Python module after compilation": [[1738, "how-to-run-psi4-as-python-module-after-compilation"]], "How to run Psi4 as executable after compilation": [[1738, "how-to-run-psi4-as-executable-after-compilation"]], "How to run Psi4 as executable after compilation using driver from source": [[1738, "how-to-run-psi4-as-executable-after-compilation-using-driver-from-source"]], "How to run Psi4 as executable or Python module from conda installation": [[1738, "how-to-run-psi4-as-executable-or-python-module-from-conda-installation"]], "How to run a minute\u2019s worth of tests": [[1738, "how-to-run-a-minute-s-worth-of-tests"]], "How to run a subset of tests": [[1738, "how-to-run-a-subset-of-tests"]], "How to run code-style tools clang-format and yapf manually": [[1747, "how-to-run-code-style-tools-clang-format-and-yapf-manually"]], "How to satisfy the GCC >= 4.9 requirement on Linux without updating the OS": [[1738, "how-to-satisfy-the-gcc-4-9-requirement-on-linux-without-updating-the-os"]], "How to save configuration settings for a future compilation": [[1738, "how-to-save-configuration-settings-for-a-future-compilation"]], "How to see CTest testing errors": [[1738, "how-to-see-ctest-testing-errors"]], "How to see the actual compiling commands (or errors) with cmake": [[1738, "how-to-see-the-actual-compiling-commands-or-errors-with-cmake"]], "How to see what build configuration options are available": [[1738, "how-to-see-what-build-configuration-options-are-available"]], "How to set up the scratch directory": [[1738, "how-to-set-up-the-scratch-directory"]], "How to solve ModuleNotFoundError: No module named 'psi4'": [[1738, "how-to-solve-modulenotfounderror-no-module-named-psi4"]], "How to test a Psi4 installation": [[1738, "how-to-test-a-psi4-installation"]], "How to update a Psi4 binary": [[1748, "how-to-update-a-psi4-binary"]], "How to update and rebuild Psi4": [[1738, "how-to-update-and-rebuild-psi4"]], "How to use Psi4 within a PBS queue": [[1738, "how-to-use-psi4-within-a-pbs-queue"]], "How to use a local Add-On repository in the Psi4 build": [[1738, "how-to-use-a-local-add-on-repository-in-the-psi4-build"]], "How to use an Add-On\u2019s name in directory structure, build, and distribution": [[1785, "how-to-use-an-add-on-s-name-in-directory-structure-build-and-distribution"]], "How to use conda to compile Psi4 faster and easier": [[1748, "how-to-use-conda-to-compile-psi4-faster-and-easier"]], "How to use conda to get a Psi4 development environment": [[1738, "how-to-use-conda-to-get-a-psi4-development-environment"]], "How to use gdb and lldb with Psi4": [[1738, "how-to-use-gdb-and-lldb-with-psi4"]], "How to use logging in Psi4": [[1738, "how-to-use-logging-in-psi4"]], "How to use low-level BLAS/LAPACK with psi4.core.Matrix": [[1810, "how-to-use-low-level-blas-lapack-with-psi4-core-matrix"]], "Hybrid": [[1758, "hybrid"]], "Hybrid functionals available in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1700, null], [1758, "id5"]], "I-SAPT: A Representative Example": [[1770, "i-sapt-a-representative-example"]], "I. Basic Input Structure": [[1828, "I.-Basic-Input-Structure"]], "ICORE": [[837, null], [1210, "icore"], [1755, "icore"]], "IDAMAX": [[85, null]], "II. Running a Basic Hartree-Fock Calculation": [[1828, "II.-Running-a-Basic-Hartree-Fock-Calculation"]], "III. Geometry Optimization and Vibrational Frequency Analysis": [[1828, "III.-Geometry-Optimization-and-Vibrational-Frequency-Analysis"]], "INCFOCK": [[1231, "incfock"], [1566, null]], "INCFOCK_CONVERGENCE": [[1231, "incfock-convergence"], [1567, null]], "INCFOCK_FULL_FOCK_EVERY": [[1231, "incfock-full-fock-every"], [1568, null]], "INDUCED_CONVERGENCE": [[1228, "induced-convergence"], [1389, null], [1749, "induced-convergence"]], "INTCOS_GENERATE_EXIT": [[1226, "intcos-generate-exit"], [1334, null]], "INTEGRAL_CUTOFF": [[927, null], [1213, "integral-cutoff"]], "INTEGRAL_PACKAGE": [[1129, null], [1221, "integral-package"]], "INTERFRAGMENT_CONNECT": [[1226, "interfragment-connect"], [1341, null]], "INTERFRAG_COLLINEAR_TOL": [[1226, "interfrag-collinear-tol"], [1335, null]], "INTERFRAG_COORDS": [[1226, "interfrag-coords"], [1336, null]], "INTERFRAG_DIST_INV": [[1226, "interfrag-dist-inv"], [1337, null]], "INTERFRAG_HESS": [[1226, "interfrag-hess"], [1338, null]], "INTERFRAG_MODE": [[1226, "interfrag-mode"], [1339, null]], "INTERFRAG_STEP_LIMIT": [[1226, "interfrag-step-limit"], [1340, null]], "INTERNAL_ROTATIONS": [[1183, null], [1222, "internal-rotations"]], "INTRAFRAG_HESS": [[1226, "intrafrag-hess"], [1342, null]], "INTRAFRAG_STEP_LIMIT": [[1226, "intrafrag-step-limit"], [1343, null]], "INTRAFRAG_STEP_LIMIT_MAX": [[1226, "intrafrag-step-limit-max"], [1344, null]], "INTRAFRAG_STEP_LIMIT_MIN": [[1226, "intrafrag-step-limit-min"], [1345, null]], "INTS_TOLERANCE": [[415, null], [740, null], [905, null], [1053, null], [1198, "ints-tolerance"], [1208, "ints-tolerance"], [1212, "ints-tolerance"], [1218, "ints-tolerance"], [1224, "ints-tolerance"], [1230, "ints-tolerance"], [1231, "ints-tolerance"], [1234, null], [1455, null], [1569, null], [1837, "ints-tolerance"], [1837, "id26"]], "IO": [[86, null]], "IOManager": [[87, null]], "IP Fitting": [[1757, "ip-fitting"]], "IP_POLES": [[1225, "ip-poles"], [1264, null]], "IRC_DIRECTION": [[1226, "irc-direction"], [1346, null]], "IRC_POINTS": [[1226, "irc-points"], [1347, null]], "IRC_STEP_SIZE": [[1226, "irc-step-size"], [1348, null]], "ISOTROPIC_POL": [[1228, "isotropic-pol"], [1390, null], [1749, "isotropic-pol"]], "ISTOP": [[838, null], [1210, "istop"]], "IV. Analysis of Intermolecular Interactions": [[1828, "IV.-Analysis-of-Intermolecular-Interactions"]], "Important BLAS Routines": [[1810, "important-blas-routines"]], "Important Lapack Routines": [[1810, "important-lapack-routines"]], "Important User Changes from cpp-optking": [[1802, "important-user-changes-from-cpp-optking"]], "InPsight": [[323, null]], "Incorporating code into <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1824, "incorporating-code-into-psifour"]], "Initial Guess": [[1838, "initial-guess"]], "Initialize release branch": [[1788, "initialize-release-branch"]], "Input": [[1762, "input"], [1775, "input"]], "Inputting effective core potentials (ECPs)": [[1730, "inputting-effective-core-potentials-ecps"]], "Installation": [[1, "installation"], [1743, "installation"], [1746, "installation"], [1749, "installation"], [1754, "installation"], [1759, "installation"], [1762, "installation"], [1765, "installation"], [1773, "installation"], [1774, "installation"], [1775, "installation"], [1782, "installation"], [1783, "installation"], [1784, "installation"], [1792, "installation"], [1803, "installation"], [1805, "installation"], [1806, "installation"], [1807, "installation"], [1839, "installation"]], "Installation and Runtime Configuration": [[1767, null]], "Installing BrianQC": [[1735, "installing-brianqc"]], "Installing Sphinx": [[1764, "installing-sphinx"]], "Instantiating integral objects": [[1817, "instantiating-integral-objects"]], "IntVector": [[88, null]], "Integral consuming technologies": [[1823, "integral-consuming-technologies"]], "Integral-Direct Density-Fitted Coulomb Construction": [[1838, "integral-direct-density-fitted-coulomb-construction"]], "IntegralFactory": [[89, null]], "IntegralTransform": [[90, null]], "Integrals in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1817, null]], "Integrating New Features into <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1815, null]], "Interface Details": [[1792, "interface-details"]], "Interface to CFOUR by J. Stanton & J. Gauss": [[1743, null]], "Interface to CPPE by M. Scheurer": [[1749, null]], "Interface to CheMPS2 by S. Wouters": [[1746, null]], "Interface to DFTD3 by S. Grimme": [[1759, null]], "Interface to DKH by A. Wolf, M. Reiher, and B. A. Hess": [[1762, null]], "Interface to GDMA Distributed Multipole Analysis by A. J. Stone \u2014 gdma()": [[1775, null]], "Interface to GeomeTRIC": [[1802, "interface-to-geometric"]], "Interface to LIBEFP by I. Kaliman": [[1782, null]], "Interface to LibECPInt by R. Shaw": [[1765, null]], "Interface to Libint by E. Valeev": [[1783, null]], "Interface to Libxc by M. A. L. Marques": [[1784, null]], "Interface to MRCC by M. K\u00e1llay": [[1792, null]], "Interface to Molden \u2014 molden()": [[1791, null]], "Interface to NumPy": [[1797, null]], "Interface to PCMSolver by R. Di Remigio": [[1803, null]], "Interface to SIMINT by B. Pritchard": [[1839, null]], "Interface to adcc": [[0, "interface-to-adcc"]], "Interface to adcc by M. F. Herbst and M. Scheurer": [[1, null]], "Interface to ddx by A. Mikhalev, A. Jha, M. Nottoli and M. F. Herbst": [[1754, null]], "Interface to gCP by S. Grimme": [[1774, null]], "Interface to gau2grid by D. G. A. Smith": [[1773, null]], "Interface to programs through FCHK files \u2014 fchk()": [[1769, null]], "Interface to the BrianQC GPU module by the BrianQC team": [[1735, null]], "Interfaces: Enhancing <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span> Capabilities": [[1780, null]], "Interfacing with <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1814, "interfacing-with-psifour"]], "Interpreting SAPT Results": [[1837, "interpreting-sapt-results"]], "Introduction": [[1750, "introduction"], [1756, "introduction"], [1763, "introduction"], [1781, null], [1798, "introduction"], [1817, "introduction"], [1838, "introduction"], [1841, "introduction"]], "Introduction to Programming in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1818, null]], "IrreducibleRepresentation": [[91, null]], "Isotopic Substitution": [[1833, "isotopic-substitution"]], "Iterative Algorithms": [[1753, "iterative-algorithms"]], "Iterative solver parameters": [[1754, "iterative-solver-parameters"]], "JK": [[92, null]], "JOBTYPE": [[516, null], [1202, "jobtype"]], "JSCH": [[1692, "jsch"], [1752, "jsch"]], "JSON": [[1721, null]], "Job Control Keywords": [[1832, "job-control-keywords"]], "KIND": [[1, "kind"], [403, null], [1197, "kind"]], "Keywords": [[400, "keywords"], [1735, "keywords"], [1750, "keywords"], [1762, "keywords"], [1836, "keywords"], [1843, "keywords"]], "Keywords by Alpha": [[1704, null]], "Keywords by Module": [[1705, null]], "Keywords for CPPE": [[1749, "keywords-for-cppe"]], "Keywords for PCMSolver": [[1803, "keywords-for-pcmsolver"]], "Keywords for adcc": [[1, "keywords-for-adcc"]], "KineticInt": [[93, null]], "Known limitations": [[1841, "known-limitations"]], "LAPACK Wrappers": [[1810, "lapack-wrappers"]], "LEVEL_SHIFT": [[928, null], [1184, null], [1213, "level-shift"], [1222, "level-shift"], [1225, "level-shift"], [1231, "level-shift"], [1265, null], [1570, null]], "LEVEL_SHIFT_CUTOFF": [[1231, "level-shift-cutoff"], [1571, null]], "LIBEFP": [[1722, null]], "LINEAR": [[540, null], [1203, "linear"]], "LINEQ_SOLVER": [[929, null], [1213, "lineq-solver"]], "LINK_INTS_TOLERANCE": [[1231, "link-ints-tolerance"], [1572, null]], "LITERAL_CFOUR": [[1130, null], [1221, "literal-cfour"]], "LOCAL": [[441, null], [478, null], [517, null], [541, null], [1199, "local"], [1200, "local"], [1202, "local"], [1203, "local"]], "LOCAL_CONVERGENCE": [[973, null], [1054, null], [1214, "local-convergence"], [1218, "local-convergence"], [1231, "local-convergence"], [1573, null]], "LOCAL_CPHF_CUTOFF": [[442, null], [518, null], [542, null], [1199, "local-cphf-cutoff"], [1202, "local-cphf-cutoff"], [1203, "local-cphf-cutoff"]], "LOCAL_CUTOFF": [[443, null], [479, null], [519, null], [543, null], [1199, "local-cutoff"], [1200, "local-cutoff"], [1202, "local-cutoff"], [1203, "local-cutoff"]], "LOCAL_DO_SINGLES": [[480, null], [1200, "local-do-singles"]], "LOCAL_FILTER_SINGLES": [[481, null], [520, null], [544, null], [1200, "local-filter-singles"], [1202, "local-filter-singles"], [1203, "local-filter-singles"]], "LOCAL_IBO_CONDITION": [[1055, null], [1218, "local-ibo-condition"]], "LOCAL_IBO_POWER": [[1056, null], [1218, "local-ibo-power"]], "LOCAL_IBO_STARS": [[1057, null], [1218, "local-ibo-stars"]], "LOCAL_IBO_STARS_COMPLETENESS": [[1058, null], [1218, "local-ibo-stars-completeness"]], "LOCAL_IBO_USE_STARS": [[1059, null], [1218, "local-ibo-use-stars"]], "LOCAL_MAXITER": [[974, null], [1060, null], [1214, "local-maxiter"], [1218, "local-maxiter"], [1231, "local-maxiter"], [1574, null]], "LOCAL_METHOD": [[444, null], [482, null], [521, null], [545, null], [1199, "local-method"], [1200, "local-method"], [1202, "local-method"], [1203, "local-method"]], "LOCAL_PAIRDEF": [[445, null], [522, null], [546, null], [1199, "local-pairdef"], [1202, "local-pairdef"], [1203, "local-pairdef"]], "LOCAL_PRECONDITIONER": [[483, null], [1200, "local-preconditioner"]], "LOCAL_USE_GHOSTS": [[1061, null], [1218, "local-use-ghosts"]], "LOCAL_WEAKP": [[446, null], [484, null], [523, null], [547, null], [1199, "local-weakp"], [1200, "local-weakp"], [1202, "local-weakp"], [1203, "local-weakp"]], "LOCK_SINGLET": [[1229, "lock-singlet"], [1415, null]], "LSE": [[839, null], [1210, "lse"]], "LSE_COLLAPSE": [[840, null], [1210, "lse-collapse"]], "LSE_TOLERANCE": [[841, null], [1210, "lse-tolerance"]], "LS_THC_BASIS_TOLERANCE": [[1131, null], [1221, "ls-thc-basis-tolerance"]], "LS_THC_Computer": [[94, null]], "LS_THC_DF": [[1132, null], [1221, "ls-thc-df"]], "LS_THC_PRUNING_SCHEME": [[1133, null], [1221, "ls-thc-pruning-scheme"]], "LS_THC_RADIAL_POINTS": [[1134, null], [1221, "ls-thc-radial-points"]], "LS_THC_SPHERICAL_POINTS": [[1136, null], [1221, "ls-thc-spherical-points"]], "LS_THC_S_EPSILON": [[1135, null], [1221, "ls-thc-s-epsilon"]], "LS_THC_WEIGHTS_TOLERANCE": [[1137, null], [1221, "ls-thc-weights-tolerance"]], "LaplaceDenominator": [[95, null]], "Larger Calculations": [[1742, "larger-calculations"]], "Levels of truncation for diffuse functions in standard basis sets": [[1733, "id16"]], "LibOptions: globals, locals, has_changed and all that": [[1801, null]], "LibXCFunctional": [[96, null]], "License": [[1781, "license"]], "Linear Algebra in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1810, null]], "Linear Exchange": [[1838, "linear-exchange"]], "Linear Response (CCLR) Calculations": [[1742, "linear-response-cclr-calculations"]], "Lineshape": [[324, null]], "Link Orbital Partitioning in I-SAPT": [[1770, "link-orbital-partitioning-in-i-sapt"]], "Localizer": [[97, null]], "Long-Range Corrected": [[1758, "long-range-corrected"]], "Long-Range-Corrected functionals available in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1701, null], [1758, "id4"]], "Loops": [[1832, "loops"]], "Lorentzian": [[325, null]], "MADMP2_SLEEP": [[906, null], [1212, "madmp2-sleep"]], "MAT_NUM_COLUMN_PRINT": [[1138, null], [1221, "mat-num-column-print"]], "MAXITER": [[1, "maxiter"], [405, null], [447, null], [485, null], [524, null], [548, null], [741, null], [1062, null], [1080, null], [1185, null], [1197, "maxiter"], [1199, "maxiter"], [1200, "maxiter"], [1202, "maxiter"], [1203, "maxiter"], [1208, "maxiter"], [1218, "maxiter"], [1219, "maxiter"], [1222, "maxiter"], [1228, "maxiter"], [1229, "maxiter"], [1230, "maxiter"], [1231, "maxiter"], [1391, null], [1416, null], [1457, null], [1577, null], [1742, "maxiter"], [1749, "maxiter"], [1771, "maxiter"], [1837, "maxiter"]], "MAX_ATTEMPTS": [[1231, "max-attempts"], [1575, null]], "MAX_CCD_DIISVECS": [[1230, "max-ccd-diisvecs"], [1456, null]], "MAX_DISP_G_CONVERGENCE": [[1226, "max-disp-g-convergence"], [1349, null]], "MAX_ENERGY_G_CONVERGENCE": [[1226, "max-energy-g-convergence"], [1350, null]], "MAX_FORCE_G_CONVERGENCE": [[1226, "max-force-g-convergence"], [1351, null]], "MAX_MEM_BUF": [[1231, "max-mem-buf"], [1576, null]], "MAX_MOGRAD_CONVERGENCE": [[930, null], [1213, "max-mograd-convergence"], [1225, "max-mograd-convergence"], [1266, null], [1798, "max-mograd-convergence"], [1798, "id37"]], "MAX_NUM_VECS": [[1, "max-num-vecs"], [404, null], [842, null], [1197, "max-num-vecs"], [1210, "max-num-vecs"]], "MAX_RADIAL_MOMENT": [[1139, null], [1221, "max-radial-moment"]], "MBIS_D_CONVERGENCE": [[1140, null], [1221, "mbis-d-convergence"]], "MBIS_MAXITER": [[1141, null], [1221, "mbis-maxiter"]], "MBIS_PRUNING_SCHEME": [[1142, null], [1221, "mbis-pruning-scheme"]], "MBIS_RADIAL_POINTS": [[1143, null], [1221, "mbis-radial-points"]], "MBIS_SPHERICAL_POINTS": [[1144, null], [1221, "mbis-spherical-points"]], "MCSCF": [[1210, "mcscf"], [1222, null], [1682, null]], "MCSCF: Multi-Configurational Self-Consistent-Field": [[1789, null]], "MCSCF_ALGORITHM": [[843, null], [1210, "mcscf-algorithm"], [1789, "mcscf-algorithm"]], "MCSCF_CI_CLEANUP": [[844, null], [1210, "mcscf-ci-cleanup"]], "MCSCF_DIIS_ERROR_TYPE": [[845, null], [1210, "mcscf-diis-error-type"]], "MCSCF_DIIS_FREQ": [[846, null], [1210, "mcscf-diis-freq"]], "MCSCF_DIIS_MAX_VECS": [[847, null], [1210, "mcscf-diis-max-vecs"]], "MCSCF_DIIS_START": [[848, null], [1210, "mcscf-diis-start"], [1789, "mcscf-diis-start"]], "MCSCF_DPD_CLEANUP": [[849, null], [1210, "mcscf-dpd-cleanup"]], "MCSCF_E_CONVERGENCE": [[850, null], [1210, "mcscf-e-convergence"], [1789, "mcscf-e-convergence"]], "MCSCF_GUESS": [[851, null], [1210, "mcscf-guess"]], "MCSCF_MAXITER": [[853, null], [1210, "mcscf-maxiter"], [1789, "mcscf-maxiter"]], "MCSCF_MAX_ROT": [[852, null], [1210, "mcscf-max-rot"]], "MCSCF_ROTATE": [[855, null], [1210, "mcscf-rotate"], [1789, "mcscf-rotate"]], "MCSCF_R_CONVERGENCE": [[854, null], [1210, "mcscf-r-convergence"], [1789, "mcscf-r-convergence"]], "MCSCF_SO_START_E": [[856, null], [1210, "mcscf-so-start-e"]], "MCSCF_SO_START_GRAD": [[857, null], [1210, "mcscf-so-start-grad"]], "MCSCF_TYPE": [[858, null], [1210, "mcscf-type"], [1789, "mcscf-type"]], "MINAO_BASIS": [[1063, null], [1218, "minao-basis"]], "MINTS": [[1223, null]], "MIN_CCD_DIISVECS": [[1230, "min-ccd-diisvecs"], [1458, null]], "MIXED": [[859, null], [1210, "mixed"]], "MIXED4": [[860, null], [1210, "mixed4"]], "MODULE": [[719, null], [1207, "module"]], "MOGRAD_DAMPING": [[1225, "mograd-damping"], [1271, null]], "MOLDEN_WITH_VIRTUAL": [[1145, null], [1221, "molden-with-virtual"], [1791, "molden-with-virtual"]], "MOLDEN_WRITE": [[934, null], [1213, "molden-write"], [1231, "molden-write"], [1578, null], [1791, "molden-write"]], "MOM_OCC": [[1231, "mom-occ"], [1579, null]], "MOM_START": [[1231, "mom-start"], [1580, null]], "MOM_VIR": [[1231, "mom-vir"], [1581, null]], "MOSpace": [[98, null]], "MOWriter": [[99, null]], "MO_DIIS_NUM_VECS": [[931, null], [1213, "mo-diis-num-vecs"], [1798, "mo-diis-num-vecs"]], "MO_MAXITER": [[932, null], [1213, "mo-maxiter"], [1225, "mo-maxiter"], [1267, null], [1798, "mo-maxiter"], [1798, "id38"]], "MO_READ": [[1186, null], [1222, "mo-read"], [1225, "mo-read"], [1268, null]], "MO_STEP_MAX": [[933, null], [1213, "mo-step-max"], [1225, "mo-step-max"], [1269, null]], "MO_WRITE": [[1225, "mo-write"], [1270, null]], "MP2 Natural Orbitals": [[1837, "mp2-natural-orbitals"]], "MP2_AMPS_PRINT": [[448, null], [1199, "mp2-amps-print"], [1742, "mp2-amps-print"]], "MP2_AMP_TYPE": [[935, null], [1213, "mp2-amp-type"]], "MP2_CCSD_METHOD": [[1229, "mp2-ccsd-method"], [1417, null]], "MP2_GUESS": [[1229, "mp2-guess"], [1418, null]], "MP2_OS_SCALE": [[449, null], [907, null], [936, null], [1199, "mp2-os-scale"], [1212, "mp2-os-scale"], [1213, "mp2-os-scale"], [1225, "mp2-os-scale"], [1272, null], [1798, "mp2-os-scale"]], "MP2_SCALE_OS": [[1081, null], [1219, "mp2-scale-os"], [1771, "mp2-scale-os"]], "MP2_SCALE_SS": [[1082, null], [1219, "mp2-scale-ss"], [1771, "mp2-scale-ss"]], "MP2_SOS_SCALE": [[937, null], [1213, "mp2-sos-scale"], [1225, "mp2-sos-scale"], [1273, null], [1798, "mp2-sos-scale"]], "MP2_SOS_SCALE2": [[938, null], [1213, "mp2-sos-scale2"], [1225, "mp2-sos-scale2"], [1274, null], [1798, "mp2-sos-scale2"]], "MP2_SS_SCALE": [[450, null], [908, null], [939, null], [1199, "mp2-ss-scale"], [1212, "mp2-ss-scale"], [1213, "mp2-ss-scale"], [1225, "mp2-ss-scale"], [1275, null], [1798, "mp2-ss-scale"]], "MP2_TYPE": [[1146, null], [1221, "mp2-type"]], "MPN": [[861, null], [1210, "mpn"], [1755, "mpn"]], "MPN_ORDER_SAVE": [[862, null], [1210, "mpn-order-save"]], "MPN_SCHMIDT": [[863, null], [1210, "mpn-schmidt"]], "MPN_WIGNER": [[864, null], [1210, "mpn-wigner"]], "MP_TYPE": [[1147, null], [1221, "mp-type"]], "MRCC": [[1224, null], [1683, null], [1723, null]], "MRCC methods": [[1792, "id3"]], "MRCC_LEVEL": [[1224, "mrcc-level"], [1235, null]], "MRCC_METHOD": [[1224, "mrcc-method"], [1236, null]], "MRCC_NUM_DOUBLET_ROOTS": [[1224, "mrcc-num-doublet-roots"], [1237, null]], "MRCC_NUM_SINGLET_ROOTS": [[1224, "mrcc-num-singlet-roots"], [1238, null]], "MRCC_NUM_TRIPLET_ROOTS": [[1224, "mrcc-num-triplet-roots"], [1239, null]], "MRCC_OMP_NUM_THREADS": [[1224, "mrcc-omp-num-threads"], [1240, null]], "MRCC_RESTART": [[1224, "mrcc-restart"], [1241, null]], "MS0": [[865, null], [1210, "ms0"]], "Managed Methods": [[1809, "managed-methods"]], "ManagedMethodError": [[268, null]], "Managing Code": [[1736, "managing-code"]], "Managing: Git, Conda, CMake and all that": [[1787, null]], "Many-body perturbation theory": [[1771, "many-body-perturbation-theory"]], "Mark virtual functions in derived classes with override": [[1821, "mark-virtual-functions-in-derived-classes-with-override"]], "Math in the Codebase": [[1764, "math-in-the-codebase"]], "Matrix": [[100, null]], "Matrix to Array": [[1797, "matrix-to-array"]], "MatrixFactory": [[101, null]], "MemDFJK": [[102, null]], "Memory Specification": [[1832, "memory-specification"]], "Meta": [[1758, "meta"]], "Meta functionals available in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1702, null], [1758, "id3"]], "Methods": [[1746, "methods"], [1753, "methods"], [1798, "methods"]], "Methods Summary": [[1753, "methods-summary"]], "Minimal Basis Iterative Stockholder": [[1799, "minimal-basis-iterative-stockholder"]], "Minimal Input": [[1753, "minimal-input"], [1757, "minimal-input"], [1838, "minimal-input"]], "MintsHelper": [[103, null]], "Misc.": [[1226, "misc"], [1788, "misc"]], "Misc. Running": [[1743, "misc-running"]], "Miscellaneous": [[400, "miscellaneous"], [1736, "miscellaneous"], [1814, "miscellaneous"]], "MissingMethodError": [[269, null]], "Mixing Basis Sets": [[1730, "mixing-basis-sets"]], "Modular Approach to Development": [[1808, "modular-approach-to-development"]], "Modules in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1814, "modules-in-psifour"]], "Molden Interface Keywords": [[1772, "molden-interface-keywords"]], "MoldenWriter": [[104, null]], "MolecularGrid": [[105, null]], "Molecule": [[106, null]], "Molecule Keywords": [[1833, "molecule-keywords"]], "Molecule Specification": [[1782, "molecule-specification"]], "Molecule and Geometry Specification": [[1832, "molecule-and-geometry-specification"], [1833, null]], "Monomer-Centered Basis Computations": [[1837, "monomer-centered-basis-computations"]], "Mukherjee State-Specific Multi-Reference Coupled Cluster (Mk-MRCC)": [[1781, "mukherjee-state-specific-multi-reference-coupled-cluster-mk-mrcc"]], "Multi-Fragment Optimizations": [[1802, "multi-fragment-optimizations"]], "Multiple Molecules": [[1833, "multiple-molecules"]], "MultipoleInt": [[107, null]], "MultipoleSymmetry": [[108, null]], "Multireference Dimensions": [[1810, "multireference-dimensions"]], "NAT_ORBS": [[866, null], [940, null], [1083, null], [1210, "nat-orbs"], [1213, "nat-orbs"], [1219, "nat-orbs"], [1225, "nat-orbs"], [1276, null], [1771, "nat-orbs"], [1798, "nat-orbs"]], "NAT_ORBS_T2": [[1230, "nat-orbs-t2"], [1459, null], [1837, "nat-orbs-t2"]], "NAT_ORBS_T3": [[1230, "nat-orbs-t3"], [1460, null], [1837, "nat-orbs-t3"]], "NAT_ORBS_V4": [[1230, "nat-orbs-v4"], [1461, null], [1837, "nat-orbs-v4"]], "NBC10": [[1692, "nbc10"], [1752, "nbc10"]], "NCB31": [[1692, "ncb31"], [1752, "ncb31"]], "NEW_TRIPLES": [[451, null], [486, null], [1199, "new-triples"], [1200, "new-triples"]], "NHTBH": [[1692, "nhtbh"], [1752, "nhtbh"]], "NL_DISPERSION_PARAMETERS": [[1231, "nl-dispersion-parameters"], [1582, null]], "NORMAL_MODES_WRITE": [[1027, null], [1217, "normal-modes-write"], [1772, "normal-modes-write"]], "NO_DFILE": [[867, null], [1210, "no-dfile"]], "NO_SINGLES": [[1229, "no-singles"], [1419, null]], "NUM_AMPS_PRINT": [[452, null], [487, null], [525, null], [549, null], [868, null], [1199, "num-amps-print"], [1200, "num-amps-print"], [1202, "num-amps-print"], [1203, "num-amps-print"], [1210, "num-amps-print"], [1742, "num-amps-print"]], "NUM_CORE_ORBITALS": [[1, "num-core-orbitals"], [406, null], [1197, "num-core-orbitals"]], "NUM_DETS_PRINT": [[869, null], [1210, "num-dets-print"]], "NUM_FROZEN_DOCC": [[1148, null], [1221, "num-frozen-docc"]], "NUM_FROZEN_UOCC": [[1149, null], [1221, "num-frozen-uocc"]], "NUM_GUESSES": [[0, "num-guesses"], [1, "num-guesses"], [407, null], [1197, "num-guesses"]], "NUM_INIT_VECS": [[870, null], [1210, "num-init-vecs"]], "NUM_ROOTS": [[871, null], [1210, "num-roots"], [1755, "num-roots"]], "NablaInt": [[109, null]], "Necessary and recommended option values": [[1735, "necessary-and-recommended-option-values"]], "New Operators Available": [[1817, "new-operators-available"]], "New integral operators": [[1823, "new-integral-operators"]], "Non-Covalently Bonded Molecule Fragments": [[1833, "non-covalently-bonded-molecule-fragments"]], "Non-OO theoretical methods accessible through OCC/DFOCC": [[1798, "id72"]], "Non-QC Dependencies": [[1736, "non-qc-dependencies"]], "Notes on Options": [[1795, null], [1796, null]], "Notes on PSI Variables": [[1795, "notes-on-psi-variables"]], "NumIntHelper": [[110, null]], "NumPy Views": [[1797, "numpy-views"]], "Numerical integration and discretisation parameters": [[1754, "numerical-integration-and-discretisation-parameters"]], "O24by5": [[1692, "o24by5"], [1752, "o24by5"]], "O24by5mb": [[1692, "o24by5mb"], [1752, "o24by5mb"]], "OCC": [[1225, null], [1684, null]], "OCC: Orbital-Optimized Coupled-Cluster and M\u00f8ller\u2013Plesset Perturbation Theories": [[1798, null]], "OCC_ORBS_PRINT": [[941, null], [1213, "occ-orbs-print"], [1225, "occ-orbs-print"], [1277, null], [1798, "occ-orbs-print"]], "OCC_PERCENTAGE": [[1084, null], [1219, "occ-percentage"]], "OCC_TOLERANCE": [[1085, null], [1219, "occ-tolerance"], [1230, "occ-tolerance"], [1462, null], [1771, "occ-tolerance"], [1837, "occ-tolerance"]], "ODC_GUESS": [[742, null], [1208, "odc-guess"]], "OEPROP": [[942, null], [1213, "oeprop"], [1225, "oeprop"], [1278, null], [1685, null]], "OEProp": [[111, null]], "OFFDIAGONAL_CCSD_T": [[1229, "offdiagonal-ccsd-t"], [1420, null]], "OMEGA": [[550, null], [1203, "omega"], [1742, "omega"]], "OMEGA_ERF": [[1196, null], [1223, "omega-erf"]], "ONEPDM": [[909, null], [1212, "onepdm"]], "ONEPOT_GRID_READ": [[1231, "onepot-grid-read"], [1583, null]], "OO_SCALE": [[943, null], [1213, "oo-scale"]], "OPDM": [[743, null], [872, null], [1208, "opdm"], [1210, "opdm"], [1755, "opdm"]], "OPDM_ONLY": [[416, null], [1198, "opdm-only"]], "OPDM_RELAX": [[417, null], [910, null], [1198, "opdm-relax"], [1212, "opdm-relax"]], "OPTKING": [[1226, null]], "OPT_COORDINATES": [[1226, "opt-coordinates"], [1352, null]], "OPT_METHOD": [[944, null], [1213, "opt-method"], [1225, "opt-method"], [1279, null], [1798, "opt-method"], [1798, "id40"]], "OPT_RESTART": [[1226, "opt-restart"], [1353, null]], "OPT_TYPE": [[1226, "opt-type"], [1354, null], [1802, "opt-type"]], "ORBITALS_WRITE": [[1231, "orbitals-write"], [1584, null]], "ORBITAL_LEVEL_SHIFT": [[744, null], [1208, "orbital-level-shift"]], "ORB_OPT": [[945, null], [1213, "orb-opt"], [1225, "orb-opt"], [1280, null], [1798, "orb-opt"], [1798, "id39"]], "ORB_RESP_SOLVER": [[946, null], [1213, "orb-resp-solver"], [1225, "orb-resp-solver"], [1281, null]], "ORTH_TYPE": [[947, null], [1213, "orth-type"], [1225, "orth-type"], [1282, null], [1798, "orth-type"], [1798, "id41"]], "OS_SCALE": [[1225, "os-scale"], [1283, null]], "OVERLAP_CHECK": [[488, null], [1200, "overlap-check"]], "Objects": [[2, "objects"]], "Obtaining <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1737, null]], "Obtaining and Updating <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1736, "obtaining-and-updating-psifour"]], "On January first": [[1788, "on-january-first"]], "One Electron Integral Algorithm Overview": [[1817, "one-electron-integral-algorithm-overview"]], "One Electron Integrals in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1817, "one-electron-integrals-in-psifour"]], "OneBodyAOInt": [[112, null]], "OneBodySOInt": [[113, null]], "Optimization Algorithm": [[1226, "optimization-algorithm"]], "OptimizationConvergenceError": [[270, null]], "Optimizing Minima": [[1802, "optimizing-minima"]], "OptionState": [[326, null]], "Options": [[114, null], [1775, "options"], [1791, "options"]], "OptionsState": [[327, null]], "OptionsStateCM": [[328, null]], "Orbital Visualization with VMD": [[1750, "orbital-visualization-with-vmd"]], "Orbital ordering and selection of the model space": [[1829, "orbital-ordering-and-selection-of-the-model-space"]], "Orbital spaces for CI computations": [[1755, "id8"]], "Orbital spaces for MCSCF computations": [[1789, "id5"]], "Orbital-Optimized Post-Hartree\u2013Fock Methods": [[1781, "orbital-optimized-post-hartree-fock-methods"]], "Orbital-optimized theoretical methods accessible through OCC/DFOCC": [[1798, "id69"]], "OrbitalSpace": [[115, null]], "Order-1 Visualization with PyMol": [[1770, "order-1-visualization-with-pymol"]], "Ordering of irreducible representations (irreps) used in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1833, "id2"]], "Orthogonalization": [[1838, "orthogonalization"]], "Other F/I-SAPT Keywords": [[1770, "other-f-i-sapt-keywords"]], "Output": [[1740, "output"], [1743, "output"], [1752, "output"], [1802, "output"], [1843, "output"]], "Overall <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span> Package": [[1781, "overall-psifour-package"]], "OverlapInt": [[116, null]], "Overview": [[1781, "overview"]], "Overview of Required Steps": [[1815, "overview-of-required-steps"]], "P": [[1232, "p"], [1665, null], [1843, "p"]], "PAIR_ENERGIES_PRINT": [[453, null], [1199, "pair-energies-print"]], "PARALLEL": [[1231, "parallel"], [1585, null]], "PARENT_SYMMETRY": [[1150, null], [1221, "parent-symmetry"]], "PBS job file": [[1767, "pbs-job-file"]], "PCG_BETA_TYPE": [[948, null], [1213, "pcg-beta-type"], [1225, "pcg-beta-type"], [1284, null]], "PCG_CONVERGENCE": [[949, null], [1213, "pcg-convergence"], [1225, "pcg-convergence"], [1285, null]], "PCG_MAXITER": [[950, null], [1213, "pcg-maxiter"], [1225, "pcg-maxiter"], [1286, null]], "PCM": [[1151, null], [1221, "pcm"], [1227, null], [1686, null], [1803, "pcm"]], "PCMSOLVER": [[1724, null]], "PCMSOLVER_PARSED_FNAME": [[1227, "pcmsolver-parsed-fname"], [1377, null]], "PCM_CC_TYPE": [[1227, "pcm-cc-type"], [1375, null], [1803, "pcm-cc-type"]], "PCM_SCF_TYPE": [[1227, "pcm-scf-type"], [1376, null], [1803, "pcm-scf-type"]], "PE": [[1152, null], [1221, "pe"], [1228, null], [1687, null], [1749, "pe"]], "PEP1: Proposing PsiPEP for <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1804, null]], "PERTURB_CBS": [[1229, "perturb-cbs"], [1421, null]], "PERTURB_CBS_COUPLING": [[1229, "perturb-cbs-coupling"], [1422, null]], "PERTURB_DIPOLE": [[1231, "perturb-dipole"], [1586, null]], "PERTURB_H": [[1231, "perturb-h"], [1587, null]], "PERTURB_MAGNITUDE": [[873, null], [1210, "perturb-magnitude"], [1231, "perturb-magnitude"], [1588, null]], "PERTURB_WITH": [[1231, "perturb-with"], [1589, null]], "PE_ECP": [[1228, "pe-ecp"], [1392, null]], "PHI_POINTS": [[1231, "phi-points"], [1590, null]], "PK_ALL_NONSYM": [[1231, "pk-all-nonsym"], [1591, null]], "PK_MAX_BUCKETS": [[1231, "pk-max-buckets"], [1592, null]], "PMLocalizer": [[117, null]], "PNO_CONVERGENCE": [[975, null], [1214, "pno-convergence"]], "POINTS": [[1028, null], [1217, "points"]], "POTFILE": [[1228, "potfile"], [1393, null], [1749, "potfile"]], "PPL_TYPE": [[951, null], [1213, "ppl-type"]], "PRECONDITIONER": [[874, null], [1210, "preconditioner"]], "PRINT": [[720, null], [1021, null], [1153, null], [1207, "print"], [1216, "print"], [1221, "print"], [1230, "print"], [1463, null], [1837, "print"], [1837, "id25"]], "PRINT_BASIS": [[1231, "print-basis"], [1593, null]], "PRINT_MOS": [[1231, "print-mos"], [1594, null]], "PRINT_NOONS": [[1154, null], [1221, "print-noons"]], "PRINT_OPT_PARAMS": [[1226, "print-opt-params"], [1355, null]], "PRINT_TRAJECTORY_XYZ_FILE": [[1226, "print-trajectory-xyz-file"], [1356, null]], "PROCESS_GRID": [[1231, "process-grid"], [1595, null]], "PROPERTIES": [[1155, null], [1221, "properties"]], "PROPERTIES_ORIGIN": [[1156, null], [1221, "properties-origin"]], "PROPERTY": [[454, null], [551, null], [1199, "property"], [1203, "property"], [1742, "property"]], "PROP_ALL": [[418, null], [526, null], [1198, "prop-all"], [1202, "prop-all"]], "PROP_ROOT": [[419, null], [489, null], [527, null], [1198, "prop-root"], [1200, "prop-root"], [1202, "prop-root"]], "PROP_SYM": [[420, null], [490, null], [528, null], [1198, "prop-sym"], [1200, "prop-sym"], [1202, "prop-sym"]], "PSI Variables": [[1832, "psi-variables"]], "PSI Variables by Alpha": [[1776, null]], "PSI Variables by Module": [[1709, null]], "PSI4NUMPY": [[1725, null]], "PSIMRCC": [[1229, null], [1688, null]], "PSIMRCC Implementation of Mk-MRCC Theory": [[1829, null]], "PSIOH Intermediate Files": [[1708, null]], "PT_ENERGY": [[1229, "pt-energy"], [1423, null]], "PUREAM": [[1157, null], [1221, "puream"]], "PYTHON": [[1726, null]], "ParsingError": [[271, null]], "PastureRequiredError": [[272, null]], "Path of a PsiPEP": [[1804, "path-of-a-psipep"]], "Permitted nesting of Psithon functions": [[1779, "id1"]], "Permutational symmetry": [[1817, "permutational-symmetry"]], "PetiteList": [[118, null]], "Physical Constants": [[1706, null], [1832, "physical-constants"]], "Physical constants in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1706, "id1"]], "Plain Old Data": [[2, "plain-old-data"]], "Planning: how to configure Psi4 and invoke CMake": [[1738, "planning-how-to-configure-psi4-and-invoke-cmake"]], "Plotting one-photon absorption and electronic circular dichroism spectra": [[1841, "plotting-one-photon-absorption-and-electronic-circular-dichroism-spectra"]], "Plugin v2rdm_casscf by A. E. DePrince": [[1807, null]], "PointFunctions": [[119, null]], "PointGroup": [[120, null]], "Post-Release (e.g., v1.8.2)": [[1788, "post-release-e-g-v1-8-2"]], "Post-SCF convergence criteria defaults by calculation type 4": [[1838, "id43"]], "Potential Surface Scans and Counterpoise Correction Made Easy with Psithon": [[1844, "potential-surface-scans-and-counterpoise-correction-made-easy-with-psithon"]], "PotentialInt": [[121, null]], "Pre-Release (e.g., v1.3rc1)": [[1788, "pre-release-e-g-v1-3rc1"]], "Prefer GiB for memory printing": [[1821, "prefer-gib-for-memory-printing"]], "Prefer auto to explicit type declarations": [[1821, "prefer-auto-to-explicit-type-declarations"]], "Prefer nullptr to 0 or NULL": [[1821, "prefer-nullptr-to-0-or-null"]], "Prefer std::make_shared to direct use of new": [[1821, "prefer-std-make-shared-to-direct-use-of-new"]], "PrimitiveType": [[122, null]], "Profiling": [[1813, "profiling"]], "Programmers FAQ": [[1814, null]], "Programmers\u2019 Manual": [[1777, "programmers-manual"]], "Programming with the Core Libraries": [[1812, null]], "Prop": [[123, null]], "Properties evaluated on a grid": [[1799, "properties-evaluated-on-a-grid"]], "Property": [[1826, null]], "ProtoIntVector": [[124, null]], "ProtoVector": [[125, null]], "Psi4 Control of CFOUR": [[1206, "psi4-control-of-cfour"]], "Psi4FockCI: A General Fock-Space CI For Spin-Flip And IP/EA": [[1805, null]], "PsiAPI Tutorial: Using Psi4 as a Python Module": [[1828, null]], "PsiAPI usage": [[1841, "psiapi-usage"]], "PsiException": [[273, null]], "PsiPEP: Plans and Practices to Organize <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1830, null]], "PsiReturnType": [[126, null]], "Psithon Functions: Invoking a Calculation": [[1831, null]], "Psithon Tutorial: Using <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span> as an Executable": [[1844, null]], "Psithon keywords": [[1841, "psithon-keywords"]], "Psithon: Structuring an Input File": [[1832, null]], "PubChem Database": [[1833, "pubchem-database"]], "Publish GitHub postrelease": [[1788, "publish-github-postrelease"]], "Publish GitHub release": [[1788, "publish-github-release"]], "Publish psicode.org release": [[1788, "publish-psicode-org-release"]], "Python Style": [[1822, null]], "Python Wrappers": [[1832, "python-wrappers"]], "QC Dependencies and Extensions": [[1736, "qc-dependencies-and-extensions"]], "QCHF": [[952, null], [1213, "qchf"], [1231, "qchf"], [1596, null]], "QCISD(T), CCSD(T), MP4, and CEPA": [[1771, "qcisd-t-ccsd-t-mp4-and-cepa"]], "QCVariables (aka PSI Variables)": [[400, "qcvariables-aka-psi-variables"]], "QC_COUPLING": [[745, null], [1208, "qc-coupling"]], "QC_MODULE": [[1158, null], [1221, "qc-module"]], "QC_TYPE": [[746, null], [1208, "qc-type"]], "QMEFP": [[1022, null], [1216, "qmefp"]], "QMMM": [[274, null]], "QMMMbohr": [[275, null]], "Quadratic configuration interaction and coupled cluster": [[1771, "quadratic-configuration-interaction-and-coupled-cluster"]], "QuadrupoleInt": [[127, null]], "Quick Installation": [[1748, "quick-installation"]], "R4S": [[875, null], [1210, "r4s"]], "RADIUS": [[1231, "radius"], [1598, null]], "RANGED_BEND": [[1226, "ranged-bend"], [1357, null]], "RANGED_DIHEDRAL": [[1226, "ranged-dihedral"], [1358, null]], "RANGED_DISTANCE": [[1226, "ranged-distance"], [1359, null]], "RANGED_OOFP": [[1226, "ranged-oofp"], [1360, null]], "RAS1": [[1159, null], [1221, "ras1"]], "RAS2": [[1160, null], [1221, "ras2"]], "RAS3": [[1161, null], [1221, "ras3"]], "RAS34_MAX": [[877, null], [1210, "ras34-max"]], "RAS3_MAX": [[878, null], [1210, "ras3-max"]], "RAS4": [[1162, null], [1221, "ras4"]], "RAS4_MAX": [[879, null], [1210, "ras4-max"]], "READ_SCF_3INDEX": [[954, null], [1213, "read-scf-3index"]], "REFERENCE": [[0, "reference"], [1, "reference"], [409, null], [421, null], [456, null], [492, null], [553, null], [560, null], [565, null], [748, null], [880, null], [1187, null], [1197, "reference"], [1198, "reference"], [1199, "reference"], [1200, "reference"], [1203, "reference"], [1204, "reference"], [1205, "reference"], [1208, "reference"], [1210, "reference"], [1222, "reference"], [1231, "reference"], [1599, null], [1742, "reference"], [1755, "reference"]], "REFERENCE_SYM": [[881, null], [1210, "reference-sym"]], "REGULARIZATION": [[956, null], [1213, "regularization"]], "REG_PARAM": [[955, null], [1213, "reg-param"]], "RELATIVISTIC": [[1163, null], [1221, "relativistic"], [1762, "relativistic"], [1836, "relativistic"]], "RELAXED": [[1225, "relaxed"], [1288, null]], "RELAX_GUESS_ORBITALS": [[749, null], [1208, "relax-guess-orbitals"]], "REMP_A": [[957, null], [1213, "remp-a"], [1225, "remp-a"], [1289, null]], "REPL_OTF": [[882, null], [1210, "repl-otf"]], "RESPONSE_ALGORITHM": [[750, null], [1208, "response-algorithm"]], "RESTART": [[457, null], [530, null], [554, null], [883, null], [1199, "restart"], [1202, "restart"], [1203, "restart"], [1210, "restart"], [1742, "restart"]], "RESTART_EOM_CC3": [[493, null], [1200, "restart-eom-cc3"]], "RESTRICTED_DOCC": [[1164, null], [1221, "restricted-docc"], [1755, "restricted-docc"]], "RESTRICTED_UOCC": [[1165, null], [1221, "restricted-uocc"], [1755, "restricted-uocc"]], "RFO_FOLLOW_ROOT": [[1226, "rfo-follow-root"], [1361, null]], "RFO_NORMALIZATION_MAX": [[1226, "rfo-normalization-max"], [1362, null]], "RFO_ROOT": [[1226, "rfo-root"], [1363, null]], "RGC10": [[1692, "rgc10"], [1752, "rgc10"]], "RHF": [[128, null]], "RHF_TRIPLETS": [[494, null], [1200, "rhf-triplets"]], "RKSFunctions": [[129, null]], "RMS_DISP_G_CONVERGENCE": [[1226, "rms-disp-g-convergence"], [1364, null]], "RMS_FORCE_G_CONVERGENCE": [[1226, "rms-force-g-convergence"], [1365, null]], "RMS_MOGRAD_CONVERGENCE": [[958, null], [1213, "rms-mograd-convergence"], [1225, "rms-mograd-convergence"], [1290, null], [1798, "rms-mograd-convergence"], [1798, "id36"]], "ROHF": [[130, null]], "ROOTS_PER_IRREP": [[1, "roots-per-irrep"], [410, null], [422, null], [495, null], [531, null], [1197, "roots-per-irrep"], [1198, "roots-per-irrep"], [1200, "roots-per-irrep"], [1202, "roots-per-irrep"], [1742, "roots-per-irrep"]], "ROTATE_MO_ANGLE": [[1188, null], [1222, "rotate-mo-angle"]], "ROTATE_MO_IRREP": [[1189, null], [1222, "rotate-mo-irrep"]], "ROTATE_MO_P": [[1190, null], [1222, "rotate-mo-p"]], "ROTATE_MO_Q": [[1191, null], [1222, "rotate-mo-q"]], "ROTATIONAL_SYMMETRY_NUMBER": [[1232, "rotational-symmetry-number"], [1666, null], [1843, "rotational-symmetry-number"]], "RSE42": [[1692, "rse42"], [1752, "rse42"]], "RSRFO_ALPHA_MAX": [[1226, "rsrfo-alpha-max"], [1366, null]], "RUN_CCSD": [[1087, null], [1219, "run-ccsd"], [1771, "run-ccsd"]], "RUN_CCTRANSORT": [[561, null], [1204, "run-cctransort"]], "RUN_CEPA": [[1088, null], [1219, "run-cepa"], [1771, "run-cepa"]], "RUN_MP2": [[1089, null], [1219, "run-mp2"], [1771, "run-mp2"]], "RUN_MP3": [[1090, null], [1219, "run-mp3"], [1771, "run-mp3"]], "RUN_MP4": [[1091, null], [1219, "run-mp4"], [1771, "run-mp4"]], "R_CONVERGENCE": [[0, "r-convergence"], [1, "r-convergence"], [408, null], [455, null], [491, null], [529, null], [552, null], [747, null], [876, null], [953, null], [976, null], [1086, null], [1197, "r-convergence"], [1199, "r-convergence"], [1200, "r-convergence"], [1202, "r-convergence"], [1203, "r-convergence"], [1208, "r-convergence"], [1210, "r-convergence"], [1213, "r-convergence"], [1214, "r-convergence"], [1219, "r-convergence"], [1225, "r-convergence"], [1229, "r-convergence"], [1287, null], [1424, null], [1742, "r-convergence"], [1755, "r-convergence"], [1771, "r-convergence"], [1798, "r-convergence"], [1798, "id35"]], "R_POINTS": [[1231, "r-points"], [1597, null]], "Rapid initial development using Psi4NumPy": [[1824, "rapid-initial-development-using-psi4numpy"]], "Reading Options in Module": [[1801, "reading-options-in-module"]], "Recommendations": [[1753, "recommendations"], [1756, "recommendations"], [1757, "recommendations"], [1763, "recommendations"], [1838, "recommendations"]], "Reference": [[1762, "reference"]], "Release (e.g., v1.3)": [[1788, "release-e-g-v1-3"]], "Release Procedures": [[1788, null]], "Releasing <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1814, "releasing-psifour"]], "Reporting Bugs": [[1816, "reporting-bugs"]], "Restarting the SCF": [[1838, "restarting-the-scf"]], "Results accessible through psi4.core.Wavefunction.frequency_analysis": [[1772, "id1"]], "Return Values": [[1832, "return-values"]], "Roles of a PsiPEP Include": [[1804, "roles-of-a-psipep-include"]], "Root Following": [[1210, "root-following"]], "Run long tests": [[1788, "run-long-tests"]], "Running <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1736, "running-psifour"]], "Running ADC calculations": [[0, "running-adc-calculations"]], "Running DFTD3 or DFTD4": [[1759, "running-dftd3-or-dftd4"]], "Running EFP": [[1782, "running-efp"]], "Running MRCC": [[1792, "running-mrcc"]], "Running a Basic Hartree\u2013Fock Calculation": [[1844, "running-a-basic-hartree-fock-calculation"]], "Running for Debugging": [[2, "running-for-debugging"], [2, "id1"]], "Running gCP": [[1774, "running-gcp"]], "Running the Script": [[1750, "running-the-script"]], "Runtime Errors and Debugging": [[1736, "runtime-errors-and-debugging"]], "Runtime Setup": [[1736, "runtime-setup"]], "S": [[884, null], [1210, "s"]], "S22": [[1692, "s22"], [1752, "s22"]], "S22by5": [[1692, "s22by5"], [1752, "s22by5"]], "S66": [[1692, "s66"], [1752, "s66"]], "S66by8": [[1692, "s66by8"], [1752, "s66by8"]], "SAD Guess Algorithm": [[1231, "sad-guess-algorithm"]], "SADGuess": [[131, null]], "SAD_CHOL_TOLERANCE": [[1231, "sad-chol-tolerance"], [1603, null]], "SAD_D_CONVERGENCE": [[1231, "sad-d-convergence"], [1604, null]], "SAD_E_CONVERGENCE": [[1231, "sad-e-convergence"], [1605, null]], "SAD_FRAC_OCC": [[1231, "sad-frac-occ"], [1606, null]], "SAD_MAXITER": [[1231, "sad-maxiter"], [1607, null]], "SAD_PRINT": [[1231, "sad-print"], [1608, null]], "SAD_SCF_TYPE": [[1231, "sad-scf-type"], [1609, null]], "SAD_SPIN_AVERAGE": [[1231, "sad-spin-average"], [1610, null]], "SAPGAU_BASIS": [[1231, "sapgau-basis"], [1611, null]], "SAPT": [[1230, null], [1231, "sapt"], [1612, null], [1689, null]], "SAPT(DFT)": [[1230, "sapt-dft"], [1837, "sapt-dft"]], "SAPT(HF)": [[1230, "sapt-hf"]], "SAPT0": [[1837, "sapt0"]], "SAPT0-D": [[1837, "sapt0-d"]], "SAPT0_E10": [[1230, "sapt0-e10"], [1464, null]], "SAPT0_E20DISP": [[1230, "sapt0-e20disp"], [1465, null]], "SAPT0_E20IND": [[1230, "sapt0-e20ind"], [1466, null]], "SAPT: Symmetry-Adapted Perturbation Theory": [[1837, null]], "SAPT_DFT_DO_DHF": [[1230, "sapt-dft-do-dhf"], [1467, null], [1837, "sapt-dft-do-dhf"]], "SAPT_DFT_DO_HYBRID": [[1230, "sapt-dft-do-hybrid"], [1468, null], [1837, "sapt-dft-do-hybrid"]], "SAPT_DFT_EXCH_DISP_FIXED_SCALE": [[1230, "sapt-dft-exch-disp-fixed-scale"], [1469, null], [1837, "sapt-dft-exch-disp-fixed-scale"]], "SAPT_DFT_EXCH_DISP_SCALE_SCHEME": [[1230, "sapt-dft-exch-disp-scale-scheme"], [1470, null], [1837, "sapt-dft-exch-disp-scale-scheme"]], "SAPT_DFT_FUNCTIONAL": [[1230, "sapt-dft-functional"], [1471, null], [1837, "sapt-dft-functional"]], "SAPT_DFT_GRAC_DETERMINATION": [[1230, "sapt-dft-grac-determination"], [1472, null]], "SAPT_DFT_GRAC_SHIFT_A": [[1230, "sapt-dft-grac-shift-a"], [1473, null], [1837, "sapt-dft-grac-shift-a"]], "SAPT_DFT_GRAC_SHIFT_B": [[1230, "sapt-dft-grac-shift-b"], [1474, null], [1837, "sapt-dft-grac-shift-b"]], "SAPT_DFT_MP2_DISP_ALG": [[1230, "sapt-dft-mp2-disp-alg"], [1475, null], [1837, "sapt-dft-mp2-disp-alg"]], "SAPT_FDDS_DISP_LEG_LAMBDA": [[1230, "sapt-fdds-disp-leg-lambda"], [1476, null]], "SAPT_FDDS_DISP_NUM_POINTS": [[1230, "sapt-fdds-disp-num-points"], [1477, null]], "SAPT_FDDS_V2_RHO_CUTOFF": [[1230, "sapt-fdds-v2-rho-cutoff"], [1478, null]], "SAPT_LEVEL": [[1230, "sapt-level"], [1479, null], [1837, "sapt-level"]], "SAPT_MEM_CHECK": [[1230, "sapt-mem-check"], [1480, null], [1837, "sapt-mem-check"]], "SAPT_MEM_FACTOR": [[1230, "sapt-mem-factor"], [1481, null]], "SAPT_MEM_SAFETY": [[1230, "sapt-mem-safety"], [1482, null], [1837, "sapt-mem-safety"]], "SAPT_QUIET": [[1230, "sapt-quiet"], [1483, null], [1837, "sapt-quiet"]], "SAVE_JK": [[1231, "save-jk"], [1613, null]], "SAVE_OPTIMIZATION": [[1226, "save-optimization"], [1367, null]], "SAVE_UHF_NOS": [[1231, "save-uhf-nos"], [1614, null]], "SCF": [[1231, null], [1690, null]], "SCF algorithm and convergence criteria defaults by calculation type 1": [[1838, "id42"]], "SCFConvergenceError": [[276, null]], "SCF_INITIAL_ACCELERATOR": [[1231, "scf-initial-accelerator"], [1615, null]], "SCF_INITIAL_FINISH_DIIS_TRANSITION": [[1231, "scf-initial-finish-diis-transition"], [1616, null]], "SCF_INITIAL_START_DIIS_TRANSITION": [[1231, "scf-initial-start-diis-transition"], [1617, null]], "SCF_MEM_SAFETY_FACTOR": [[1231, "scf-mem-safety-factor"], [1618, null]], "SCF_PROPERTIES": [[1231, "scf-properties"], [1619, null]], "SCF_SUBTYPE": [[1231, "scf-subtype"], [1620, null]], "SCF_TYPE": [[721, null], [1166, null], [1207, "scf-type"], [1221, "scf-type"]], "SCHMIDT_ADD_RESIDUAL_TOLERANCE": [[496, null], [1200, "schmidt-add-residual-tolerance"], [1742, "schmidt-add-residual-tolerance"]], "SCREENING": [[1167, null], [1221, "screening"]], "SCS Double-Hybrid": [[1758, "scs-double-hybrid"]], "SCSN_MP2": [[460, null], [1199, "scsn-mp2"]], "SCS_CCSD": [[458, null], [1092, null], [1199, "scs-ccsd"], [1219, "scs-ccsd"], [1771, "scs-ccsd"]], "SCS_CEPA": [[1093, null], [1219, "scs-cepa"]], "SCS_MP2": [[459, null], [1094, null], [1199, "scs-mp2"], [1219, "scs-mp2"], [1771, "scs-mp2"]], "SCS_TYPE": [[959, null], [1213, "scs-type"], [1225, "scs-type"], [1291, null]], "SEKINO": [[532, null], [555, null], [1202, "sekino"], [1203, "sekino"]], "SEMICANONICAL": [[461, null], [497, null], [562, null], [566, null], [1199, "semicanonical"], [1200, "semicanonical"], [1204, "semicanonical"], [1205, "semicanonical"]], "SF_RESTRICT": [[885, null], [1210, "sf-restrict"]], "SIGMA_OVERLAP": [[886, null], [1210, "sigma-overlap"]], "SIMINT": [[1727, null]], "SINGLES_PRINT": [[498, null], [1200, "singles-print"], [1742, "singles-print"]], "SMALL_CUTOFF": [[1229, "small-cutoff"], [1425, null]], "SNLINK_BASIS_TOLERANCE": [[1231, "snlink-basis-tolerance"], [1621, null]], "SNLINK_DENSITY_TOLERANCE": [[1231, "snlink-density-tolerance"], [1622, null]], "SNLINK_FORCE_CARTESIAN": [[1231, "snlink-force-cartesian"], [1623, null]], "SNLINK_GPU_MEM": [[1231, "snlink-gpu-mem"], [1624, null]], "SNLINK_GRID_BATCH_SIZE": [[1231, "snlink-grid-batch-size"], [1625, null]], "SNLINK_INTEGRATOR_KERNEL": [[1231, "snlink-integrator-kernel"], [1626, null]], "SNLINK_INTS_TOLERANCE": [[1231, "snlink-ints-tolerance"], [1627, null]], "SNLINK_LOAD_BALANCER_KERNEL": [[1231, "snlink-load-balancer-kernel"], [1628, null]], "SNLINK_LWD_KERNEL": [[1231, "snlink-lwd-kernel"], [1629, null]], "SNLINK_MOL_WEIGHTS_KERNEL": [[1231, "snlink-mol-weights-kernel"], [1630, null]], "SNLINK_PRUNING_SCHEME": [[1231, "snlink-pruning-scheme"], [1631, null]], "SNLINK_RADIAL_POINTS": [[1231, "snlink-radial-points"], [1632, null]], "SNLINK_RADIAL_SCHEME": [[1231, "snlink-radial-scheme"], [1633, null]], "SNLINK_REDUCTION_KERNEL": [[1231, "snlink-reduction-kernel"], [1634, null]], "SNLINK_SPHERICAL_POINTS": [[1231, "snlink-spherical-points"], [1635, null]], "SNLINK_USE_DEBUG_GRID": [[1231, "snlink-use-debug-grid"], [1636, null]], "SNLINK_USE_GPU": [[1231, "snlink-use-gpu"], [1637, null]], "SNSMP2": [[1728, null]], "SOBasisSet": [[132, null]], "SOCC": [[1168, null], [1192, null], [1221, "socc"], [1222, "socc"]], "SOLVER_CONVERGENCE": [[722, null], [1207, "solver-convergence"], [1231, "solver-convergence"], [1638, null]], "SOLVER_MAXITER": [[723, null], [1207, "solver-maxiter"], [1231, "solver-maxiter"], [1639, null]], "SOLVER_N_GUESS": [[724, null], [1207, "solver-n-guess"], [1231, "solver-n-guess"], [1640, null]], "SOLVER_N_ROOT": [[1231, "solver-n-root"], [1641, null]], "SOLVER_PRECONDITION": [[725, null], [1207, "solver-precondition"]], "SOLVER_ROOTS_PER_IRREP": [[1231, "solver-roots-per-irrep"], [1642, null]], "SOMCSCF": [[133, null]], "SOSCF": [[1231, "soscf"], [1643, null]], "SOSCF_CONV": [[1231, "soscf-conv"], [1644, null]], "SOSCF_MAX_ITER": [[1231, "soscf-max-iter"], [1645, null]], "SOSCF_MIN_ITER": [[1231, "soscf-min-iter"], [1646, null]], "SOSCF_PRINT": [[1231, "soscf-print"], [1647, null]], "SOSCF_START_CONVERGENCE": [[1231, "soscf-start-convergence"], [1648, null]], "SOS_TYPE": [[960, null], [1213, "sos-type"], [1225, "sos-type"], [1292, null]], "SPIN_SCALE_TYPE": [[1225, "spin-scale-type"], [1293, null]], "SSAPT0_SCALE": [[1064, null], [1218, "ssapt0-scale"]], "SSI": [[1692, "ssi"], [1752, "ssi"]], "SS_E_CONVERGENCE": [[499, null], [1200, "ss-e-convergence"]], "SS_R_CONVERGENCE": [[500, null], [1200, "ss-r-convergence"]], "SS_SCALE": [[1225, "ss-scale"], [1294, null]], "SS_SKIP_DIAG": [[501, null], [1200, "ss-skip-diag"]], "SS_VECS_PER_ROOT": [[502, null], [1200, "ss-vecs-per-root"]], "STABILITY_ADD_VECTORS": [[751, null], [1208, "stability-add-vectors"]], "STABILITY_ANALYSIS": [[1231, "stability-analysis"], [1649, null]], "STABILITY_AUGMENT_SPACE_TOL": [[752, null], [1208, "stability-augment-space-tol"]], "STABILITY_CHECK": [[753, null], [1208, "stability-check"]], "STABILITY_CONVERGENCE": [[754, null], [1208, "stability-convergence"]], "STABILITY_MAX_SPACE_SIZE": [[755, null], [1208, "stability-max-space-size"]], "STABILITY_N_EIGENVALUES": [[756, null], [1208, "stability-n-eigenvalues"]], "STABILITY_N_GUESS_VECTORS": [[757, null], [1208, "stability-n-guess-vectors"]], "STEP_TYPE": [[1226, "step-type"], [1368, null], [1802, "step-type"]], "SUMMATION_FIELDS": [[1228, "summation-fields"], [1394, null]], "SYMMETRIZE": [[1225, "symmetrize"], [1295, null]], "S^inf Keywords": [[1837, "s-inf-keywords"]], "S_CHOLESKY_TOLERANCE": [[1231, "s-cholesky-tolerance"], [1600, null]], "S_CUT": [[977, null], [1214, "s-cut"]], "S_ORTHOGONALIZATION": [[1231, "s-orthogonalization"], [1601, null]], "S_TOLERANCE": [[1231, "s-tolerance"], [1602, null]], "SalcComponent": [[134, null]], "Sample Input": [[1805, "sample-input"], [1806, "sample-input"]], "Sample Input Files": [[1844, "sample-input-files"]], "SaveType": [[135, null]], "Saving the Wavefunction": [[1767, "saving-the-wavefunction"]], "Scalar Relativistic Corrections": [[1781, "scalar-relativistic-corrections"]], "Scalar relativistic Hamiltonians": [[1836, null]], "Scratch Files": [[1767, "scratch-files"]], "Script Options": [[1750, "script-options"]], "Script Prerequisites": [[1750, "script-prerequisites"]], "Second-order Convergence": [[1838, "second-order-convergence"]], "Seminumerical Linear Exchange": [[1838, "seminumerical-linear-exchange"]], "Setting Up Your Development Environment": [[1820, null]], "Shell Pairs": [[1817, "shell-pairs"]], "Shell blocking": [[1817, "shell-blocking"]], "ShellInfo": [[136, null]], "Sieving": [[1817, "sieving"]], "Single-Point Energy \u2014 energy()": [[1766, null]], "Slack": [[1816, "slack"]], "Slice": [[137, null]], "Solvent model and solvent cavity definition": [[1754, "solvent-model-and-solvent-cavity-definition"]], "SolverEngine": [[329, null]], "Specific open-shell SAPT0 keywords": [[1837, "specific-open-shell-sapt0-keywords"]], "Specification Details": [[1743, "specification-details"]], "Spectroscopic Constants for Diatomics": [[1761, null]], "Spin Multiplicities of Higher Roots": [[1755, "spin-multiplicities-of-higher-roots"]], "Spin-Component-Scaled Orbital-Optimized MP capabilities of OCC/DFOCC modules": [[1798, "id71"]], "Spin-Flip SAPT": [[1837, "spin-flip-sapt"]], "Spin-Network-Scaled MP2 (SNS-MP2) by D. E. Shaw": [[1806, null]], "Spin/Symmetry Treatment": [[1757, "spin-symmetry-treatment"], [1838, "spin-symmetry-treatment"]], "Stability Analysis": [[1838, "stability-analysis"]], "Stability analysis methods available in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1838, "id41"]], "Summary capabilities of <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>. \u201c\u2713\u201d runs analytically. \u201c\u2237\u201d runs derivative with internal finite difference. Double underline \u201c\u2713\u0333\u201d or \u201c\u2237\u0333\u201d is default algorithm type when type selector (e.g., CC_TYPE) unspecified.": [[1781, "id59"]], "Summary of Dunning Douglas-Kroll orbital basis sets available in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1733, "id18"]], "Summary of Dunning F12 orbital basis sets available in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1733, "id19"]], "Summary of Dunning JK-fitting basis sets available in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1733, "id20"]], "Summary of Dunning MP2-fitting basis sets available in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1733, "id21"]], "Summary of Dunning dual-basis helper basis sets available in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1733, "id22"]], "Summary of Dunning orbital basis sets available in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1733, "id17"]], "Summary of Jensen orbital basis sets available in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1733, "id24"]], "Summary of Karlsruhe orbital basis sets available in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1733, "id23"]], "Summary of Petersson orbital basis sets available in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1733, "id25"]], "Summary of Pople-style orbital basis sets available in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span> 1": [[1733, "id15"]], "Summary of other orbital basis sets available in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1733, "id26"]], "Summary of sets of geometry optimization criteria available in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1802, "id26"]], "Summary of theoretical methods available in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1781, "id58"]], "SuperFunctional": [[138, null]], "Supported Systems": [[1781, "supported-systems"]], "Supported methods": [[1771, "supported-methods"]], "Symmetry": [[1833, "symmetry"]], "Symmetry-Adapted Perturbation Theory (SAPT)": [[1781, "symmetry-adapted-perturbation-theory-sapt"]], "SymmetryOperation": [[139, null]], "T": [[1232, "t"], [1667, null], [1843, "t"]], "T2_COUPLED": [[462, null], [1199, "t2-coupled"]], "T3_WS_INCORE": [[463, null], [503, null], [1199, "t3-ws-incore"], [1200, "t3-ws-incore"]], "TDM": [[887, null], [1210, "tdm"], [1755, "tdm"]], "TDSCF": [[1231, "tdscf"]], "TDSCF: Time-dependent Hartree\u2013Fock and density-functional theory": [[1841, null]], "TDSCFConvergenceError": [[277, null]], "TDSCF_COEFF_CUTOFF": [[1231, "tdscf-coeff-cutoff"], [1650, null], [1841, "tdscf-coeff-cutoff"]], "TDSCF_GUESS": [[1231, "tdscf-guess"], [1651, null], [1841, "tdscf-guess"]], "TDSCF_MAXITER": [[1231, "tdscf-maxiter"], [1652, null], [1841, "tdscf-maxiter"]], "TDSCF_PRINT": [[1231, "tdscf-print"], [1653, null], [1841, "tdscf-print"]], "TDSCF_R_CONVERGENCE": [[1231, "tdscf-r-convergence"], [1654, null], [1841, "tdscf-r-convergence"]], "TDSCF_STATES": [[1231, "tdscf-states"], [1655, null], [1841, "tdscf-states"]], "TDSCF_TDA": [[1231, "tdscf-tda"], [1656, null], [1841, "tdscf-tda"]], "TDSCF_TDM_PRINT": [[1231, "tdscf-tdm-print"], [1657, null], [1841, "tdscf-tdm-print"]], "TDSCF_TRIPLETS": [[1231, "tdscf-triplets"], [1658, null], [1841, "tdscf-triplets"]], "TEST_B": [[1226, "test-b"], [1369, null]], "TEST_DERIVATIVE_B": [[1226, "test-derivative-b"], [1370, null]], "THERMO": [[1232, null], [1691, null]], "THETA_POINTS": [[1231, "theta-points"], [1659, null]], "THICKNESS": [[1231, "thickness"], [1660, null]], "THREE_PARTICLE": [[758, null], [1208, "three-particle"]], "TIKHONOW_MAX": [[1229, "tikhonow-max"], [1426, null]], "TIKHONOW_OMEGA": [[759, null], [1208, "tikhonow-omega"], [1229, "tikhonow-omega"], [1427, null]], "TIKHONOW_TRIPLES": [[1229, "tikhonow-triples"], [1428, null]], "TILE_SZ": [[1231, "tile-sz"], [1661, null]], "TLaplaceDenominator": [[140, null]], "TPDM": [[888, null], [1210, "tpdm"]], "TPDM_ABCD_TYPE": [[1225, "tpdm-abcd-type"], [1296, null], [1798, "tpdm-abcd-type"]], "TRANSLATE_PSI4": [[713, null], [1206, "translate-psi4"]], "TREE_EXPANSION_ORDER": [[1228, "tree-expansion-order"], [1395, null]], "TREE_THETA": [[1228, "tree-theta"], [1396, null]], "TRIPLES_ALGORITHM": [[1229, "triples-algorithm"], [1429, null]], "TRIPLES_DIIS": [[1229, "triples-diis"], [1430, null]], "TRIPLES_IABC_TYPE": [[961, null], [1213, "triples-iabc-type"]], "TRIPLES_LOW_MEMORY": [[1095, null], [1219, "triples-low-memory"], [1771, "triples-low-memory"]], "TURN_ON_ACTV": [[1193, null], [1222, "turn-on-actv"]], "T_AMPS": [[509, null], [1201, "t-amps"]], "T_CUT_CLMO": [[978, null], [1214, "t-cut-clmo"]], "T_CUT_CPAO": [[979, null], [1214, "t-cut-cpao"]], "T_CUT_DO": [[980, null], [1214, "t-cut-do"]], "T_CUT_DO_IJ": [[981, null], [1214, "t-cut-do-ij"]], "T_CUT_DO_PRE": [[982, null], [1214, "t-cut-do-pre"]], "T_CUT_MKN": [[983, null], [1214, "t-cut-mkn"]], "T_CUT_PNO": [[984, null], [1214, "t-cut-pno"]], "T_CUT_PRE": [[985, null], [1214, "t-cut-pre"]], "Tables of Results": [[1832, "tables-of-results"]], "Tag (pre)release": [[1788, "tag-pre-release"]], "Tag postrelease": [[1788, "tag-postrelease"]], "Tarball from GitHub Repository": [[1737, "tarball-from-github-repository"]], "Technical Support": [[1781, "technical-support"]], "Test Contents": [[2, "test-contents"]], "Test Suite": [[2, null]], "Test Suite and Sample Inputs": [[1842, null]], "TestComparisonError": [[278, null]], "Testing": [[1736, "testing"]], "The <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span> community": [[1825, "the-psifour-community"]], "The Map of the Sphinx": [[1764, "the-map-of-the-sphinx"]], "The S2 approximation and scaling": [[1837, "the-s2-approximation-and-scaling"]], "The new syntax": [[1817, "the-new-syntax"]], "The older style": [[1817, "the-older-style"]], "Theoretical Methods: SCF to FCI": [[1790, null]], "Theoretical methods accessible through FNOCC": [[1771, "id12"]], "Theory": [[1753, "theory"], [1756, "theory"], [1757, "theory"], [1759, "theory"], [1763, "theory"], [1798, "theory"], [1836, "theory"], [1838, "theory"], [1841, "theory"]], "Threading": [[1767, "threading"]], "Three-Body Dispersion Corrections": [[1759, "three-body-dispersion-corrections"]], "ThreeCenterOverlapInt": [[141, null]], "TracelessQuadrupoleInt": [[142, null]], "Transition States and Reaction Paths": [[1802, "transition-states-and-reaction-paths"]], "Tweak Conda for postrelease": [[1788, "tweak-conda-for-postrelease"]], "TwoBodyAOInt": [[143, null]], "TwoElectronInt": [[144, null]], "UHF": [[145, null]], "UHF_NOONS": [[1231, "uhf-noons"], [1662, null]], "UKSFunctions": [[146, null]], "UNFREEZE_DIHEDRALS": [[1226, "unfreeze-dihedrals"], [1371, null]], "UPDATE": [[889, null], [1210, "update"]], "USE_DF_INTS": [[1096, null], [1219, "use-df-ints"]], "USE_SPIN_SYM": [[1229, "use-spin-sym"], [1431, null]], "USE_SPIN_SYMMETRY": [[1229, "use-spin-symmetry"], [1432, null]], "Update copyright year": [[1788, "update-copyright-year"]], "Update counter scripts": [[1788, "update-counter-scripts"]], "Update samples": [[1788, "update-samples"]], "Updating the <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span> Users\u2019 and Programmers\u2019 Manual": [[1764, null]], "UpgradeHelper": [[279, null]], "Useful Commands": [[1748, "useful-commands"]], "User-Defined Basis Sets": [[1730, "user-defined-basis-sets"]], "Using <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1816, "using-psifour"]], "Using BrianQC from <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1735, "using-brianqc-from-psifour"]], "Using bra-ket symmetry": [[1817, "using-bra-ket-symmetry"]], "Using dd-based continum solvation models": [[1754, "using-dd-based-continum-solvation-models"]], "Using the polarizable continuum model": [[1803, "using-the-polarizable-continuum-model"]], "Using the polarizable embedding model": [[1749, "using-the-polarizable-embedding-model"]], "V. Potential Surface Scans and Counterpoise Correction Made Easy": [[1828, "V.-Potential-Surface-Scans-and-Counterpoise-Correction-Made-Easy"]], "V2RDM_CASSCF": [[1729, null]], "VAL_EX_LEVEL": [[890, null], [1210, "val-ex-level"]], "VBase": [[147, null]], "VECS_CC3": [[504, null], [1200, "vecs-cc3"]], "VECS_PER_ROOT": [[505, null], [1200, "vecs-per-root"]], "ValidationError": [[280, null]], "Variants of dispersion corrections": [[1759, "id36"]], "Vector": [[148, null]], "Vector3": [[149, null]], "Versioning <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>": [[1814, "versioning-psifour"]], "Vibrational and Thermochemical Analysis": [[1843, null]], "Visualization of Normal Modes": [[1772, "visualization-of-normal-modes"]], "WABEI_LOWDISK": [[510, null], [1201, "wabei-lowdisk"]], "WCOMBINE": [[1231, "wcombine"], [1663, null]], "WFN": [[423, null], [464, null], [506, null], [511, null], [533, null], [556, null], [563, null], [567, null], [891, null], [1169, null], [1198, "wfn"], [1199, "wfn"], [1200, "wfn"], [1201, "wfn"], [1202, "wfn"], [1203, "wfn"], [1204, "wfn"], [1205, "wfn"], [1210, "wfn"], [1221, "wfn"], [1231, "wfn"], [1664, null]], "WFN_SYM": [[1194, null], [1222, "wfn-sym"], [1229, "wfn-sym"], [1433, null]], "WFN_TYPE": [[962, null], [1213, "wfn-type"], [1225, "wfn-type"], [1297, null], [1798, "wfn-type"]], "WRITER_FILE_LABEL": [[1170, null], [1221, "writer-file-label"], [1772, "writer-file-label"], [1791, "writer-file-label"]], "WRITE_NOS": [[424, null], [1198, "write-nos"]], "WRITE_OPT_HISTORY": [[1226, "write-opt-history"], [1372, null]], "WRITE_OPT_RESULT": [[1226, "write-opt-result"], [1373, null]], "WRITE_TRAJECTORY": [[1226, "write-trajectory"], [1374, null]], "Wavefunction": [[150, null]], "Ways to Add Code: Psi4NumPy, Plugins, Full Integration": [[1824, null]], "Welcome to New Programmers": [[1825, null]], "What C and C++ compilers and versions are approved": [[1738, "what-c-and-c-compilers-and-versions-are-approved"]], "What Fortran compilers are approved": [[1738, "what-fortran-compilers-are-approved"]], "What Psi4 version is running": [[1786, "what-psi4-version-is-running"]], "What Python is Psi4 running": [[1738, "what-python-is-psi4-running"]], "What are the add-on capabilities for Psi4 and what are their dependencies": [[1738, "what-are-the-add-on-capabilities-for-psi4-and-what-are-their-dependencies"]], "What are the tools and dependencies strictly required for building Psi4": [[1738, "what-are-the-tools-and-dependencies-strictly-required-for-building-psi4"]], "What do the conda packages psi4 & psi4-dev and the installer psi4conda contain": [[1748, "what-do-the-conda-packages-psi4-psi4-dev-and-the-installer-psi4conda-contain"]], "What is has_changed ?": [[1801, "what-is-has-changed"]], "What is the directory layout of the installed or staged Psi4": [[1738, "what-is-the-directory-layout-of-the-installed-or-staged-psi4"]], "What is the suggested GitHub workflow": [[1737, "what-is-the-suggested-github-workflow"]], "When to enable BrianQC": [[1735, "when-to-enable-brianqc"]], "Where to Get Help": [[1816, null]], "Why not to set PSIDATADIR": [[1738, "why-not-to-set-psidatadir"]], "Workflow": [[1814, "workflow"]], "XI": [[425, null], [1198, "xi"]], "XI_CONNECT": [[426, null], [1198, "xi-connect"]], "ZERO_INTERNAL_AMPS": [[1229, "zero-internal-amps"], [1434, null]], "ZETA": [[427, null], [534, null], [1198, "zeta"], [1202, "zeta"]], "activate": [[281, null]], "all_casings": [[330, null]], "array_to_matrix": [[331, null]], "array_variable": [[151, null]], "array_variables": [[152, null]], "banner": [[282, null], [332, null]], "basis_helper": [[283, null], [333, null]], "be_quiet": [[153, null]], "benchmark_blas1": [[154, null]], "benchmark_blas2": [[155, null]], "benchmark_blas3": [[156, null]], "benchmark_disk": [[157, null]], "benchmark_integrals": [[158, null]], "benchmark_math": [[159, null]], "block_diagonal_array": [[334, null]], "cbs": [[284, null]], "ccdensity": [[160, null]], "ccenergy": [[161, null]], "cceom": [[162, null]], "cchbar": [[163, null]], "cclambda": [[164, null]], "ccresponse": [[165, null]], "cctransort": [[166, null]], "cctriples": [[167, null]], "cg_solver": [[335, null]], "clean": [[168, null]], "clean_options": [[169, null]], "clean_timers": [[170, null]], "clean_variables": [[171, null]], "close_outfile": [[172, null]], "compare_fchkfiles": [[285, null], [336, null]], "compare_fcidumps": [[286, null], [337, null]], "compare_moldenfiles": [[287, null], [338, null]], "compare_vibinfos": [[383, null]], "copy_file_from_scratch": [[288, null], [339, null]], "copy_file_to_scratch": [[289, null], [340, null]], "create_plugin": [[290, null]], "cubeprop": [[291, null], [341, null]], "davidson_solver": [[342, null]], "dct": [[173, null]], "del_array_variable": [[174, null]], "del_scalar_variable": [[175, null]], "del_variable": [[176, null]], "detci": [[177, null]], "dfmp2": [[178, null]], "dfocc": [[179, null]], "dlpno": [[180, null]], "dmrg": [[181, null]], "docs_table_link": [[292, null], [343, null]], "doublet": [[182, null]], "dpdbuf4": [[183, null]], "dpdfile2": [[184, null]], "drop_duplicates": [[344, null]], "dummy_einsums": [[185, null]], "dummy_integratorxx": [[186, null]], "dynamic_variable_bind": [[293, null]], "else": [[1785, "else"]], "energies_from_fcidump": [[294, null], [345, null]], "energy": [[295, null]], "expand_psivars": [[346, null]], "fchk": [[296, null]], "fcidump": [[297, null], [347, null]], "fcidump_from_file": [[298, null], [348, null]], "fcidump_tei_helper": [[187, null]], "filter_nonvib": [[384, null]], "filter_omega_to_real": [[385, null]], "finalize": [[188, null]], "find_approximate_string_matches": [[299, null], [349, null]], "flush_outfile": [[189, null]], "fnocc": [[190, null]], "format_molecule_for_input": [[350, null]], "format_options_for_input": [[351, null]], "free_atom_volumes": [[352, null]], "freq": [[300, null]], "frequencies": [[301, null]], "frequency": [[302, null]], "gdma": [[303, null]], "geometry": [[304, null]], "get_active_molecule": [[191, null]], "get_array_variable": [[192, null]], "get_array_variables": [[193, null]], "get_datadir": [[194, null]], "get_global_option": [[195, null]], "get_global_option_list": [[196, null]], "get_local_option": [[197, null]], "get_memory": [[198, null], [305, null], [353, null]], "get_num_threads": [[199, null]], "get_option": [[200, null]], "get_options": [[201, null]], "get_output_file": [[202, null]], "get_psifile": [[354, null]], "get_variable": [[203, null]], "get_variables": [[204, null]], "get_writer_file_prefix": [[205, null]], "getattr_ignorecase": [[355, null]], "git_version": [[206, null]], "gradient": [[306, null]], "hamiltonian_solver": [[356, null]], "harmonic_analysis": [[386, null]], "has_array_variable": [[207, null]], "has_global_option_changed": [[208, null]], "has_local_option_changed": [[209, null]], "has_option_changed": [[210, null]], "has_scalar_variable": [[211, null]], "has_variable": [[212, null]], "hessian": [[307, null]], "hessian_symmetrize": [[387, null]], "hold_options_state": [[357, null]], "import_ignorecase": [[358, null]], "initialize": [[213, null]], "input.dat": [[2, "input-dat"]], "ipi_broker": [[308, null]], "kwargs_lower": [[359, null]], "levenshtein": [[309, null], [360, null]], "libint2_configuration": [[310, null], [361, null]], "libint2_print_out": [[311, null], [362, null]], "libint2_solid_harmonics_ordering": [[214, null]], "mat2arr": [[363, null]], "mcscf": [[215, null]], "mdi_run": [[312, null]], "message_box": [[313, null], [364, null]], "molden": [[314, null]], "molecule_get_attr": [[315, null]], "molecule_set_attr": [[316, null]], "mrcc_generate_input": [[216, null]], "mrcc_load_densities": [[217, null]], "occ": [[218, null]], "oeprop": [[317, null], [365, null]], "opt": [[318, null]], "optimize": [[319, null]], "optimize_geometric": [[320, null]], "option_exists_in_module": [[219, null]], "options_to_python": [[220, null]], "outfile_name": [[221, null]], "output.ref": [[2, "output-ref"]], "pcm_helper": [[366, null], [379, null]], "plugin": [[222, null]], "plugin_close": [[223, null]], "plugin_close_all": [[224, null]], "plugin_load": [[225, null]], "plump_qcvar": [[367, null]], "post-SCF time savings": [[1760, "post-scf-time-savings"]], "prefactor_ecd": [[368, null]], "prefactor_opa": [[369, null]], "prepare_options_for_module": [[226, null]], "prepare_options_for_modules": [[370, null]], "prepare_options_for_set_options": [[371, null]], "print_global_options": [[227, null]], "print_molden_vibs": [[388, null]], "print_options": [[228, null]], "print_out": [[229, null]], "print_variables": [[230, null]], "print_vibs": [[389, null]], "proc.py": [[1809, "proc-py"]], "process_input": [[380, null]], "prop": [[381, null]], "properties": [[382, null]], "provenance_stamp": [[372, null]], "psi4.core Module": [[1827, "module-psi4.core"]], "psi4.driver Package": [[1827, "module-psi4.driver"]], "psi4.driver.p4util Package": [[1827, "module-psi4.driver.p4util"]], "psi4.driver.qcdb.vib Module": [[1772, "module-psi4.driver.qcdb.vib"]], "psi_top_srcdir": [[231, null]], "psimrcc": [[232, null]], "psio_entry": [[233, null]], "reStructuredText": [[1764, "restructuredtext"]], "reopen_outfile": [[234, null]], "revoke_global_option_changed": [[235, null]], "revoke_local_option_changed": [[236, null]], "sanitize_method": [[373, null], [391, null]], "sanitize_name": [[392, null]], "sapt": [[237, null]], "scalar_variable": [[238, null]], "scalar_variables": [[239, null]], "scatter": [[240, null]], "scf_helper": [[393, null]], "scf_wavefunction_factory": [[394, null]], "scfgrad": [[241, null]], "scfhess": [[242, null]], "set_active_molecule": [[243, null]], "set_array_variable": [[244, null]], "set_datadir": [[245, null]], "set_global_option": [[246, null]], "set_global_option_python": [[247, null]], "set_local_option": [[248, null]], "set_local_option_python": [[249, null]], "set_memory": [[374, null], [395, null]], "set_memory_bytes": [[250, null]], "set_module_options": [[375, null], [396, null]], "set_num_threads": [[251, null]], "set_options": [[376, null], [397, null]], "set_output_file": [[252, null]], "set_psi_file_prefix": [[253, null]], "set_scalar_variable": [[254, null]], "set_variable": [[255, null]], "snLinK Algorithm": [[1231, "snlink-algorithm"]], "spectrum": [[377, null]], "state_to_atomicinput": [[378, null]], "tdscf": [[398, null]], "test_input.py": [[2, "test-input-py"]], "test_matrix_dpd_interface": [[256, null]], "thermo": [[390, null]], "timer_off": [[257, null]], "timer_on": [[258, null]], "triplet": [[259, null]], "tstart": [[260, null]], "tstop": [[261, null]], "variable": [[262, null]], "variables": [[263, null]], "version": [[264, null]], "vibanal_wfn": [[399, null]], "~/.psi4rc File": [[1767, "psirc-file"]]}, "docnames": ["adc", "adcc", "add_tests", "api/psi4.core.AOShellCombinationsIterator", "api/psi4.core.AngularMomentumInt", "api/psi4.core.BSVec", "api/psi4.core.BasisExtents", "api/psi4.core.BasisFunctions", "api/psi4.core.BasisSet", "api/psi4.core.BlockOPoints", "api/psi4.core.BoysLocalizer", "api/psi4.core.CCWavefunction", "api/psi4.core.CIVector", "api/psi4.core.CIWavefunction", "api/psi4.core.CUHF", "api/psi4.core.CdSalc", "api/psi4.core.CdSalcList", "api/psi4.core.CharacterTable", "api/psi4.core.CompositeJK", "api/psi4.core.CorrelationFactor", "api/psi4.core.CorrelationTable", "api/psi4.core.CubeProperties", "api/psi4.core.DASUM", "api/psi4.core.DAXPY", "api/psi4.core.DCOPY", "api/psi4.core.DDOT", "api/psi4.core.DFEP2Wavefunction", "api/psi4.core.DFHelper", "api/psi4.core.DFSOMCSCF", "api/psi4.core.DFTGrid", "api/psi4.core.DFTensor", "api/psi4.core.DGBMV", "api/psi4.core.DGEEV", "api/psi4.core.DGEMM", "api/psi4.core.DGEMV", "api/psi4.core.DGER", "api/psi4.core.DGETRF", "api/psi4.core.DGETRI", "api/psi4.core.DGETRS", "api/psi4.core.DNRM2", "api/psi4.core.DPOTRF", "api/psi4.core.DPOTRI", "api/psi4.core.DPOTRS", "api/psi4.core.DROT", "api/psi4.core.DSBMV", "api/psi4.core.DSCAL", "api/psi4.core.DSWAP", "api/psi4.core.DSYEV", "api/psi4.core.DSYMM", "api/psi4.core.DSYMV", "api/psi4.core.DSYR", "api/psi4.core.DSYR2", "api/psi4.core.DSYR2K", "api/psi4.core.DSYRK", "api/psi4.core.DSYSV", "api/psi4.core.DTBMV", "api/psi4.core.DTBSV", "api/psi4.core.DTRMM", "api/psi4.core.DTRMV", "api/psi4.core.DTRSM", "api/psi4.core.DTRSV", "api/psi4.core.Deriv", "api/psi4.core.DerivCalcType", "api/psi4.core.DiagonalizeOrder", "api/psi4.core.Dimension", "api/psi4.core.DipoleInt", "api/psi4.core.DirectJK", "api/psi4.core.DiskSOMCSCF", "api/psi4.core.Dispersion", "api/psi4.core.ERI", "api/psi4.core.ESPPropCalc", "api/psi4.core.ElectricFieldInt", "api/psi4.core.ElectrostaticInt", "api/psi4.core.ExternalPotential", "api/psi4.core.FCHKWriter", "api/psi4.core.FDDS_Dispersion", "api/psi4.core.FISAPT", "api/psi4.core.FittedSlaterCorrelationFactor", "api/psi4.core.FittingMetric", "api/psi4.core.FragmentType", "api/psi4.core.Functional", "api/psi4.core.GaussianShell", "api/psi4.core.GaussianType", "api/psi4.core.GeometryUnits", "api/psi4.core.HF", "api/psi4.core.IDAMAX", "api/psi4.core.IO", "api/psi4.core.IOManager", "api/psi4.core.IntVector", "api/psi4.core.IntegralFactory", "api/psi4.core.IntegralTransform", "api/psi4.core.IrreducibleRepresentation", "api/psi4.core.JK", "api/psi4.core.KineticInt", "api/psi4.core.LS_THC_Computer", "api/psi4.core.LaplaceDenominator", "api/psi4.core.LibXCFunctional", "api/psi4.core.Localizer", "api/psi4.core.MOSpace", "api/psi4.core.MOWriter", "api/psi4.core.Matrix", "api/psi4.core.MatrixFactory", "api/psi4.core.MemDFJK", "api/psi4.core.MintsHelper", "api/psi4.core.MoldenWriter", "api/psi4.core.MolecularGrid", "api/psi4.core.Molecule", "api/psi4.core.MultipoleInt", "api/psi4.core.MultipoleSymmetry", "api/psi4.core.NablaInt", "api/psi4.core.NumIntHelper", "api/psi4.core.OEProp", "api/psi4.core.OneBodyAOInt", "api/psi4.core.OneBodySOInt", "api/psi4.core.Options", "api/psi4.core.OrbitalSpace", "api/psi4.core.OverlapInt", "api/psi4.core.PMLocalizer", "api/psi4.core.PetiteList", "api/psi4.core.PointFunctions", "api/psi4.core.PointGroup", "api/psi4.core.PotentialInt", "api/psi4.core.PrimitiveType", "api/psi4.core.Prop", "api/psi4.core.ProtoIntVector", "api/psi4.core.ProtoVector", "api/psi4.core.PsiReturnType", "api/psi4.core.QuadrupoleInt", "api/psi4.core.RHF", "api/psi4.core.RKSFunctions", "api/psi4.core.ROHF", "api/psi4.core.SADGuess", "api/psi4.core.SOBasisSet", "api/psi4.core.SOMCSCF", "api/psi4.core.SalcComponent", "api/psi4.core.SaveType", "api/psi4.core.ShellInfo", "api/psi4.core.Slice", "api/psi4.core.SuperFunctional", "api/psi4.core.SymmetryOperation", "api/psi4.core.TLaplaceDenominator", "api/psi4.core.ThreeCenterOverlapInt", "api/psi4.core.TracelessQuadrupoleInt", "api/psi4.core.TwoBodyAOInt", "api/psi4.core.TwoElectronInt", "api/psi4.core.UHF", "api/psi4.core.UKSFunctions", "api/psi4.core.VBase", "api/psi4.core.Vector", "api/psi4.core.Vector3", "api/psi4.core.Wavefunction", "api/psi4.core.array_variable", "api/psi4.core.array_variables", "api/psi4.core.be_quiet", "api/psi4.core.benchmark_blas1", "api/psi4.core.benchmark_blas2", "api/psi4.core.benchmark_blas3", "api/psi4.core.benchmark_disk", "api/psi4.core.benchmark_integrals", "api/psi4.core.benchmark_math", "api/psi4.core.ccdensity", "api/psi4.core.ccenergy", "api/psi4.core.cceom", "api/psi4.core.cchbar", "api/psi4.core.cclambda", "api/psi4.core.ccresponse", "api/psi4.core.cctransort", "api/psi4.core.cctriples", "api/psi4.core.clean", "api/psi4.core.clean_options", "api/psi4.core.clean_timers", "api/psi4.core.clean_variables", "api/psi4.core.close_outfile", "api/psi4.core.dct", "api/psi4.core.del_array_variable", "api/psi4.core.del_scalar_variable", "api/psi4.core.del_variable", "api/psi4.core.detci", "api/psi4.core.dfmp2", "api/psi4.core.dfocc", "api/psi4.core.dlpno", "api/psi4.core.dmrg", "api/psi4.core.doublet", "api/psi4.core.dpdbuf4", "api/psi4.core.dpdfile2", "api/psi4.core.dummy_einsums", "api/psi4.core.dummy_integratorxx", "api/psi4.core.fcidump_tei_helper", "api/psi4.core.finalize", "api/psi4.core.flush_outfile", "api/psi4.core.fnocc", "api/psi4.core.get_active_molecule", "api/psi4.core.get_array_variable", "api/psi4.core.get_array_variables", "api/psi4.core.get_datadir", "api/psi4.core.get_global_option", "api/psi4.core.get_global_option_list", "api/psi4.core.get_local_option", "api/psi4.core.get_memory", "api/psi4.core.get_num_threads", "api/psi4.core.get_option", "api/psi4.core.get_options", "api/psi4.core.get_output_file", "api/psi4.core.get_variable", "api/psi4.core.get_variables", "api/psi4.core.get_writer_file_prefix", "api/psi4.core.git_version", "api/psi4.core.has_array_variable", "api/psi4.core.has_global_option_changed", "api/psi4.core.has_local_option_changed", "api/psi4.core.has_option_changed", "api/psi4.core.has_scalar_variable", "api/psi4.core.has_variable", "api/psi4.core.initialize", "api/psi4.core.libint2_solid_harmonics_ordering", "api/psi4.core.mcscf", "api/psi4.core.mrcc_generate_input", "api/psi4.core.mrcc_load_densities", "api/psi4.core.occ", "api/psi4.core.option_exists_in_module", "api/psi4.core.options_to_python", "api/psi4.core.outfile_name", "api/psi4.core.plugin", "api/psi4.core.plugin_close", "api/psi4.core.plugin_close_all", "api/psi4.core.plugin_load", "api/psi4.core.prepare_options_for_module", "api/psi4.core.print_global_options", "api/psi4.core.print_options", "api/psi4.core.print_out", "api/psi4.core.print_variables", "api/psi4.core.psi_top_srcdir", "api/psi4.core.psimrcc", "api/psi4.core.psio_entry", "api/psi4.core.reopen_outfile", "api/psi4.core.revoke_global_option_changed", "api/psi4.core.revoke_local_option_changed", "api/psi4.core.sapt", "api/psi4.core.scalar_variable", "api/psi4.core.scalar_variables", "api/psi4.core.scatter", "api/psi4.core.scfgrad", "api/psi4.core.scfhess", "api/psi4.core.set_active_molecule", "api/psi4.core.set_array_variable", "api/psi4.core.set_datadir", "api/psi4.core.set_global_option", "api/psi4.core.set_global_option_python", "api/psi4.core.set_local_option", "api/psi4.core.set_local_option_python", "api/psi4.core.set_memory_bytes", "api/psi4.core.set_num_threads", "api/psi4.core.set_output_file", "api/psi4.core.set_psi_file_prefix", "api/psi4.core.set_scalar_variable", "api/psi4.core.set_variable", "api/psi4.core.test_matrix_dpd_interface", "api/psi4.core.timer_off", "api/psi4.core.timer_on", "api/psi4.core.triplet", "api/psi4.core.tstart", "api/psi4.core.tstop", "api/psi4.core.variable", "api/psi4.core.variables", "api/psi4.core.version", "api/psi4.driver.AtomicComputer", "api/psi4.driver.ConvergenceError", "api/psi4.driver.EmpiricalDispersion", "api/psi4.driver.ManagedMethodError", "api/psi4.driver.MissingMethodError", "api/psi4.driver.OptimizationConvergenceError", "api/psi4.driver.ParsingError", "api/psi4.driver.PastureRequiredError", "api/psi4.driver.PsiException", "api/psi4.driver.QMMM", "api/psi4.driver.QMMMbohr", "api/psi4.driver.SCFConvergenceError", "api/psi4.driver.TDSCFConvergenceError", "api/psi4.driver.TestComparisonError", "api/psi4.driver.UpgradeHelper", "api/psi4.driver.ValidationError", "api/psi4.driver.activate", "api/psi4.driver.banner", "api/psi4.driver.basis_helper", "api/psi4.driver.cbs", "api/psi4.driver.compare_fchkfiles", "api/psi4.driver.compare_fcidumps", "api/psi4.driver.compare_moldenfiles", "api/psi4.driver.copy_file_from_scratch", "api/psi4.driver.copy_file_to_scratch", "api/psi4.driver.create_plugin", "api/psi4.driver.cubeprop", "api/psi4.driver.docs_table_link", "api/psi4.driver.dynamic_variable_bind", "api/psi4.driver.energies_from_fcidump", "api/psi4.driver.energy", "api/psi4.driver.fchk", "api/psi4.driver.fcidump", "api/psi4.driver.fcidump_from_file", "api/psi4.driver.find_approximate_string_matches", "api/psi4.driver.freq", "api/psi4.driver.frequencies", "api/psi4.driver.frequency", "api/psi4.driver.gdma", "api/psi4.driver.geometry", "api/psi4.driver.get_memory", "api/psi4.driver.gradient", "api/psi4.driver.hessian", "api/psi4.driver.ipi_broker", "api/psi4.driver.levenshtein", "api/psi4.driver.libint2_configuration", "api/psi4.driver.libint2_print_out", "api/psi4.driver.mdi_run", "api/psi4.driver.message_box", "api/psi4.driver.molden", "api/psi4.driver.molecule_get_attr", "api/psi4.driver.molecule_set_attr", "api/psi4.driver.oeprop", "api/psi4.driver.opt", "api/psi4.driver.optimize", "api/psi4.driver.optimize_geometric", "api/psi4.driver.p4util.DIIS", "api/psi4.driver.p4util.Gaussian", "api/psi4.driver.p4util.InPsight", "api/psi4.driver.p4util.Lineshape", "api/psi4.driver.p4util.Lorentzian", "api/psi4.driver.p4util.OptionState", "api/psi4.driver.p4util.OptionsState", "api/psi4.driver.p4util.OptionsStateCM", "api/psi4.driver.p4util.SolverEngine", "api/psi4.driver.p4util.all_casings", "api/psi4.driver.p4util.array_to_matrix", "api/psi4.driver.p4util.banner", "api/psi4.driver.p4util.basis_helper", "api/psi4.driver.p4util.block_diagonal_array", "api/psi4.driver.p4util.cg_solver", "api/psi4.driver.p4util.compare_fchkfiles", "api/psi4.driver.p4util.compare_fcidumps", "api/psi4.driver.p4util.compare_moldenfiles", "api/psi4.driver.p4util.copy_file_from_scratch", "api/psi4.driver.p4util.copy_file_to_scratch", "api/psi4.driver.p4util.cubeprop", "api/psi4.driver.p4util.davidson_solver", "api/psi4.driver.p4util.docs_table_link", "api/psi4.driver.p4util.drop_duplicates", "api/psi4.driver.p4util.energies_from_fcidump", "api/psi4.driver.p4util.expand_psivars", "api/psi4.driver.p4util.fcidump", "api/psi4.driver.p4util.fcidump_from_file", "api/psi4.driver.p4util.find_approximate_string_matches", "api/psi4.driver.p4util.format_molecule_for_input", "api/psi4.driver.p4util.format_options_for_input", "api/psi4.driver.p4util.free_atom_volumes", "api/psi4.driver.p4util.get_memory", "api/psi4.driver.p4util.get_psifile", "api/psi4.driver.p4util.getattr_ignorecase", "api/psi4.driver.p4util.hamiltonian_solver", "api/psi4.driver.p4util.hold_options_state", "api/psi4.driver.p4util.import_ignorecase", "api/psi4.driver.p4util.kwargs_lower", "api/psi4.driver.p4util.levenshtein", "api/psi4.driver.p4util.libint2_configuration", "api/psi4.driver.p4util.libint2_print_out", "api/psi4.driver.p4util.mat2arr", "api/psi4.driver.p4util.message_box", "api/psi4.driver.p4util.oeprop", "api/psi4.driver.p4util.pcm_helper", "api/psi4.driver.p4util.plump_qcvar", "api/psi4.driver.p4util.prefactor_ecd", "api/psi4.driver.p4util.prefactor_opa", "api/psi4.driver.p4util.prepare_options_for_modules", "api/psi4.driver.p4util.prepare_options_for_set_options", "api/psi4.driver.p4util.provenance_stamp", "api/psi4.driver.p4util.sanitize_method", "api/psi4.driver.p4util.set_memory", "api/psi4.driver.p4util.set_module_options", "api/psi4.driver.p4util.set_options", "api/psi4.driver.p4util.spectrum", "api/psi4.driver.p4util.state_to_atomicinput", "api/psi4.driver.pcm_helper", "api/psi4.driver.process_input", "api/psi4.driver.prop", "api/psi4.driver.properties", "api/psi4.driver.qcdb.vib.compare_vibinfos", "api/psi4.driver.qcdb.vib.filter_nonvib", "api/psi4.driver.qcdb.vib.filter_omega_to_real", "api/psi4.driver.qcdb.vib.harmonic_analysis", "api/psi4.driver.qcdb.vib.hessian_symmetrize", "api/psi4.driver.qcdb.vib.print_molden_vibs", "api/psi4.driver.qcdb.vib.print_vibs", "api/psi4.driver.qcdb.vib.thermo", "api/psi4.driver.sanitize_method", "api/psi4.driver.sanitize_name", "api/psi4.driver.scf_helper", "api/psi4.driver.scf_wavefunction_factory", "api/psi4.driver.set_memory", "api/psi4.driver.set_module_options", "api/psi4.driver.set_options", "api/psi4.driver.tdscf", "api/psi4.driver.vibanal_wfn", "appendices", "autodir_options_c/adc__cutoff_amps_print", "autodir_options_c/adc__gauge", "autodir_options_c/adc__kind", "autodir_options_c/adc__max_num_vecs", "autodir_options_c/adc__maxiter", "autodir_options_c/adc__num_core_orbitals", "autodir_options_c/adc__num_guesses", "autodir_options_c/adc__r_convergence", "autodir_options_c/adc__reference", "autodir_options_c/adc__roots_per_irrep", "autodir_options_c/ccdensity__ao_basis", "autodir_options_c/ccdensity__cachelevel", "autodir_options_c/ccdensity__debug", "autodir_options_c/ccdensity__gauge", "autodir_options_c/ccdensity__ints_tolerance", "autodir_options_c/ccdensity__opdm_only", "autodir_options_c/ccdensity__opdm_relax", "autodir_options_c/ccdensity__prop_all", "autodir_options_c/ccdensity__prop_root", "autodir_options_c/ccdensity__prop_sym", "autodir_options_c/ccdensity__reference", "autodir_options_c/ccdensity__roots_per_irrep", "autodir_options_c/ccdensity__wfn", "autodir_options_c/ccdensity__write_nos", "autodir_options_c/ccdensity__xi", "autodir_options_c/ccdensity__xi_connect", "autodir_options_c/ccdensity__zeta", "autodir_options_c/ccenergy__abcd", "autodir_options_c/ccenergy__analyze", "autodir_options_c/ccenergy__ao_basis", "autodir_options_c/ccenergy__bccd_maxiter", "autodir_options_c/ccenergy__brueckner_orbs_r_convergence", "autodir_options_c/ccenergy__cachelevel", "autodir_options_c/ccenergy__cachetype", "autodir_options_c/ccenergy__cc_num_threads", "autodir_options_c/ccenergy__cc_os_scale", "autodir_options_c/ccenergy__cc_ss_scale", "autodir_options_c/ccenergy__diis", "autodir_options_c/ccenergy__e_convergence", "autodir_options_c/ccenergy__force_restart", "autodir_options_c/ccenergy__local", "autodir_options_c/ccenergy__local_cphf_cutoff", "autodir_options_c/ccenergy__local_cutoff", "autodir_options_c/ccenergy__local_method", "autodir_options_c/ccenergy__local_pairdef", "autodir_options_c/ccenergy__local_weakp", "autodir_options_c/ccenergy__maxiter", "autodir_options_c/ccenergy__mp2_amps_print", "autodir_options_c/ccenergy__mp2_os_scale", "autodir_options_c/ccenergy__mp2_ss_scale", "autodir_options_c/ccenergy__new_triples", "autodir_options_c/ccenergy__num_amps_print", "autodir_options_c/ccenergy__pair_energies_print", "autodir_options_c/ccenergy__property", "autodir_options_c/ccenergy__r_convergence", "autodir_options_c/ccenergy__reference", "autodir_options_c/ccenergy__restart", "autodir_options_c/ccenergy__scs_ccsd", "autodir_options_c/ccenergy__scs_mp2", "autodir_options_c/ccenergy__scsn_mp2", "autodir_options_c/ccenergy__semicanonical", "autodir_options_c/ccenergy__t2_coupled", "autodir_options_c/ccenergy__t3_ws_incore", "autodir_options_c/ccenergy__wfn", "autodir_options_c/cceom__abcd", "autodir_options_c/cceom__cachelevel", "autodir_options_c/cceom__cachetype", "autodir_options_c/cceom__cc3_follow_root", "autodir_options_c/cceom__cc_num_threads", "autodir_options_c/cceom__collapse_with_last", "autodir_options_c/cceom__collapse_with_last_cc3", "autodir_options_c/cceom__complex_tolerance", "autodir_options_c/cceom__e_convergence", "autodir_options_c/cceom__eom_guess", "autodir_options_c/cceom__eom_reference", "autodir_options_c/cceom__excitation_range", "autodir_options_c/cceom__full_matrix", "autodir_options_c/cceom__local", "autodir_options_c/cceom__local_cutoff", "autodir_options_c/cceom__local_do_singles", "autodir_options_c/cceom__local_filter_singles", "autodir_options_c/cceom__local_method", "autodir_options_c/cceom__local_preconditioner", "autodir_options_c/cceom__local_weakp", "autodir_options_c/cceom__maxiter", "autodir_options_c/cceom__new_triples", "autodir_options_c/cceom__num_amps_print", "autodir_options_c/cceom__overlap_check", "autodir_options_c/cceom__prop_root", "autodir_options_c/cceom__prop_sym", "autodir_options_c/cceom__r_convergence", "autodir_options_c/cceom__reference", "autodir_options_c/cceom__restart_eom_cc3", "autodir_options_c/cceom__rhf_triplets", "autodir_options_c/cceom__roots_per_irrep", "autodir_options_c/cceom__schmidt_add_residual_tolerance", "autodir_options_c/cceom__semicanonical", "autodir_options_c/cceom__singles_print", "autodir_options_c/cceom__ss_e_convergence", "autodir_options_c/cceom__ss_r_convergence", "autodir_options_c/cceom__ss_skip_diag", "autodir_options_c/cceom__ss_vecs_per_root", "autodir_options_c/cceom__t3_ws_incore", "autodir_options_c/cceom__vecs_cc3", "autodir_options_c/cceom__vecs_per_root", "autodir_options_c/cceom__wfn", "autodir_options_c/cchbar__cachelevel", "autodir_options_c/cchbar__eom_reference", "autodir_options_c/cchbar__t_amps", "autodir_options_c/cchbar__wabei_lowdisk", "autodir_options_c/cchbar__wfn", "autodir_options_c/cclambda__abcd", "autodir_options_c/cclambda__ao_basis", "autodir_options_c/cclambda__cachelevel", "autodir_options_c/cclambda__diis", "autodir_options_c/cclambda__jobtype", "autodir_options_c/cclambda__local", "autodir_options_c/cclambda__local_cphf_cutoff", "autodir_options_c/cclambda__local_cutoff", "autodir_options_c/cclambda__local_filter_singles", "autodir_options_c/cclambda__local_method", "autodir_options_c/cclambda__local_pairdef", "autodir_options_c/cclambda__local_weakp", "autodir_options_c/cclambda__maxiter", "autodir_options_c/cclambda__num_amps_print", "autodir_options_c/cclambda__prop_all", "autodir_options_c/cclambda__prop_root", "autodir_options_c/cclambda__prop_sym", "autodir_options_c/cclambda__r_convergence", "autodir_options_c/cclambda__restart", "autodir_options_c/cclambda__roots_per_irrep", "autodir_options_c/cclambda__sekino", "autodir_options_c/cclambda__wfn", "autodir_options_c/cclambda__zeta", "autodir_options_c/ccresponse__abcd", "autodir_options_c/ccresponse__analyze", "autodir_options_c/ccresponse__cachelevel", "autodir_options_c/ccresponse__diis", "autodir_options_c/ccresponse__gauge", "autodir_options_c/ccresponse__linear", "autodir_options_c/ccresponse__local", "autodir_options_c/ccresponse__local_cphf_cutoff", "autodir_options_c/ccresponse__local_cutoff", "autodir_options_c/ccresponse__local_filter_singles", "autodir_options_c/ccresponse__local_method", "autodir_options_c/ccresponse__local_pairdef", "autodir_options_c/ccresponse__local_weakp", "autodir_options_c/ccresponse__maxiter", "autodir_options_c/ccresponse__num_amps_print", "autodir_options_c/ccresponse__omega", "autodir_options_c/ccresponse__property", "autodir_options_c/ccresponse__r_convergence", "autodir_options_c/ccresponse__reference", "autodir_options_c/ccresponse__restart", "autodir_options_c/ccresponse__sekino", "autodir_options_c/ccresponse__wfn", "autodir_options_c/cctransort__ao_basis", "autodir_options_c/cctransort__cachelevel", "autodir_options_c/cctransort__delete_tei", "autodir_options_c/cctransort__reference", "autodir_options_c/cctransort__run_cctransort", "autodir_options_c/cctransort__semicanonical", "autodir_options_c/cctransort__wfn", "autodir_options_c/cctriples__cc_num_threads", "autodir_options_c/cctriples__reference", "autodir_options_c/cctriples__semicanonical", "autodir_options_c/cctriples__wfn", "autodir_options_c/cfour__cfour_abcdtype", "autodir_options_c/cfour__cfour_active_orbi", "autodir_options_c/cfour__cfour_anh_algorithm", "autodir_options_c/cfour__cfour_anh_derivatives", "autodir_options_c/cfour__cfour_anh_stepsize", "autodir_options_c/cfour__cfour_anh_symmetry", "autodir_options_c/cfour__cfour_anharmonic", "autodir_options_c/cfour__cfour_ao_ladders", "autodir_options_c/cfour__cfour_av_scf", "autodir_options_c/cfour__cfour_basis", "autodir_options_c/cfour__cfour_bruck_conv", "autodir_options_c/cfour__cfour_brueckner", "autodir_options_c/cfour__cfour_cache_recs", "autodir_options_c/cfour__cfour_calc_level", "autodir_options_c/cfour__cfour_cc_conv", "autodir_options_c/cfour__cfour_cc_exporder", "autodir_options_c/cfour__cfour_cc_extrapolation", "autodir_options_c/cfour__cfour_cc_maxcyc", "autodir_options_c/cfour__cfour_cc_program", "autodir_options_c/cfour__cfour_charge", "autodir_options_c/cfour__cfour_cis_conv", "autodir_options_c/cfour__cfour_continuum", "autodir_options_c/cfour__cfour_contraction", "autodir_options_c/cfour__cfour_convergence", "autodir_options_c/cfour__cfour_coordinates", "autodir_options_c/cfour__cfour_core_orbitals", "autodir_options_c/cfour__cfour_cphf_conver", "autodir_options_c/cfour__cfour_cphf_maxcyc", "autodir_options_c/cfour__cfour_curvilinear", "autodir_options_c/cfour__cfour_dboc", "autodir_options_c/cfour__cfour_dct", "autodir_options_c/cfour__cfour_deriv_level", "autodir_options_c/cfour__cfour_diff_type", "autodir_options_c/cfour__cfour_dropmo", "autodir_options_c/cfour__cfour_ecp", "autodir_options_c/cfour__cfour_eigenvector", "autodir_options_c/cfour__cfour_el_anharm", "autodir_options_c/cfour__cfour_eom_nonit", "autodir_options_c/cfour__cfour_estate_conv", "autodir_options_c/cfour__cfour_estate_maxcyc", "autodir_options_c/cfour__cfour_estate_prop", "autodir_options_c/cfour__cfour_estate_sym", "autodir_options_c/cfour__cfour_estate_trans", "autodir_options_c/cfour__cfour_eval_hess", "autodir_options_c/cfour__cfour_excitation", "autodir_options_c/cfour__cfour_excite", "autodir_options_c/cfour__cfour_fc_field", "autodir_options_c/cfour__cfour_fd_calctype", "autodir_options_c/cfour__cfour_fd_irreps", "autodir_options_c/cfour__cfour_fd_project", "autodir_options_c/cfour__cfour_fd_stepsize", "autodir_options_c/cfour__cfour_fd_usegroup", "autodir_options_c/cfour__cfour_file_recsiz", "autodir_options_c/cfour__cfour_file_stripe", "autodir_options_c/cfour__cfour_finite_perturbation", "autodir_options_c/cfour__cfour_fock", "autodir_options_c/cfour__cfour_freq_algorithm", "autodir_options_c/cfour__cfour_frozen_core", "autodir_options_c/cfour__cfour_frozen_virt", "autodir_options_c/cfour__cfour_gamma_abcd", "autodir_options_c/cfour__cfour_genbas_1", "autodir_options_c/cfour__cfour_genbas_2", "autodir_options_c/cfour__cfour_genbas_3", "autodir_options_c/cfour__cfour_genbas_4", "autodir_options_c/cfour__cfour_geo_conv", "autodir_options_c/cfour__cfour_geo_maxcyc", "autodir_options_c/cfour__cfour_geo_maxstep", "autodir_options_c/cfour__cfour_geo_method", "autodir_options_c/cfour__cfour_giao", "autodir_options_c/cfour__cfour_grid", "autodir_options_c/cfour__cfour_guess", "autodir_options_c/cfour__cfour_hbar", "autodir_options_c/cfour__cfour_hfstability", "autodir_options_c/cfour__cfour_incore", "autodir_options_c/cfour__cfour_input_mrcc", "autodir_options_c/cfour__cfour_integrals", "autodir_options_c/cfour__cfour_joda_print", "autodir_options_c/cfour__cfour_lineq_conv", "autodir_options_c/cfour__cfour_lineq_maxcy", "autodir_options_c/cfour__cfour_lineq_type", "autodir_options_c/cfour__cfour_lock_orbocc", "autodir_options_c/cfour__cfour_maxstep", "autodir_options_c/cfour__cfour_mem_unit", "autodir_options_c/cfour__cfour_memory_size", "autodir_options_c/cfour__cfour_method", "autodir_options_c/cfour__cfour_mrcc", "autodir_options_c/cfour__cfour_multiplicity", "autodir_options_c/cfour__cfour_nacoupling", "autodir_options_c/cfour__cfour_negeval", "autodir_options_c/cfour__cfour_newnorm", "autodir_options_c/cfour__cfour_nonhf", "autodir_options_c/cfour__cfour_ntop_tamp", "autodir_options_c/cfour__cfour_occupation", "autodir_options_c/cfour__cfour_omp_num_threads", "autodir_options_c/cfour__cfour_open-shell", "autodir_options_c/cfour__cfour_opt_maxcyc", "autodir_options_c/cfour__cfour_orbitals", "autodir_options_c/cfour__cfour_pert_orb", "autodir_options_c/cfour__cfour_points", "autodir_options_c/cfour__cfour_print", "autodir_options_c/cfour__cfour_prop_integral", "autodir_options_c/cfour__cfour_props", "autodir_options_c/cfour__cfour_qrhf_general", "autodir_options_c/cfour__cfour_qrhf_orbital", "autodir_options_c/cfour__cfour_qrhfgues", "autodir_options_c/cfour__cfour_raman_int", "autodir_options_c/cfour__cfour_raman_orb", "autodir_options_c/cfour__cfour_rdo", "autodir_options_c/cfour__cfour_reference", "autodir_options_c/cfour__cfour_relativistic", "autodir_options_c/cfour__cfour_relax_dens", "autodir_options_c/cfour__cfour_res_raman", "autodir_options_c/cfour__cfour_restart_cc", "autodir_options_c/cfour__cfour_rot_evec", "autodir_options_c/cfour__cfour_save_ints", "autodir_options_c/cfour__cfour_scale_on", "autodir_options_c/cfour__cfour_scf_conv", "autodir_options_c/cfour__cfour_scf_damping", "autodir_options_c/cfour__cfour_scf_exporder", "autodir_options_c/cfour__cfour_scf_expstart", "autodir_options_c/cfour__cfour_scf_extrapolation", "autodir_options_c/cfour__cfour_scf_maxcyc", "autodir_options_c/cfour__cfour_sd_field", "autodir_options_c/cfour__cfour_spherical", "autodir_options_c/cfour__cfour_spin_flip", "autodir_options_c/cfour__cfour_spin_orbit", "autodir_options_c/cfour__cfour_spin_scal", "autodir_options_c/cfour__cfour_spinrotation", "autodir_options_c/cfour__cfour_subgroup", "autodir_options_c/cfour__cfour_sym_check", "autodir_options_c/cfour__cfour_symmetry", "autodir_options_c/cfour__cfour_t3_extrapol", "autodir_options_c/cfour__cfour_tamp_sum", "autodir_options_c/cfour__cfour_thermochemistry", "autodir_options_c/cfour__cfour_trans_inv", "autodir_options_c/cfour__cfour_treat_pert", "autodir_options_c/cfour__cfour_uij_threshold", "autodir_options_c/cfour__cfour_units", "autodir_options_c/cfour__cfour_update_hessian", "autodir_options_c/cfour__cfour_vibration", "autodir_options_c/cfour__cfour_vtran", "autodir_options_c/cfour__cfour_xfield", "autodir_options_c/cfour__cfour_xform_tol", "autodir_options_c/cfour__cfour_yfield", "autodir_options_c/cfour__cfour_zfield", "autodir_options_c/cfour__translate_psi4", "autodir_options_c/cphf__cphf_mem_safety_factor", "autodir_options_c/cphf__cphf_tasks", "autodir_options_c/cphf__debug", "autodir_options_c/cphf__df_basis_scf", "autodir_options_c/cphf__explicit_hamiltonian", "autodir_options_c/cphf__module", "autodir_options_c/cphf__print", "autodir_options_c/cphf__scf_type", "autodir_options_c/cphf__solver_convergence", "autodir_options_c/cphf__solver_maxiter", "autodir_options_c/cphf__solver_n_guess", "autodir_options_c/cphf__solver_precondition", "autodir_options_c/dct__algorithm", "autodir_options_c/dct__ao_basis", "autodir_options_c/dct__cachelevel", "autodir_options_c/dct__damping_percentage", "autodir_options_c/dct__dct_functional", "autodir_options_c/dct__dct_guess", "autodir_options_c/dct__dct_type", "autodir_options_c/dct__df_basis_dct", "autodir_options_c/dct__diis_max_vecs", "autodir_options_c/dct__diis_min_vecs", "autodir_options_c/dct__diis_start_convergence", "autodir_options_c/dct__e_convergence", "autodir_options_c/dct__energy_level_shift", "autodir_options_c/dct__guess_r_convergence", "autodir_options_c/dct__ints_tolerance", "autodir_options_c/dct__maxiter", "autodir_options_c/dct__odc_guess", "autodir_options_c/dct__opdm", "autodir_options_c/dct__orbital_level_shift", "autodir_options_c/dct__qc_coupling", "autodir_options_c/dct__qc_type", "autodir_options_c/dct__r_convergence", "autodir_options_c/dct__reference", "autodir_options_c/dct__relax_guess_orbitals", "autodir_options_c/dct__response_algorithm", "autodir_options_c/dct__stability_add_vectors", "autodir_options_c/dct__stability_augment_space_tol", "autodir_options_c/dct__stability_check", "autodir_options_c/dct__stability_convergence", "autodir_options_c/dct__stability_max_space_size", "autodir_options_c/dct__stability_n_eigenvalues", "autodir_options_c/dct__stability_n_guess_vectors", "autodir_options_c/dct__three_particle", "autodir_options_c/dct__tikhonow_omega", "autodir_options_c/ddx__ddx_diis_max_vecs", "autodir_options_c/ddx__ddx_eta", "autodir_options_c/ddx__ddx_fmm", "autodir_options_c/ddx__ddx_fmm_local_lmax", "autodir_options_c/ddx__ddx_fmm_multipole_lmax", "autodir_options_c/ddx__ddx_incore", "autodir_options_c/ddx__ddx_lmax", "autodir_options_c/ddx__ddx_logfile", "autodir_options_c/ddx__ddx_maxiter", "autodir_options_c/ddx__ddx_model", "autodir_options_c/ddx__ddx_n_lebedev", "autodir_options_c/ddx__ddx_radii", "autodir_options_c/ddx__ddx_radii_scaling", "autodir_options_c/ddx__ddx_radii_set", "autodir_options_c/ddx__ddx_shift", "autodir_options_c/ddx__ddx_solute_radial_points", "autodir_options_c/ddx__ddx_solute_spherical_points", "autodir_options_c/ddx__ddx_solvation_convergence", "autodir_options_c/ddx__ddx_solvent", "autodir_options_c/ddx__ddx_solvent_epsilon", "autodir_options_c/ddx__ddx_solvent_epsilon_optical", "autodir_options_c/ddx__ddx_solvent_kappa", "autodir_options_c/detci__a_ras3_max", "autodir_options_c/detci__avg_states", "autodir_options_c/detci__avg_weights", "autodir_options_c/detci__b_ras3_max", "autodir_options_c/detci__bendazzoli", "autodir_options_c/detci__calc_s_squared", "autodir_options_c/detci__cc", "autodir_options_c/detci__cc_a_ras3_max", "autodir_options_c/detci__cc_b_ras3_max", "autodir_options_c/detci__cc_ex_level", "autodir_options_c/detci__cc_fix_external", "autodir_options_c/detci__cc_fix_external_min", "autodir_options_c/detci__cc_macro", "autodir_options_c/detci__cc_mixed", "autodir_options_c/detci__cc_ras34_max", "autodir_options_c/detci__cc_ras3_max", "autodir_options_c/detci__cc_ras4_max", "autodir_options_c/detci__cc_update_eps", "autodir_options_c/detci__cc_val_ex_level", "autodir_options_c/detci__cc_variational", "autodir_options_c/detci__cc_vecs_read", "autodir_options_c/detci__cc_vecs_write", "autodir_options_c/detci__ci_file_start", "autodir_options_c/detci__ci_maxiter", "autodir_options_c/detci__ci_num_threads", "autodir_options_c/detci__ciblks_print", "autodir_options_c/detci__collapse_size", "autodir_options_c/detci__detci_freeze_core", "autodir_options_c/detci__df_basis_mcscf", "autodir_options_c/detci__diag_method", "autodir_options_c/detci__diis", "autodir_options_c/detci__diis_freq", "autodir_options_c/detci__diis_max_vecs", "autodir_options_c/detci__diis_min_vecs", "autodir_options_c/detci__diis_start_iter", "autodir_options_c/detci__dipmom", "autodir_options_c/detci__e_convergence", "autodir_options_c/detci__ex_allow", "autodir_options_c/detci__ex_level", "autodir_options_c/detci__fci", "autodir_options_c/detci__fci_strings", "autodir_options_c/detci__filter_guess", "autodir_options_c/detci__filter_guess_det1", "autodir_options_c/detci__filter_guess_det2", "autodir_options_c/detci__filter_guess_sign", "autodir_options_c/detci__filter_zero_det", "autodir_options_c/detci__follow_root", "autodir_options_c/detci__follow_vector", "autodir_options_c/detci__guess_vector", "autodir_options_c/detci__h0_block_coupling", "autodir_options_c/detci__h0_block_coupling_size", "autodir_options_c/detci__h0_blocksize", "autodir_options_c/detci__h0_guess_size", "autodir_options_c/detci__hd_avg", "autodir_options_c/detci__hd_otf", "autodir_options_c/detci__icore", "autodir_options_c/detci__istop", "autodir_options_c/detci__lse", "autodir_options_c/detci__lse_collapse", "autodir_options_c/detci__lse_tolerance", "autodir_options_c/detci__max_num_vecs", "autodir_options_c/detci__mcscf_algorithm", "autodir_options_c/detci__mcscf_ci_cleanup", "autodir_options_c/detci__mcscf_diis_error_type", "autodir_options_c/detci__mcscf_diis_freq", "autodir_options_c/detci__mcscf_diis_max_vecs", "autodir_options_c/detci__mcscf_diis_start", "autodir_options_c/detci__mcscf_dpd_cleanup", "autodir_options_c/detci__mcscf_e_convergence", "autodir_options_c/detci__mcscf_guess", "autodir_options_c/detci__mcscf_max_rot", "autodir_options_c/detci__mcscf_maxiter", "autodir_options_c/detci__mcscf_r_convergence", "autodir_options_c/detci__mcscf_rotate", "autodir_options_c/detci__mcscf_so_start_e", "autodir_options_c/detci__mcscf_so_start_grad", "autodir_options_c/detci__mcscf_type", "autodir_options_c/detci__mixed", "autodir_options_c/detci__mixed4", "autodir_options_c/detci__mpn", "autodir_options_c/detci__mpn_order_save", "autodir_options_c/detci__mpn_schmidt", "autodir_options_c/detci__mpn_wigner", "autodir_options_c/detci__ms0", "autodir_options_c/detci__nat_orbs", "autodir_options_c/detci__no_dfile", "autodir_options_c/detci__num_amps_print", "autodir_options_c/detci__num_dets_print", "autodir_options_c/detci__num_init_vecs", "autodir_options_c/detci__num_roots", "autodir_options_c/detci__opdm", "autodir_options_c/detci__perturb_magnitude", "autodir_options_c/detci__preconditioner", "autodir_options_c/detci__r4s", "autodir_options_c/detci__r_convergence", "autodir_options_c/detci__ras34_max", "autodir_options_c/detci__ras3_max", "autodir_options_c/detci__ras4_max", "autodir_options_c/detci__reference", "autodir_options_c/detci__reference_sym", "autodir_options_c/detci__repl_otf", "autodir_options_c/detci__restart", "autodir_options_c/detci__s", "autodir_options_c/detci__sf_restrict", "autodir_options_c/detci__sigma_overlap", "autodir_options_c/detci__tdm", "autodir_options_c/detci__tpdm", "autodir_options_c/detci__update", "autodir_options_c/detci__val_ex_level", "autodir_options_c/detci__wfn", "autodir_options_c/dfep2__df_basis_ep2", "autodir_options_c/dfep2__ep2_convergence", "autodir_options_c/dfep2__ep2_maxiter", "autodir_options_c/dfep2__ep2_num_ea", "autodir_options_c/dfep2__ep2_num_ip", "autodir_options_c/dfep2__ep2_orbitals", "autodir_options_c/dfmp2__basis", "autodir_options_c/dfmp2__df_basis_mp2", "autodir_options_c/dfmp2__df_ints_io", "autodir_options_c/dfmp2__df_ints_num_threads", "autodir_options_c/dfmp2__dfmp2_mem_factor", "autodir_options_c/dfmp2__dfmp2_p2_tolerance", "autodir_options_c/dfmp2__dfmp2_p_tolerance", "autodir_options_c/dfmp2__ints_tolerance", "autodir_options_c/dfmp2__madmp2_sleep", "autodir_options_c/dfmp2__mp2_os_scale", "autodir_options_c/dfmp2__mp2_ss_scale", "autodir_options_c/dfmp2__onepdm", "autodir_options_c/dfmp2__opdm_relax", "autodir_options_c/dfocc__cc_diis_max_vecs", "autodir_options_c/dfocc__cc_diis_min_vecs", "autodir_options_c/dfocc__cc_lambda", "autodir_options_c/dfocc__cc_maxiter", "autodir_options_c/dfocc__cholesky", "autodir_options_c/dfocc__cholesky_tolerance", "autodir_options_c/dfocc__comput_s2", "autodir_options_c/dfocc__cutoff", "autodir_options_c/dfocc__do_diis", "autodir_options_c/dfocc__do_level_shift", "autodir_options_c/dfocc__do_scs", "autodir_options_c/dfocc__do_sos", "autodir_options_c/dfocc__e3_scale", "autodir_options_c/dfocc__e_convergence", "autodir_options_c/dfocc__ekt_ip", "autodir_options_c/dfocc__hess_type", "autodir_options_c/dfocc__integral_cutoff", "autodir_options_c/dfocc__level_shift", "autodir_options_c/dfocc__lineq_solver", "autodir_options_c/dfocc__max_mograd_convergence", "autodir_options_c/dfocc__mo_diis_num_vecs", "autodir_options_c/dfocc__mo_maxiter", "autodir_options_c/dfocc__mo_step_max", "autodir_options_c/dfocc__molden_write", "autodir_options_c/dfocc__mp2_amp_type", "autodir_options_c/dfocc__mp2_os_scale", "autodir_options_c/dfocc__mp2_sos_scale", "autodir_options_c/dfocc__mp2_sos_scale2", "autodir_options_c/dfocc__mp2_ss_scale", "autodir_options_c/dfocc__nat_orbs", "autodir_options_c/dfocc__occ_orbs_print", "autodir_options_c/dfocc__oeprop", "autodir_options_c/dfocc__oo_scale", "autodir_options_c/dfocc__opt_method", "autodir_options_c/dfocc__orb_opt", "autodir_options_c/dfocc__orb_resp_solver", "autodir_options_c/dfocc__orth_type", "autodir_options_c/dfocc__pcg_beta_type", "autodir_options_c/dfocc__pcg_convergence", "autodir_options_c/dfocc__pcg_maxiter", "autodir_options_c/dfocc__ppl_type", "autodir_options_c/dfocc__qchf", "autodir_options_c/dfocc__r_convergence", "autodir_options_c/dfocc__read_scf_3index", "autodir_options_c/dfocc__reg_param", "autodir_options_c/dfocc__regularization", "autodir_options_c/dfocc__remp_a", "autodir_options_c/dfocc__rms_mograd_convergence", "autodir_options_c/dfocc__scs_type", "autodir_options_c/dfocc__sos_type", "autodir_options_c/dfocc__triples_iabc_type", "autodir_options_c/dfocc__wfn_type", "autodir_options_c/dlpno__df_basis_mp2", "autodir_options_c/dlpno__dlpno_algorithm", "autodir_options_c/dlpno__dlpno_local_orbitals", "autodir_options_c/dlpno__dlpno_maxiter", "autodir_options_c/dlpno__doi_basis_tolerance", "autodir_options_c/dlpno__doi_pruning_scheme", "autodir_options_c/dlpno__doi_radial_points", "autodir_options_c/dlpno__doi_spherical_points", "autodir_options_c/dlpno__e_convergence", "autodir_options_c/dlpno__f_cut", "autodir_options_c/dlpno__local_convergence", "autodir_options_c/dlpno__local_maxiter", "autodir_options_c/dlpno__pno_convergence", "autodir_options_c/dlpno__r_convergence", "autodir_options_c/dlpno__s_cut", "autodir_options_c/dlpno__t_cut_clmo", "autodir_options_c/dlpno__t_cut_cpao", "autodir_options_c/dlpno__t_cut_do", "autodir_options_c/dlpno__t_cut_do_ij", "autodir_options_c/dlpno__t_cut_do_pre", "autodir_options_c/dlpno__t_cut_mkn", "autodir_options_c/dlpno__t_cut_pno", "autodir_options_c/dlpno__t_cut_pre", "autodir_options_c/dmrg__dmrg_caspt2_calc", "autodir_options_c/dmrg__dmrg_caspt2_imag", "autodir_options_c/dmrg__dmrg_caspt2_ipea", "autodir_options_c/dmrg__dmrg_caspt2_orbs", "autodir_options_c/dmrg__dmrg_diis", "autodir_options_c/dmrg__dmrg_diis_write", "autodir_options_c/dmrg__dmrg_excitation", "autodir_options_c/dmrg__dmrg_irrep", "autodir_options_c/dmrg__dmrg_local_init", "autodir_options_c/dmrg__dmrg_molden_write", "autodir_options_c/dmrg__dmrg_mps_write", "autodir_options_c/dmrg__dmrg_multiplicity", "autodir_options_c/dmrg__dmrg_opdm_ao_print", "autodir_options_c/dmrg__dmrg_print_corr", "autodir_options_c/dmrg__dmrg_scf_active_space", "autodir_options_c/dmrg__dmrg_scf_diis_thr", "autodir_options_c/dmrg__dmrg_scf_grad_thr", "autodir_options_c/dmrg__dmrg_scf_max_iter", "autodir_options_c/dmrg__dmrg_scf_state_avg", "autodir_options_c/dmrg__dmrg_sweep_dvdson_rtol", "autodir_options_c/dmrg__dmrg_sweep_energy_conv", "autodir_options_c/dmrg__dmrg_sweep_max_sweeps", "autodir_options_c/dmrg__dmrg_sweep_noise_prefac", "autodir_options_c/dmrg__dmrg_sweep_states", "autodir_options_c/dmrg__dmrg_unitary_write", "autodir_options_c/efp__dertype", "autodir_options_c/efp__efp_disp", "autodir_options_c/efp__efp_disp_damping", "autodir_options_c/efp__efp_elst", "autodir_options_c/efp__efp_elst_damping", "autodir_options_c/efp__efp_exch", "autodir_options_c/efp__efp_ind", "autodir_options_c/efp__efp_ind_damping", "autodir_options_c/efp__efp_qm_elst", "autodir_options_c/efp__efp_qm_ind", "autodir_options_c/efp__print", "autodir_options_c/efp__qmefp", "autodir_options_c/findif__disp_size", "autodir_options_c/findif__fd_project", "autodir_options_c/findif__gradient_write", "autodir_options_c/findif__hessian_write", "autodir_options_c/findif__normal_modes_write", "autodir_options_c/findif__points", "autodir_options_c/fisapt__cphf_r_convergence", "autodir_options_c/fisapt__cubic_basis_tolerance", "autodir_options_c/fisapt__cubic_block_max_points", "autodir_options_c/fisapt__cubic_grid_overage", "autodir_options_c/fisapt__cubic_grid_spacing", "autodir_options_c/fisapt__fisapt_charge_completeness", "autodir_options_c/fisapt__fisapt_cube_densmat", "autodir_options_c/fisapt__fisapt_cube_linkibos", "autodir_options_c/fisapt__fisapt_cube_linkihos", "autodir_options_c/fisapt__fisapt_do_fsapt", "autodir_options_c/fisapt__fisapt_do_fsapt_disp", "autodir_options_c/fisapt__fisapt_do_plot", "autodir_options_c/fisapt__fisapt_exch_parperp", "autodir_options_c/fisapt__fisapt_fsapt_exch_scale", "autodir_options_c/fisapt__fisapt_fsapt_filepath", "autodir_options_c/fisapt__fisapt_fsapt_ind_response", "autodir_options_c/fisapt__fisapt_fsapt_ind_scale", "autodir_options_c/fisapt__fisapt_fssapt_filepath", "autodir_options_c/fisapt__fisapt_link_assignment", "autodir_options_c/fisapt__fisapt_link_ortho", "autodir_options_c/fisapt__fisapt_link_selection", "autodir_options_c/fisapt__fisapt_manual_links", "autodir_options_c/fisapt__fisapt_mem_safety_factor", "autodir_options_c/fisapt__fisapt_plot_filepath", "autodir_options_c/fisapt__ints_tolerance", "autodir_options_c/fisapt__local_convergence", "autodir_options_c/fisapt__local_ibo_condition", "autodir_options_c/fisapt__local_ibo_power", "autodir_options_c/fisapt__local_ibo_stars", "autodir_options_c/fisapt__local_ibo_stars_completeness", "autodir_options_c/fisapt__local_ibo_use_stars", "autodir_options_c/fisapt__local_maxiter", "autodir_options_c/fisapt__local_use_ghosts", "autodir_options_c/fisapt__maxiter", "autodir_options_c/fisapt__minao_basis", "autodir_options_c/fisapt__ssapt0_scale", "autodir_options_c/fnocc__active_nat_orbs", "autodir_options_c/fnocc__brueckner_maxiter", "autodir_options_c/fnocc__cc_scale_os", "autodir_options_c/fnocc__cc_scale_ss", "autodir_options_c/fnocc__cc_timings", "autodir_options_c/fnocc__cepa_level", "autodir_options_c/fnocc__cepa_no_singles", "autodir_options_c/fnocc__cholesky_tolerance", "autodir_options_c/fnocc__compute_mp4_triples", "autodir_options_c/fnocc__compute_triples", "autodir_options_c/fnocc__df_basis_cc", "autodir_options_c/fnocc__dfcc", "autodir_options_c/fnocc__diis_max_vecs", "autodir_options_c/fnocc__dipmom", "autodir_options_c/fnocc__e_convergence", "autodir_options_c/fnocc__maxiter", "autodir_options_c/fnocc__mp2_scale_os", "autodir_options_c/fnocc__mp2_scale_ss", "autodir_options_c/fnocc__nat_orbs", "autodir_options_c/fnocc__occ_percentage", "autodir_options_c/fnocc__occ_tolerance", "autodir_options_c/fnocc__r_convergence", "autodir_options_c/fnocc__run_ccsd", "autodir_options_c/fnocc__run_cepa", "autodir_options_c/fnocc__run_mp2", "autodir_options_c/fnocc__run_mp3", "autodir_options_c/fnocc__run_mp4", "autodir_options_c/fnocc__scs_ccsd", "autodir_options_c/fnocc__scs_cepa", "autodir_options_c/fnocc__scs_mp2", "autodir_options_c/fnocc__triples_low_memory", "autodir_options_c/fnocc__use_df_ints", "autodir_options_c/gdma__gdma_limit", "autodir_options_c/gdma__gdma_multipole_units", "autodir_options_c/gdma__gdma_origin", "autodir_options_c/gdma__gdma_radius", "autodir_options_c/gdma__gdma_switch", "autodir_options_c/globals__active", "autodir_options_c/globals__basis_relativistic", "autodir_options_c/globals__bench", "autodir_options_c/globals__brianqc_enable", "autodir_options_c/globals__cc_type", "autodir_options_c/globals__ci_type", "autodir_options_c/globals__cubeprop_basis_functions", "autodir_options_c/globals__cubeprop_filepath", "autodir_options_c/globals__cubeprop_isocontour_threshold", "autodir_options_c/globals__cubeprop_orbitals", "autodir_options_c/globals__cubeprop_tasks", "autodir_options_c/globals__cubic_basis_tolerance", "autodir_options_c/globals__cubic_block_max_points", "autodir_options_c/globals__cubic_grid_overage", "autodir_options_c/globals__cubic_grid_spacing", "autodir_options_c/globals__ddx", "autodir_options_c/globals__debug", "autodir_options_c/globals__dertype", "autodir_options_c/globals__df_basis_cc", "autodir_options_c/globals__die_if_not_converged", "autodir_options_c/globals__dkh_order", "autodir_options_c/globals__docc", "autodir_options_c/globals__external_potential_symmetry", "autodir_options_c/globals__freeze_core", "autodir_options_c/globals__freeze_core_policy", "autodir_options_c/globals__frozen_docc", "autodir_options_c/globals__frozen_uocc", "autodir_options_c/globals__integral_package", "autodir_options_c/globals__literal_cfour", "autodir_options_c/globals__ls_thc_basis_tolerance", "autodir_options_c/globals__ls_thc_df", "autodir_options_c/globals__ls_thc_pruning_scheme", "autodir_options_c/globals__ls_thc_radial_points", "autodir_options_c/globals__ls_thc_s_epsilon", "autodir_options_c/globals__ls_thc_spherical_points", "autodir_options_c/globals__ls_thc_weights_tolerance", "autodir_options_c/globals__mat_num_column_print", "autodir_options_c/globals__max_radial_moment", "autodir_options_c/globals__mbis_d_convergence", "autodir_options_c/globals__mbis_maxiter", "autodir_options_c/globals__mbis_pruning_scheme", "autodir_options_c/globals__mbis_radial_points", "autodir_options_c/globals__mbis_spherical_points", "autodir_options_c/globals__molden_with_virtual", "autodir_options_c/globals__mp2_type", "autodir_options_c/globals__mp_type", "autodir_options_c/globals__num_frozen_docc", "autodir_options_c/globals__num_frozen_uocc", "autodir_options_c/globals__parent_symmetry", "autodir_options_c/globals__pcm", "autodir_options_c/globals__pe", "autodir_options_c/globals__print", "autodir_options_c/globals__print_noons", "autodir_options_c/globals__properties", "autodir_options_c/globals__properties_origin", "autodir_options_c/globals__puream", "autodir_options_c/globals__qc_module", "autodir_options_c/globals__ras1", "autodir_options_c/globals__ras2", "autodir_options_c/globals__ras3", "autodir_options_c/globals__ras4", "autodir_options_c/globals__relativistic", "autodir_options_c/globals__restricted_docc", "autodir_options_c/globals__restricted_uocc", "autodir_options_c/globals__scf_type", "autodir_options_c/globals__screening", "autodir_options_c/globals__socc", "autodir_options_c/globals__wfn", "autodir_options_c/globals__writer_file_label", "autodir_options_c/mcscf__canonicalize_active_favg", "autodir_options_c/mcscf__canonicalize_inactive_favg", "autodir_options_c/mcscf__ci_diis", "autodir_options_c/mcscf__d_convergence", "autodir_options_c/mcscf__diis", "autodir_options_c/mcscf__diis_max_vecs", "autodir_options_c/mcscf__docc", "autodir_options_c/mcscf__e_convergence", "autodir_options_c/mcscf__favg", "autodir_options_c/mcscf__favg_start", "autodir_options_c/mcscf__follow_root", "autodir_options_c/mcscf__force_twocon", "autodir_options_c/mcscf__internal_rotations", "autodir_options_c/mcscf__level_shift", "autodir_options_c/mcscf__maxiter", "autodir_options_c/mcscf__mo_read", "autodir_options_c/mcscf__reference", "autodir_options_c/mcscf__rotate_mo_angle", "autodir_options_c/mcscf__rotate_mo_irrep", "autodir_options_c/mcscf__rotate_mo_p", "autodir_options_c/mcscf__rotate_mo_q", "autodir_options_c/mcscf__socc", "autodir_options_c/mcscf__turn_on_actv", "autodir_options_c/mcscf__wfn_sym", "autodir_options_c/mints__basis", "autodir_options_c/mints__omega_erf", "autodir_options_c/module__adc", "autodir_options_c/module__ccdensity", "autodir_options_c/module__ccenergy", "autodir_options_c/module__cceom", "autodir_options_c/module__cchbar", "autodir_options_c/module__cclambda", "autodir_options_c/module__ccresponse", "autodir_options_c/module__cctransort", "autodir_options_c/module__cctriples", "autodir_options_c/module__cfour", "autodir_options_c/module__cphf", "autodir_options_c/module__dct", "autodir_options_c/module__ddx", "autodir_options_c/module__detci", "autodir_options_c/module__dfep2", "autodir_options_c/module__dfmp2", "autodir_options_c/module__dfocc", "autodir_options_c/module__dlpno", "autodir_options_c/module__dmrg", "autodir_options_c/module__efp", "autodir_options_c/module__findif", "autodir_options_c/module__fisapt", "autodir_options_c/module__fnocc", "autodir_options_c/module__gdma", "autodir_options_c/module__globals", "autodir_options_c/module__mcscf", "autodir_options_c/module__mints", "autodir_options_c/module__mrcc", "autodir_options_c/module__occ", "autodir_options_c/module__optking", "autodir_options_c/module__pcm", "autodir_options_c/module__pe", "autodir_options_c/module__psimrcc", "autodir_options_c/module__sapt", "autodir_options_c/module__scf", "autodir_options_c/module__thermo", "autodir_options_c/mrcc__e_convergence", "autodir_options_c/mrcc__ints_tolerance", "autodir_options_c/mrcc__mrcc_level", "autodir_options_c/mrcc__mrcc_method", "autodir_options_c/mrcc__mrcc_num_doublet_roots", "autodir_options_c/mrcc__mrcc_num_singlet_roots", "autodir_options_c/mrcc__mrcc_num_triplet_roots", "autodir_options_c/mrcc__mrcc_omp_num_threads", "autodir_options_c/mrcc__mrcc_restart", "autodir_options_c/occ__cachelevel", "autodir_options_c/occ__cc_maxiter", "autodir_options_c/occ__ccl_energy", "autodir_options_c/occ__cepa_os_scale", "autodir_options_c/occ__cepa_sos_scale", "autodir_options_c/occ__cepa_ss_scale", "autodir_options_c/occ__cepa_type", "autodir_options_c/occ__cutoff", "autodir_options_c/occ__diis_max_vecs", "autodir_options_c/occ__diis_min_vecs", "autodir_options_c/occ__do_diis", "autodir_options_c/occ__do_level_shift", "autodir_options_c/occ__do_scs", "autodir_options_c/occ__do_sos", "autodir_options_c/occ__e3_scale", "autodir_options_c/occ__e_convergence", "autodir_options_c/occ__ea_poles", "autodir_options_c/occ__ekt_ea", "autodir_options_c/occ__ekt_ip", "autodir_options_c/occ__ep_ea_poles", "autodir_options_c/occ__ep_ip_poles", "autodir_options_c/occ__ep_maxiter", "autodir_options_c/occ__ip_poles", "autodir_options_c/occ__level_shift", "autodir_options_c/occ__max_mograd_convergence", "autodir_options_c/occ__mo_maxiter", "autodir_options_c/occ__mo_read", "autodir_options_c/occ__mo_step_max", "autodir_options_c/occ__mo_write", "autodir_options_c/occ__mograd_damping", "autodir_options_c/occ__mp2_os_scale", "autodir_options_c/occ__mp2_sos_scale", "autodir_options_c/occ__mp2_sos_scale2", "autodir_options_c/occ__mp2_ss_scale", "autodir_options_c/occ__nat_orbs", "autodir_options_c/occ__occ_orbs_print", "autodir_options_c/occ__oeprop", "autodir_options_c/occ__opt_method", "autodir_options_c/occ__orb_opt", "autodir_options_c/occ__orb_resp_solver", "autodir_options_c/occ__orth_type", "autodir_options_c/occ__os_scale", "autodir_options_c/occ__pcg_beta_type", "autodir_options_c/occ__pcg_convergence", "autodir_options_c/occ__pcg_maxiter", "autodir_options_c/occ__r_convergence", "autodir_options_c/occ__relaxed", "autodir_options_c/occ__remp_a", "autodir_options_c/occ__rms_mograd_convergence", "autodir_options_c/occ__scs_type", "autodir_options_c/occ__sos_type", "autodir_options_c/occ__spin_scale_type", "autodir_options_c/occ__ss_scale", "autodir_options_c/occ__symmetrize", "autodir_options_c/occ__tpdm_abcd_type", "autodir_options_c/occ__wfn_type", "autodir_options_c/optking__add_auxiliary_bonds", "autodir_options_c/optking__auxiliary_bond_factor", "autodir_options_c/optking__cart_hess_read", "autodir_options_c/optking__cartesian_sym_tolerance", "autodir_options_c/optking__consecutive_backsteps", "autodir_options_c/optking__covalent_connect", "autodir_options_c/optking__custom_coords", "autodir_options_c/optking__dynamic_level", "autodir_options_c/optking__ensure_bt_convergence", "autodir_options_c/optking__ext_force_bend", "autodir_options_c/optking__ext_force_cartesian", "autodir_options_c/optking__ext_force_dihedral", "autodir_options_c/optking__ext_force_distance", "autodir_options_c/optking__ext_force_oofp", "autodir_options_c/optking__flexible_g_convergence", "autodir_options_c/optking__frag_mode", "autodir_options_c/optking__frag_ref_atoms", "autodir_options_c/optking__freeze_all_dihedrals", "autodir_options_c/optking__freeze_interfrag", "autodir_options_c/optking__freeze_intrafrag", "autodir_options_c/optking__frozen_bend", "autodir_options_c/optking__frozen_cartesian", "autodir_options_c/optking__frozen_dihedral", "autodir_options_c/optking__frozen_distance", "autodir_options_c/optking__frozen_oofp", "autodir_options_c/optking__full_hess_every", "autodir_options_c/optking__g_convergence", "autodir_options_c/optking__geom_maxiter", "autodir_options_c/optking__h_bond_connect", "autodir_options_c/optking__h_guess_every", "autodir_options_c/optking__h_update_den_tol", "autodir_options_c/optking__hess_update", "autodir_options_c/optking__hess_update_limit", "autodir_options_c/optking__hess_update_limit_max", "autodir_options_c/optking__hess_update_limit_scale", "autodir_options_c/optking__hess_update_use_last", "autodir_options_c/optking__intcos_generate_exit", "autodir_options_c/optking__interfrag_collinear_tol", "autodir_options_c/optking__interfrag_coords", "autodir_options_c/optking__interfrag_dist_inv", "autodir_options_c/optking__interfrag_hess", "autodir_options_c/optking__interfrag_mode", "autodir_options_c/optking__interfrag_step_limit", "autodir_options_c/optking__interfragment_connect", "autodir_options_c/optking__intrafrag_hess", "autodir_options_c/optking__intrafrag_step_limit", "autodir_options_c/optking__intrafrag_step_limit_max", "autodir_options_c/optking__intrafrag_step_limit_min", "autodir_options_c/optking__irc_direction", "autodir_options_c/optking__irc_points", "autodir_options_c/optking__irc_step_size", "autodir_options_c/optking__max_disp_g_convergence", "autodir_options_c/optking__max_energy_g_convergence", "autodir_options_c/optking__max_force_g_convergence", "autodir_options_c/optking__opt_coordinates", "autodir_options_c/optking__opt_restart", "autodir_options_c/optking__opt_type", "autodir_options_c/optking__print_opt_params", "autodir_options_c/optking__print_trajectory_xyz_file", "autodir_options_c/optking__ranged_bend", "autodir_options_c/optking__ranged_dihedral", "autodir_options_c/optking__ranged_distance", "autodir_options_c/optking__ranged_oofp", "autodir_options_c/optking__rfo_follow_root", "autodir_options_c/optking__rfo_normalization_max", "autodir_options_c/optking__rfo_root", "autodir_options_c/optking__rms_disp_g_convergence", "autodir_options_c/optking__rms_force_g_convergence", "autodir_options_c/optking__rsrfo_alpha_max", "autodir_options_c/optking__save_optimization", "autodir_options_c/optking__step_type", "autodir_options_c/optking__test_b", "autodir_options_c/optking__test_derivative_b", "autodir_options_c/optking__unfreeze_dihedrals", "autodir_options_c/optking__write_opt_history", "autodir_options_c/optking__write_opt_result", "autodir_options_c/optking__write_trajectory", "autodir_options_c/pcm__pcm_cc_type", "autodir_options_c/pcm__pcm_scf_type", "autodir_options_c/pcm__pcmsolver_parsed_fname", "autodir_options_c/pe__border", "autodir_options_c/pe__border_n_redist", "autodir_options_c/pe__border_redist_order", "autodir_options_c/pe__border_redist_pol", "autodir_options_c/pe__border_rmin", "autodir_options_c/pe__border_rmin_unit", "autodir_options_c/pe__border_type", "autodir_options_c/pe__damp_induced", "autodir_options_c/pe__damp_multipole", "autodir_options_c/pe__damping_factor_induced", "autodir_options_c/pe__damping_factor_multipole", "autodir_options_c/pe__induced_convergence", "autodir_options_c/pe__isotropic_pol", "autodir_options_c/pe__maxiter", "autodir_options_c/pe__pe_ecp", "autodir_options_c/pe__potfile", "autodir_options_c/pe__summation_fields", "autodir_options_c/pe__tree_expansion_order", "autodir_options_c/pe__tree_theta", "autodir_options_c/psimrcc__cc_num_threads", "autodir_options_c/psimrcc__corr_ansatz", "autodir_options_c/psimrcc__corr_ccsd_t", "autodir_options_c/psimrcc__corr_charge", "autodir_options_c/psimrcc__corr_multp", "autodir_options_c/psimrcc__corr_wfn", "autodir_options_c/psimrcc__coupling", "autodir_options_c/psimrcc__coupling_terms", "autodir_options_c/psimrcc__damping_percentage", "autodir_options_c/psimrcc__diagonal_ccsd_t", "autodir_options_c/psimrcc__diagonalize_heff", "autodir_options_c/psimrcc__diis_max_vecs", "autodir_options_c/psimrcc__diis_start", "autodir_options_c/psimrcc__e_convergence", "autodir_options_c/psimrcc__favg_ccsd_t", "autodir_options_c/psimrcc__follow_root", "autodir_options_c/psimrcc__heff4", "autodir_options_c/psimrcc__heff_print", "autodir_options_c/psimrcc__lock_singlet", "autodir_options_c/psimrcc__maxiter", "autodir_options_c/psimrcc__mp2_ccsd_method", "autodir_options_c/psimrcc__mp2_guess", "autodir_options_c/psimrcc__no_singles", "autodir_options_c/psimrcc__offdiagonal_ccsd_t", "autodir_options_c/psimrcc__perturb_cbs", "autodir_options_c/psimrcc__perturb_cbs_coupling", "autodir_options_c/psimrcc__pt_energy", "autodir_options_c/psimrcc__r_convergence", "autodir_options_c/psimrcc__small_cutoff", "autodir_options_c/psimrcc__tikhonow_max", "autodir_options_c/psimrcc__tikhonow_omega", "autodir_options_c/psimrcc__tikhonow_triples", "autodir_options_c/psimrcc__triples_algorithm", "autodir_options_c/psimrcc__triples_diis", "autodir_options_c/psimrcc__use_spin_sym", "autodir_options_c/psimrcc__use_spin_symmetry", "autodir_options_c/psimrcc__wfn_sym", "autodir_options_c/psimrcc__zero_internal_amps", "autodir_options_c/sapt__aio_cphf", "autodir_options_c/sapt__aio_df_ints", "autodir_options_c/sapt__basis", "autodir_options_c/sapt__ccd_e_convergence", "autodir_options_c/sapt__ccd_maxiter", "autodir_options_c/sapt__ccd_t_convergence", "autodir_options_c/sapt__coupled_induction", "autodir_options_c/sapt__cphf_r_convergence", "autodir_options_c/sapt__denominator_algorithm", "autodir_options_c/sapt__denominator_delta", "autodir_options_c/sapt__df_basis_elst", "autodir_options_c/sapt__df_basis_sapt", "autodir_options_c/sapt__do_ccd_disp", "autodir_options_c/sapt__do_disp_exch_sinf", "autodir_options_c/sapt__do_ind30_exch_sinf", "autodir_options_c/sapt__do_ind_exch_sinf", "autodir_options_c/sapt__do_mbpt_disp", "autodir_options_c/sapt__do_third_order", "autodir_options_c/sapt__exch_scale_alpha", "autodir_options_c/sapt__freeze_core", "autodir_options_c/sapt__ints_tolerance", "autodir_options_c/sapt__max_ccd_diisvecs", "autodir_options_c/sapt__maxiter", "autodir_options_c/sapt__min_ccd_diisvecs", "autodir_options_c/sapt__nat_orbs_t2", "autodir_options_c/sapt__nat_orbs_t3", "autodir_options_c/sapt__nat_orbs_v4", "autodir_options_c/sapt__occ_tolerance", "autodir_options_c/sapt__print", "autodir_options_c/sapt__sapt0_e10", "autodir_options_c/sapt__sapt0_e20disp", "autodir_options_c/sapt__sapt0_e20ind", "autodir_options_c/sapt__sapt_dft_do_dhf", "autodir_options_c/sapt__sapt_dft_do_hybrid", "autodir_options_c/sapt__sapt_dft_exch_disp_fixed_scale", "autodir_options_c/sapt__sapt_dft_exch_disp_scale_scheme", "autodir_options_c/sapt__sapt_dft_functional", "autodir_options_c/sapt__sapt_dft_grac_determination", "autodir_options_c/sapt__sapt_dft_grac_shift_a", "autodir_options_c/sapt__sapt_dft_grac_shift_b", "autodir_options_c/sapt__sapt_dft_mp2_disp_alg", "autodir_options_c/sapt__sapt_fdds_disp_leg_lambda", "autodir_options_c/sapt__sapt_fdds_disp_num_points", "autodir_options_c/sapt__sapt_fdds_v2_rho_cutoff", "autodir_options_c/sapt__sapt_level", "autodir_options_c/sapt__sapt_mem_check", "autodir_options_c/sapt__sapt_mem_factor", "autodir_options_c/sapt__sapt_mem_safety", "autodir_options_c/sapt__sapt_quiet", "autodir_options_c/scf__basis", "autodir_options_c/scf__basis_guess", "autodir_options_c/scf__cholesky_tolerance", "autodir_options_c/scf__cosx_basis_tolerance", "autodir_options_c/scf__cosx_density_tolerance", "autodir_options_c/scf__cosx_ints_tolerance", "autodir_options_c/scf__cosx_maxiter_final", "autodir_options_c/scf__cosx_overlap_fitting", "autodir_options_c/scf__cosx_pruning_scheme", "autodir_options_c/scf__cosx_radial_points_final", "autodir_options_c/scf__cosx_radial_points_initial", "autodir_options_c/scf__cosx_spherical_points_final", "autodir_options_c/scf__cosx_spherical_points_initial", "autodir_options_c/scf__d_convergence", "autodir_options_c/scf__damping_convergence", "autodir_options_c/scf__damping_percentage", "autodir_options_c/scf__df_basis_guess", "autodir_options_c/scf__df_basis_sad", "autodir_options_c/scf__df_basis_scf", "autodir_options_c/scf__df_bump_r0", "autodir_options_c/scf__df_bump_r1", "autodir_options_c/scf__df_domains", "autodir_options_c/scf__df_fitting_condition", "autodir_options_c/scf__df_ints_io", "autodir_options_c/scf__df_ints_num_threads", "autodir_options_c/scf__df_metric", "autodir_options_c/scf__df_scf_guess", "autodir_options_c/scf__df_theta", "autodir_options_c/scf__dft_alpha", "autodir_options_c/scf__dft_alpha_c", "autodir_options_c/scf__dft_basis_tolerance", "autodir_options_c/scf__dft_block_max_points", "autodir_options_c/scf__dft_block_max_radius", "autodir_options_c/scf__dft_block_min_points", "autodir_options_c/scf__dft_block_scheme", "autodir_options_c/scf__dft_bs_radius_alpha", "autodir_options_c/scf__dft_density_tolerance", "autodir_options_c/scf__dft_dispersion_parameters", "autodir_options_c/scf__dft_grac_alpha", "autodir_options_c/scf__dft_grac_beta", "autodir_options_c/scf__dft_grac_c_func", "autodir_options_c/scf__dft_grac_shift", "autodir_options_c/scf__dft_grac_x_func", "autodir_options_c/scf__dft_grid_name", "autodir_options_c/scf__dft_nuclear_scheme", "autodir_options_c/scf__dft_omega", "autodir_options_c/scf__dft_omega_c", "autodir_options_c/scf__dft_pruning_alpha", "autodir_options_c/scf__dft_pruning_scheme", "autodir_options_c/scf__dft_radial_points", "autodir_options_c/scf__dft_radial_scheme", "autodir_options_c/scf__dft_remove_distant_points", "autodir_options_c/scf__dft_spherical_points", "autodir_options_c/scf__dft_spherical_scheme", "autodir_options_c/scf__dft_v2_rho_cutoff", "autodir_options_c/scf__dft_vv10_b", "autodir_options_c/scf__dft_vv10_c", "autodir_options_c/scf__dft_vv10_postscf", "autodir_options_c/scf__dft_vv10_radial_points", "autodir_options_c/scf__dft_vv10_rho_cutoff", "autodir_options_c/scf__dft_vv10_spherical_points", "autodir_options_c/scf__dft_weights_tolerance", "autodir_options_c/scf__diis", "autodir_options_c/scf__diis_max_vecs", "autodir_options_c/scf__diis_min_vecs", "autodir_options_c/scf__diis_rms_error", "autodir_options_c/scf__diis_start", "autodir_options_c/scf__distributed_matrix", "autodir_options_c/scf__e_convergence", "autodir_options_c/scf__extern", "autodir_options_c/scf__fail_on_maxiter", "autodir_options_c/scf__follow_step_increment", "autodir_options_c/scf__follow_step_scale", "autodir_options_c/scf__frac_diis", "autodir_options_c/scf__frac_load", "autodir_options_c/scf__frac_occ", "autodir_options_c/scf__frac_renormalize", "autodir_options_c/scf__frac_start", "autodir_options_c/scf__frac_val", "autodir_options_c/scf__guess", "autodir_options_c/scf__guess_mix", "autodir_options_c/scf__guess_persist", "autodir_options_c/scf__incfock", "autodir_options_c/scf__incfock_convergence", "autodir_options_c/scf__incfock_full_fock_every", "autodir_options_c/scf__ints_tolerance", "autodir_options_c/scf__level_shift", "autodir_options_c/scf__level_shift_cutoff", "autodir_options_c/scf__link_ints_tolerance", "autodir_options_c/scf__local_convergence", "autodir_options_c/scf__local_maxiter", "autodir_options_c/scf__max_attempts", "autodir_options_c/scf__max_mem_buf", "autodir_options_c/scf__maxiter", "autodir_options_c/scf__molden_write", "autodir_options_c/scf__mom_occ", "autodir_options_c/scf__mom_start", "autodir_options_c/scf__mom_vir", "autodir_options_c/scf__nl_dispersion_parameters", "autodir_options_c/scf__onepot_grid_read", "autodir_options_c/scf__orbitals_write", "autodir_options_c/scf__parallel", "autodir_options_c/scf__perturb_dipole", "autodir_options_c/scf__perturb_h", "autodir_options_c/scf__perturb_magnitude", "autodir_options_c/scf__perturb_with", "autodir_options_c/scf__phi_points", "autodir_options_c/scf__pk_all_nonsym", "autodir_options_c/scf__pk_max_buckets", "autodir_options_c/scf__print_basis", "autodir_options_c/scf__print_mos", "autodir_options_c/scf__process_grid", "autodir_options_c/scf__qchf", "autodir_options_c/scf__r_points", "autodir_options_c/scf__radius", "autodir_options_c/scf__reference", "autodir_options_c/scf__s_cholesky_tolerance", "autodir_options_c/scf__s_orthogonalization", "autodir_options_c/scf__s_tolerance", "autodir_options_c/scf__sad_chol_tolerance", "autodir_options_c/scf__sad_d_convergence", "autodir_options_c/scf__sad_e_convergence", "autodir_options_c/scf__sad_frac_occ", "autodir_options_c/scf__sad_maxiter", "autodir_options_c/scf__sad_print", "autodir_options_c/scf__sad_scf_type", "autodir_options_c/scf__sad_spin_average", "autodir_options_c/scf__sapgau_basis", "autodir_options_c/scf__sapt", "autodir_options_c/scf__save_jk", "autodir_options_c/scf__save_uhf_nos", "autodir_options_c/scf__scf_initial_accelerator", "autodir_options_c/scf__scf_initial_finish_diis_transition", "autodir_options_c/scf__scf_initial_start_diis_transition", "autodir_options_c/scf__scf_mem_safety_factor", "autodir_options_c/scf__scf_properties", "autodir_options_c/scf__scf_subtype", "autodir_options_c/scf__snlink_basis_tolerance", "autodir_options_c/scf__snlink_density_tolerance", "autodir_options_c/scf__snlink_force_cartesian", "autodir_options_c/scf__snlink_gpu_mem", "autodir_options_c/scf__snlink_grid_batch_size", "autodir_options_c/scf__snlink_integrator_kernel", "autodir_options_c/scf__snlink_ints_tolerance", "autodir_options_c/scf__snlink_load_balancer_kernel", "autodir_options_c/scf__snlink_lwd_kernel", "autodir_options_c/scf__snlink_mol_weights_kernel", "autodir_options_c/scf__snlink_pruning_scheme", "autodir_options_c/scf__snlink_radial_points", "autodir_options_c/scf__snlink_radial_scheme", "autodir_options_c/scf__snlink_reduction_kernel", "autodir_options_c/scf__snlink_spherical_points", "autodir_options_c/scf__snlink_use_debug_grid", "autodir_options_c/scf__snlink_use_gpu", "autodir_options_c/scf__solver_convergence", "autodir_options_c/scf__solver_maxiter", "autodir_options_c/scf__solver_n_guess", "autodir_options_c/scf__solver_n_root", "autodir_options_c/scf__solver_roots_per_irrep", "autodir_options_c/scf__soscf", "autodir_options_c/scf__soscf_conv", "autodir_options_c/scf__soscf_max_iter", "autodir_options_c/scf__soscf_min_iter", "autodir_options_c/scf__soscf_print", "autodir_options_c/scf__soscf_start_convergence", "autodir_options_c/scf__stability_analysis", "autodir_options_c/scf__tdscf_coeff_cutoff", "autodir_options_c/scf__tdscf_guess", "autodir_options_c/scf__tdscf_maxiter", "autodir_options_c/scf__tdscf_print", "autodir_options_c/scf__tdscf_r_convergence", "autodir_options_c/scf__tdscf_states", "autodir_options_c/scf__tdscf_tda", "autodir_options_c/scf__tdscf_tdm_print", "autodir_options_c/scf__tdscf_triplets", "autodir_options_c/scf__theta_points", "autodir_options_c/scf__thickness", "autodir_options_c/scf__tile_sz", "autodir_options_c/scf__uhf_noons", "autodir_options_c/scf__wcombine", "autodir_options_c/scf__wfn", "autodir_options_c/thermo__p", "autodir_options_c/thermo__rotational_symmetry_number", "autodir_options_c/thermo__t", "autodir_psivariables/module__adc", "autodir_psivariables/module__ccenergy", "autodir_psivariables/module__cfour", "autodir_psivariables/module__dct", "autodir_psivariables/module__ddx", "autodir_psivariables/module__detci", "autodir_psivariables/module__dfmp2", "autodir_psivariables/module__dfocc", "autodir_psivariables/module__dlpno", "autodir_psivariables/module__dmrg", "autodir_psivariables/module__efp", "autodir_psivariables/module__fisapt", "autodir_psivariables/module__fnocc", "autodir_psivariables/module__gdma", "autodir_psivariables/module__mcscf", "autodir_psivariables/module__mrcc", "autodir_psivariables/module__occ", "autodir_psivariables/module__oeprop", "autodir_psivariables/module__pcm", "autodir_psivariables/module__pe", "autodir_psivariables/module__psimrcc", "autodir_psivariables/module__sapt", "autodir_psivariables/module__scf", "autodir_psivariables/module__thermo", "autodoc_available_databases", "autodoc_available_efpfrag", "autodoc_basissets_byfamily", "autodoc_dft_all", "autodoc_dft_dhybrid", "autodoc_dft_disp", "autodoc_dft_energy", "autodoc_dft_gga", "autodoc_dft_hybrid", "autodoc_dft_lrc", "autodoc_dft_meta", "autodoc_dft_opt", "autodoc_glossary_options_c", "autodoc_options_c_bymodule", "autodoc_physconst", "autodoc_psi4bases", "autodoc_psifiles", "autodoc_psivariables_bymodule", "autodoc_testsuite_brianqc", "autodoc_testsuite_cfour", "autodoc_testsuite_chemps2", "autodoc_testsuite_cookbook", "autodoc_testsuite_corepsi4", "autodoc_testsuite_dftd3", "autodoc_testsuite_dftd4", "autodoc_testsuite_dkh", "autodoc_testsuite_gcp", "autodoc_testsuite_gdma", "autodoc_testsuite_gpu_dfcc", "autodoc_testsuite_json", "autodoc_testsuite_libefp", "autodoc_testsuite_mrcc", "autodoc_testsuite_pcmsolver", "autodoc_testsuite_psi4numpy", "autodoc_testsuite_python", "autodoc_testsuite_simint", "autodoc_testsuite_snsmp2", "autodoc_testsuite_v2rdm_casscf", "basissets", "basissets_byelement", "basissets_byfamily", "basissets_tables", "bibliography", "brianqc", "build_faq", "build_obtaining", "build_planning", "capabilities", "cbs", "cbs_eqn", "cc", "cfour", "cfour_table_energy", "cfour_table_grad", "chemps2", "code_style", "conda", "cppe", "cubeprop", "customizing", "db", "dct", "ddx", "detci", "dfmp2", "dft", "dft_byfunctional", "dftd3", "dftnl", "diatomic", "dkh", "dlpnomp2", "documentation", "ecpint", "energy", "external", "external_apis", "fchk", "fisapt", "fnocc", "freq", "gau2grid", "gcp", "gdma", "glossary_psivariables", "index", "index_tutorials", "intercalls", "interfacing", "introduction", "libefp", "libint", "libxc", "manage_addon", "manage_git", "manage_index", "manage_release", "mcscf", "methods", "molden", "mrcc", "mrcc_table_energy", "nbody", "notes_c", "notes_py", "numpy", "occ", "oeprop", "opt", "optionshandling", "optking", "pcmsolver", "pep0001", "plugin_psi4fockci", "plugin_snsmp2", "plugin_v2rdm_casscf", "plugins", "proc_py", "prog_blas", "prog_conduct", "prog_corelibs", "prog_debug_profile", "prog_faq", "prog_full_integration", "prog_help", "prog_integrals", "prog_intro", "prog_newcode", "prog_setup", "prog_style_c", "prog_style_py", "prog_tour", "prog_ways_to_add", "prog_welcome", "prop", "psi4api", "psiapi", "psimrcc", "psipep", "psithonfunc", "psithoninput", "psithonmol", "quickaddalias", "quickadddatabase", "relativistic", "sapt", "scf", "simint", "sowreap", "tdscf", "testsuite", "thermo", "tutorial"], "envversion": {"nbsphinx": 4, "sphinx": 62, "sphinx.domains.c": 3, "sphinx.domains.changeset": 1, "sphinx.domains.citation": 1, "sphinx.domains.cpp": 9, "sphinx.domains.index": 1, "sphinx.domains.javascript": 3, "sphinx.domains.math": 2, "sphinx.domains.python": 4, "sphinx.domains.rst": 2, "sphinx.domains.std": 2, "sphinx.ext.intersphinx": 1, "sphinx.ext.viewcode": 1}, "filenames": ["adc.rst", "adcc.rst", "add_tests.rst", "api/psi4.core.AOShellCombinationsIterator.rst", "api/psi4.core.AngularMomentumInt.rst", "api/psi4.core.BSVec.rst", "api/psi4.core.BasisExtents.rst", "api/psi4.core.BasisFunctions.rst", "api/psi4.core.BasisSet.rst", "api/psi4.core.BlockOPoints.rst", "api/psi4.core.BoysLocalizer.rst", "api/psi4.core.CCWavefunction.rst", "api/psi4.core.CIVector.rst", "api/psi4.core.CIWavefunction.rst", "api/psi4.core.CUHF.rst", "api/psi4.core.CdSalc.rst", "api/psi4.core.CdSalcList.rst", "api/psi4.core.CharacterTable.rst", "api/psi4.core.CompositeJK.rst", "api/psi4.core.CorrelationFactor.rst", "api/psi4.core.CorrelationTable.rst", "api/psi4.core.CubeProperties.rst", "api/psi4.core.DASUM.rst", "api/psi4.core.DAXPY.rst", "api/psi4.core.DCOPY.rst", "api/psi4.core.DDOT.rst", "api/psi4.core.DFEP2Wavefunction.rst", "api/psi4.core.DFHelper.rst", "api/psi4.core.DFSOMCSCF.rst", "api/psi4.core.DFTGrid.rst", "api/psi4.core.DFTensor.rst", "api/psi4.core.DGBMV.rst", "api/psi4.core.DGEEV.rst", "api/psi4.core.DGEMM.rst", "api/psi4.core.DGEMV.rst", "api/psi4.core.DGER.rst", "api/psi4.core.DGETRF.rst", "api/psi4.core.DGETRI.rst", "api/psi4.core.DGETRS.rst", "api/psi4.core.DNRM2.rst", "api/psi4.core.DPOTRF.rst", "api/psi4.core.DPOTRI.rst", "api/psi4.core.DPOTRS.rst", "api/psi4.core.DROT.rst", "api/psi4.core.DSBMV.rst", "api/psi4.core.DSCAL.rst", "api/psi4.core.DSWAP.rst", "api/psi4.core.DSYEV.rst", "api/psi4.core.DSYMM.rst", "api/psi4.core.DSYMV.rst", "api/psi4.core.DSYR.rst", "api/psi4.core.DSYR2.rst", "api/psi4.core.DSYR2K.rst", "api/psi4.core.DSYRK.rst", "api/psi4.core.DSYSV.rst", "api/psi4.core.DTBMV.rst", "api/psi4.core.DTBSV.rst", "api/psi4.core.DTRMM.rst", "api/psi4.core.DTRMV.rst", "api/psi4.core.DTRSM.rst", "api/psi4.core.DTRSV.rst", "api/psi4.core.Deriv.rst", "api/psi4.core.DerivCalcType.rst", "api/psi4.core.DiagonalizeOrder.rst", "api/psi4.core.Dimension.rst", "api/psi4.core.DipoleInt.rst", "api/psi4.core.DirectJK.rst", "api/psi4.core.DiskSOMCSCF.rst", "api/psi4.core.Dispersion.rst", "api/psi4.core.ERI.rst", "api/psi4.core.ESPPropCalc.rst", "api/psi4.core.ElectricFieldInt.rst", "api/psi4.core.ElectrostaticInt.rst", "api/psi4.core.ExternalPotential.rst", "api/psi4.core.FCHKWriter.rst", "api/psi4.core.FDDS_Dispersion.rst", "api/psi4.core.FISAPT.rst", "api/psi4.core.FittedSlaterCorrelationFactor.rst", "api/psi4.core.FittingMetric.rst", "api/psi4.core.FragmentType.rst", "api/psi4.core.Functional.rst", "api/psi4.core.GaussianShell.rst", "api/psi4.core.GaussianType.rst", "api/psi4.core.GeometryUnits.rst", "api/psi4.core.HF.rst", "api/psi4.core.IDAMAX.rst", "api/psi4.core.IO.rst", "api/psi4.core.IOManager.rst", "api/psi4.core.IntVector.rst", "api/psi4.core.IntegralFactory.rst", "api/psi4.core.IntegralTransform.rst", "api/psi4.core.IrreducibleRepresentation.rst", "api/psi4.core.JK.rst", "api/psi4.core.KineticInt.rst", "api/psi4.core.LS_THC_Computer.rst", "api/psi4.core.LaplaceDenominator.rst", "api/psi4.core.LibXCFunctional.rst", "api/psi4.core.Localizer.rst", "api/psi4.core.MOSpace.rst", "api/psi4.core.MOWriter.rst", "api/psi4.core.Matrix.rst", "api/psi4.core.MatrixFactory.rst", "api/psi4.core.MemDFJK.rst", "api/psi4.core.MintsHelper.rst", "api/psi4.core.MoldenWriter.rst", "api/psi4.core.MolecularGrid.rst", "api/psi4.core.Molecule.rst", "api/psi4.core.MultipoleInt.rst", "api/psi4.core.MultipoleSymmetry.rst", "api/psi4.core.NablaInt.rst", "api/psi4.core.NumIntHelper.rst", "api/psi4.core.OEProp.rst", "api/psi4.core.OneBodyAOInt.rst", "api/psi4.core.OneBodySOInt.rst", "api/psi4.core.Options.rst", "api/psi4.core.OrbitalSpace.rst", "api/psi4.core.OverlapInt.rst", "api/psi4.core.PMLocalizer.rst", "api/psi4.core.PetiteList.rst", "api/psi4.core.PointFunctions.rst", "api/psi4.core.PointGroup.rst", "api/psi4.core.PotentialInt.rst", "api/psi4.core.PrimitiveType.rst", "api/psi4.core.Prop.rst", "api/psi4.core.ProtoIntVector.rst", "api/psi4.core.ProtoVector.rst", "api/psi4.core.PsiReturnType.rst", "api/psi4.core.QuadrupoleInt.rst", "api/psi4.core.RHF.rst", "api/psi4.core.RKSFunctions.rst", "api/psi4.core.ROHF.rst", "api/psi4.core.SADGuess.rst", "api/psi4.core.SOBasisSet.rst", "api/psi4.core.SOMCSCF.rst", "api/psi4.core.SalcComponent.rst", "api/psi4.core.SaveType.rst", "api/psi4.core.ShellInfo.rst", "api/psi4.core.Slice.rst", "api/psi4.core.SuperFunctional.rst", "api/psi4.core.SymmetryOperation.rst", "api/psi4.core.TLaplaceDenominator.rst", "api/psi4.core.ThreeCenterOverlapInt.rst", "api/psi4.core.TracelessQuadrupoleInt.rst", "api/psi4.core.TwoBodyAOInt.rst", "api/psi4.core.TwoElectronInt.rst", "api/psi4.core.UHF.rst", "api/psi4.core.UKSFunctions.rst", "api/psi4.core.VBase.rst", "api/psi4.core.Vector.rst", "api/psi4.core.Vector3.rst", "api/psi4.core.Wavefunction.rst", "api/psi4.core.array_variable.rst", "api/psi4.core.array_variables.rst", "api/psi4.core.be_quiet.rst", "api/psi4.core.benchmark_blas1.rst", "api/psi4.core.benchmark_blas2.rst", "api/psi4.core.benchmark_blas3.rst", "api/psi4.core.benchmark_disk.rst", "api/psi4.core.benchmark_integrals.rst", "api/psi4.core.benchmark_math.rst", "api/psi4.core.ccdensity.rst", "api/psi4.core.ccenergy.rst", "api/psi4.core.cceom.rst", "api/psi4.core.cchbar.rst", "api/psi4.core.cclambda.rst", "api/psi4.core.ccresponse.rst", "api/psi4.core.cctransort.rst", "api/psi4.core.cctriples.rst", "api/psi4.core.clean.rst", "api/psi4.core.clean_options.rst", "api/psi4.core.clean_timers.rst", "api/psi4.core.clean_variables.rst", "api/psi4.core.close_outfile.rst", "api/psi4.core.dct.rst", "api/psi4.core.del_array_variable.rst", "api/psi4.core.del_scalar_variable.rst", "api/psi4.core.del_variable.rst", "api/psi4.core.detci.rst", "api/psi4.core.dfmp2.rst", "api/psi4.core.dfocc.rst", "api/psi4.core.dlpno.rst", "api/psi4.core.dmrg.rst", "api/psi4.core.doublet.rst", "api/psi4.core.dpdbuf4.rst", "api/psi4.core.dpdfile2.rst", "api/psi4.core.dummy_einsums.rst", "api/psi4.core.dummy_integratorxx.rst", "api/psi4.core.fcidump_tei_helper.rst", "api/psi4.core.finalize.rst", "api/psi4.core.flush_outfile.rst", "api/psi4.core.fnocc.rst", "api/psi4.core.get_active_molecule.rst", "api/psi4.core.get_array_variable.rst", "api/psi4.core.get_array_variables.rst", "api/psi4.core.get_datadir.rst", "api/psi4.core.get_global_option.rst", "api/psi4.core.get_global_option_list.rst", "api/psi4.core.get_local_option.rst", "api/psi4.core.get_memory.rst", "api/psi4.core.get_num_threads.rst", "api/psi4.core.get_option.rst", "api/psi4.core.get_options.rst", "api/psi4.core.get_output_file.rst", "api/psi4.core.get_variable.rst", "api/psi4.core.get_variables.rst", "api/psi4.core.get_writer_file_prefix.rst", "api/psi4.core.git_version.rst", "api/psi4.core.has_array_variable.rst", "api/psi4.core.has_global_option_changed.rst", "api/psi4.core.has_local_option_changed.rst", "api/psi4.core.has_option_changed.rst", "api/psi4.core.has_scalar_variable.rst", "api/psi4.core.has_variable.rst", "api/psi4.core.initialize.rst", "api/psi4.core.libint2_solid_harmonics_ordering.rst", "api/psi4.core.mcscf.rst", "api/psi4.core.mrcc_generate_input.rst", "api/psi4.core.mrcc_load_densities.rst", "api/psi4.core.occ.rst", "api/psi4.core.option_exists_in_module.rst", "api/psi4.core.options_to_python.rst", "api/psi4.core.outfile_name.rst", "api/psi4.core.plugin.rst", "api/psi4.core.plugin_close.rst", "api/psi4.core.plugin_close_all.rst", "api/psi4.core.plugin_load.rst", "api/psi4.core.prepare_options_for_module.rst", "api/psi4.core.print_global_options.rst", "api/psi4.core.print_options.rst", "api/psi4.core.print_out.rst", "api/psi4.core.print_variables.rst", "api/psi4.core.psi_top_srcdir.rst", "api/psi4.core.psimrcc.rst", "api/psi4.core.psio_entry.rst", "api/psi4.core.reopen_outfile.rst", "api/psi4.core.revoke_global_option_changed.rst", "api/psi4.core.revoke_local_option_changed.rst", "api/psi4.core.sapt.rst", "api/psi4.core.scalar_variable.rst", "api/psi4.core.scalar_variables.rst", "api/psi4.core.scatter.rst", "api/psi4.core.scfgrad.rst", "api/psi4.core.scfhess.rst", "api/psi4.core.set_active_molecule.rst", "api/psi4.core.set_array_variable.rst", "api/psi4.core.set_datadir.rst", "api/psi4.core.set_global_option.rst", "api/psi4.core.set_global_option_python.rst", "api/psi4.core.set_local_option.rst", "api/psi4.core.set_local_option_python.rst", "api/psi4.core.set_memory_bytes.rst", "api/psi4.core.set_num_threads.rst", "api/psi4.core.set_output_file.rst", "api/psi4.core.set_psi_file_prefix.rst", "api/psi4.core.set_scalar_variable.rst", "api/psi4.core.set_variable.rst", "api/psi4.core.test_matrix_dpd_interface.rst", "api/psi4.core.timer_off.rst", "api/psi4.core.timer_on.rst", "api/psi4.core.triplet.rst", "api/psi4.core.tstart.rst", "api/psi4.core.tstop.rst", "api/psi4.core.variable.rst", "api/psi4.core.variables.rst", "api/psi4.core.version.rst", "api/psi4.driver.AtomicComputer.rst", "api/psi4.driver.ConvergenceError.rst", "api/psi4.driver.EmpiricalDispersion.rst", "api/psi4.driver.ManagedMethodError.rst", "api/psi4.driver.MissingMethodError.rst", "api/psi4.driver.OptimizationConvergenceError.rst", "api/psi4.driver.ParsingError.rst", "api/psi4.driver.PastureRequiredError.rst", "api/psi4.driver.PsiException.rst", "api/psi4.driver.QMMM.rst", "api/psi4.driver.QMMMbohr.rst", "api/psi4.driver.SCFConvergenceError.rst", "api/psi4.driver.TDSCFConvergenceError.rst", "api/psi4.driver.TestComparisonError.rst", "api/psi4.driver.UpgradeHelper.rst", "api/psi4.driver.ValidationError.rst", "api/psi4.driver.activate.rst", "api/psi4.driver.banner.rst", "api/psi4.driver.basis_helper.rst", "api/psi4.driver.cbs.rst", "api/psi4.driver.compare_fchkfiles.rst", "api/psi4.driver.compare_fcidumps.rst", "api/psi4.driver.compare_moldenfiles.rst", "api/psi4.driver.copy_file_from_scratch.rst", "api/psi4.driver.copy_file_to_scratch.rst", "api/psi4.driver.create_plugin.rst", "api/psi4.driver.cubeprop.rst", "api/psi4.driver.docs_table_link.rst", "api/psi4.driver.dynamic_variable_bind.rst", "api/psi4.driver.energies_from_fcidump.rst", "api/psi4.driver.energy.rst", "api/psi4.driver.fchk.rst", "api/psi4.driver.fcidump.rst", "api/psi4.driver.fcidump_from_file.rst", "api/psi4.driver.find_approximate_string_matches.rst", "api/psi4.driver.freq.rst", "api/psi4.driver.frequencies.rst", "api/psi4.driver.frequency.rst", "api/psi4.driver.gdma.rst", "api/psi4.driver.geometry.rst", "api/psi4.driver.get_memory.rst", "api/psi4.driver.gradient.rst", "api/psi4.driver.hessian.rst", "api/psi4.driver.ipi_broker.rst", "api/psi4.driver.levenshtein.rst", "api/psi4.driver.libint2_configuration.rst", "api/psi4.driver.libint2_print_out.rst", "api/psi4.driver.mdi_run.rst", "api/psi4.driver.message_box.rst", "api/psi4.driver.molden.rst", "api/psi4.driver.molecule_get_attr.rst", "api/psi4.driver.molecule_set_attr.rst", "api/psi4.driver.oeprop.rst", "api/psi4.driver.opt.rst", "api/psi4.driver.optimize.rst", "api/psi4.driver.optimize_geometric.rst", "api/psi4.driver.p4util.DIIS.rst", "api/psi4.driver.p4util.Gaussian.rst", "api/psi4.driver.p4util.InPsight.rst", "api/psi4.driver.p4util.Lineshape.rst", "api/psi4.driver.p4util.Lorentzian.rst", "api/psi4.driver.p4util.OptionState.rst", "api/psi4.driver.p4util.OptionsState.rst", "api/psi4.driver.p4util.OptionsStateCM.rst", "api/psi4.driver.p4util.SolverEngine.rst", "api/psi4.driver.p4util.all_casings.rst", "api/psi4.driver.p4util.array_to_matrix.rst", "api/psi4.driver.p4util.banner.rst", "api/psi4.driver.p4util.basis_helper.rst", "api/psi4.driver.p4util.block_diagonal_array.rst", "api/psi4.driver.p4util.cg_solver.rst", "api/psi4.driver.p4util.compare_fchkfiles.rst", "api/psi4.driver.p4util.compare_fcidumps.rst", "api/psi4.driver.p4util.compare_moldenfiles.rst", "api/psi4.driver.p4util.copy_file_from_scratch.rst", "api/psi4.driver.p4util.copy_file_to_scratch.rst", "api/psi4.driver.p4util.cubeprop.rst", "api/psi4.driver.p4util.davidson_solver.rst", "api/psi4.driver.p4util.docs_table_link.rst", "api/psi4.driver.p4util.drop_duplicates.rst", "api/psi4.driver.p4util.energies_from_fcidump.rst", "api/psi4.driver.p4util.expand_psivars.rst", "api/psi4.driver.p4util.fcidump.rst", "api/psi4.driver.p4util.fcidump_from_file.rst", "api/psi4.driver.p4util.find_approximate_string_matches.rst", "api/psi4.driver.p4util.format_molecule_for_input.rst", "api/psi4.driver.p4util.format_options_for_input.rst", "api/psi4.driver.p4util.free_atom_volumes.rst", "api/psi4.driver.p4util.get_memory.rst", "api/psi4.driver.p4util.get_psifile.rst", "api/psi4.driver.p4util.getattr_ignorecase.rst", "api/psi4.driver.p4util.hamiltonian_solver.rst", "api/psi4.driver.p4util.hold_options_state.rst", "api/psi4.driver.p4util.import_ignorecase.rst", "api/psi4.driver.p4util.kwargs_lower.rst", "api/psi4.driver.p4util.levenshtein.rst", "api/psi4.driver.p4util.libint2_configuration.rst", "api/psi4.driver.p4util.libint2_print_out.rst", "api/psi4.driver.p4util.mat2arr.rst", "api/psi4.driver.p4util.message_box.rst", "api/psi4.driver.p4util.oeprop.rst", "api/psi4.driver.p4util.pcm_helper.rst", "api/psi4.driver.p4util.plump_qcvar.rst", "api/psi4.driver.p4util.prefactor_ecd.rst", "api/psi4.driver.p4util.prefactor_opa.rst", "api/psi4.driver.p4util.prepare_options_for_modules.rst", "api/psi4.driver.p4util.prepare_options_for_set_options.rst", "api/psi4.driver.p4util.provenance_stamp.rst", "api/psi4.driver.p4util.sanitize_method.rst", "api/psi4.driver.p4util.set_memory.rst", "api/psi4.driver.p4util.set_module_options.rst", "api/psi4.driver.p4util.set_options.rst", "api/psi4.driver.p4util.spectrum.rst", "api/psi4.driver.p4util.state_to_atomicinput.rst", "api/psi4.driver.pcm_helper.rst", "api/psi4.driver.process_input.rst", "api/psi4.driver.prop.rst", "api/psi4.driver.properties.rst", "api/psi4.driver.qcdb.vib.compare_vibinfos.rst", "api/psi4.driver.qcdb.vib.filter_nonvib.rst", "api/psi4.driver.qcdb.vib.filter_omega_to_real.rst", "api/psi4.driver.qcdb.vib.harmonic_analysis.rst", "api/psi4.driver.qcdb.vib.hessian_symmetrize.rst", "api/psi4.driver.qcdb.vib.print_molden_vibs.rst", "api/psi4.driver.qcdb.vib.print_vibs.rst", "api/psi4.driver.qcdb.vib.thermo.rst", "api/psi4.driver.sanitize_method.rst", "api/psi4.driver.sanitize_name.rst", "api/psi4.driver.scf_helper.rst", "api/psi4.driver.scf_wavefunction_factory.rst", "api/psi4.driver.set_memory.rst", "api/psi4.driver.set_module_options.rst", "api/psi4.driver.set_options.rst", "api/psi4.driver.tdscf.rst", "api/psi4.driver.vibanal_wfn.rst", "appendices.rst", "autodir_options_c/adc__cutoff_amps_print.rst", "autodir_options_c/adc__gauge.rst", "autodir_options_c/adc__kind.rst", "autodir_options_c/adc__max_num_vecs.rst", "autodir_options_c/adc__maxiter.rst", "autodir_options_c/adc__num_core_orbitals.rst", "autodir_options_c/adc__num_guesses.rst", "autodir_options_c/adc__r_convergence.rst", "autodir_options_c/adc__reference.rst", "autodir_options_c/adc__roots_per_irrep.rst", "autodir_options_c/ccdensity__ao_basis.rst", "autodir_options_c/ccdensity__cachelevel.rst", "autodir_options_c/ccdensity__debug.rst", "autodir_options_c/ccdensity__gauge.rst", "autodir_options_c/ccdensity__ints_tolerance.rst", "autodir_options_c/ccdensity__opdm_only.rst", "autodir_options_c/ccdensity__opdm_relax.rst", "autodir_options_c/ccdensity__prop_all.rst", "autodir_options_c/ccdensity__prop_root.rst", "autodir_options_c/ccdensity__prop_sym.rst", "autodir_options_c/ccdensity__reference.rst", "autodir_options_c/ccdensity__roots_per_irrep.rst", "autodir_options_c/ccdensity__wfn.rst", "autodir_options_c/ccdensity__write_nos.rst", "autodir_options_c/ccdensity__xi.rst", "autodir_options_c/ccdensity__xi_connect.rst", "autodir_options_c/ccdensity__zeta.rst", "autodir_options_c/ccenergy__abcd.rst", "autodir_options_c/ccenergy__analyze.rst", "autodir_options_c/ccenergy__ao_basis.rst", "autodir_options_c/ccenergy__bccd_maxiter.rst", "autodir_options_c/ccenergy__brueckner_orbs_r_convergence.rst", "autodir_options_c/ccenergy__cachelevel.rst", "autodir_options_c/ccenergy__cachetype.rst", "autodir_options_c/ccenergy__cc_num_threads.rst", "autodir_options_c/ccenergy__cc_os_scale.rst", "autodir_options_c/ccenergy__cc_ss_scale.rst", "autodir_options_c/ccenergy__diis.rst", "autodir_options_c/ccenergy__e_convergence.rst", "autodir_options_c/ccenergy__force_restart.rst", "autodir_options_c/ccenergy__local.rst", "autodir_options_c/ccenergy__local_cphf_cutoff.rst", "autodir_options_c/ccenergy__local_cutoff.rst", "autodir_options_c/ccenergy__local_method.rst", "autodir_options_c/ccenergy__local_pairdef.rst", "autodir_options_c/ccenergy__local_weakp.rst", "autodir_options_c/ccenergy__maxiter.rst", "autodir_options_c/ccenergy__mp2_amps_print.rst", "autodir_options_c/ccenergy__mp2_os_scale.rst", "autodir_options_c/ccenergy__mp2_ss_scale.rst", "autodir_options_c/ccenergy__new_triples.rst", "autodir_options_c/ccenergy__num_amps_print.rst", "autodir_options_c/ccenergy__pair_energies_print.rst", "autodir_options_c/ccenergy__property.rst", "autodir_options_c/ccenergy__r_convergence.rst", "autodir_options_c/ccenergy__reference.rst", "autodir_options_c/ccenergy__restart.rst", "autodir_options_c/ccenergy__scs_ccsd.rst", "autodir_options_c/ccenergy__scs_mp2.rst", "autodir_options_c/ccenergy__scsn_mp2.rst", "autodir_options_c/ccenergy__semicanonical.rst", "autodir_options_c/ccenergy__t2_coupled.rst", "autodir_options_c/ccenergy__t3_ws_incore.rst", "autodir_options_c/ccenergy__wfn.rst", "autodir_options_c/cceom__abcd.rst", "autodir_options_c/cceom__cachelevel.rst", "autodir_options_c/cceom__cachetype.rst", "autodir_options_c/cceom__cc3_follow_root.rst", "autodir_options_c/cceom__cc_num_threads.rst", "autodir_options_c/cceom__collapse_with_last.rst", "autodir_options_c/cceom__collapse_with_last_cc3.rst", "autodir_options_c/cceom__complex_tolerance.rst", "autodir_options_c/cceom__e_convergence.rst", "autodir_options_c/cceom__eom_guess.rst", "autodir_options_c/cceom__eom_reference.rst", "autodir_options_c/cceom__excitation_range.rst", "autodir_options_c/cceom__full_matrix.rst", "autodir_options_c/cceom__local.rst", "autodir_options_c/cceom__local_cutoff.rst", "autodir_options_c/cceom__local_do_singles.rst", "autodir_options_c/cceom__local_filter_singles.rst", "autodir_options_c/cceom__local_method.rst", "autodir_options_c/cceom__local_preconditioner.rst", "autodir_options_c/cceom__local_weakp.rst", "autodir_options_c/cceom__maxiter.rst", "autodir_options_c/cceom__new_triples.rst", "autodir_options_c/cceom__num_amps_print.rst", "autodir_options_c/cceom__overlap_check.rst", "autodir_options_c/cceom__prop_root.rst", "autodir_options_c/cceom__prop_sym.rst", "autodir_options_c/cceom__r_convergence.rst", "autodir_options_c/cceom__reference.rst", "autodir_options_c/cceom__restart_eom_cc3.rst", "autodir_options_c/cceom__rhf_triplets.rst", "autodir_options_c/cceom__roots_per_irrep.rst", "autodir_options_c/cceom__schmidt_add_residual_tolerance.rst", "autodir_options_c/cceom__semicanonical.rst", "autodir_options_c/cceom__singles_print.rst", "autodir_options_c/cceom__ss_e_convergence.rst", "autodir_options_c/cceom__ss_r_convergence.rst", "autodir_options_c/cceom__ss_skip_diag.rst", "autodir_options_c/cceom__ss_vecs_per_root.rst", "autodir_options_c/cceom__t3_ws_incore.rst", "autodir_options_c/cceom__vecs_cc3.rst", "autodir_options_c/cceom__vecs_per_root.rst", "autodir_options_c/cceom__wfn.rst", "autodir_options_c/cchbar__cachelevel.rst", "autodir_options_c/cchbar__eom_reference.rst", "autodir_options_c/cchbar__t_amps.rst", "autodir_options_c/cchbar__wabei_lowdisk.rst", "autodir_options_c/cchbar__wfn.rst", "autodir_options_c/cclambda__abcd.rst", "autodir_options_c/cclambda__ao_basis.rst", "autodir_options_c/cclambda__cachelevel.rst", "autodir_options_c/cclambda__diis.rst", "autodir_options_c/cclambda__jobtype.rst", "autodir_options_c/cclambda__local.rst", "autodir_options_c/cclambda__local_cphf_cutoff.rst", "autodir_options_c/cclambda__local_cutoff.rst", "autodir_options_c/cclambda__local_filter_singles.rst", "autodir_options_c/cclambda__local_method.rst", "autodir_options_c/cclambda__local_pairdef.rst", "autodir_options_c/cclambda__local_weakp.rst", "autodir_options_c/cclambda__maxiter.rst", "autodir_options_c/cclambda__num_amps_print.rst", "autodir_options_c/cclambda__prop_all.rst", "autodir_options_c/cclambda__prop_root.rst", "autodir_options_c/cclambda__prop_sym.rst", "autodir_options_c/cclambda__r_convergence.rst", "autodir_options_c/cclambda__restart.rst", "autodir_options_c/cclambda__roots_per_irrep.rst", "autodir_options_c/cclambda__sekino.rst", "autodir_options_c/cclambda__wfn.rst", "autodir_options_c/cclambda__zeta.rst", "autodir_options_c/ccresponse__abcd.rst", "autodir_options_c/ccresponse__analyze.rst", "autodir_options_c/ccresponse__cachelevel.rst", "autodir_options_c/ccresponse__diis.rst", "autodir_options_c/ccresponse__gauge.rst", "autodir_options_c/ccresponse__linear.rst", "autodir_options_c/ccresponse__local.rst", "autodir_options_c/ccresponse__local_cphf_cutoff.rst", "autodir_options_c/ccresponse__local_cutoff.rst", "autodir_options_c/ccresponse__local_filter_singles.rst", "autodir_options_c/ccresponse__local_method.rst", "autodir_options_c/ccresponse__local_pairdef.rst", "autodir_options_c/ccresponse__local_weakp.rst", "autodir_options_c/ccresponse__maxiter.rst", "autodir_options_c/ccresponse__num_amps_print.rst", "autodir_options_c/ccresponse__omega.rst", "autodir_options_c/ccresponse__property.rst", "autodir_options_c/ccresponse__r_convergence.rst", "autodir_options_c/ccresponse__reference.rst", "autodir_options_c/ccresponse__restart.rst", "autodir_options_c/ccresponse__sekino.rst", "autodir_options_c/ccresponse__wfn.rst", "autodir_options_c/cctransort__ao_basis.rst", "autodir_options_c/cctransort__cachelevel.rst", "autodir_options_c/cctransort__delete_tei.rst", "autodir_options_c/cctransort__reference.rst", "autodir_options_c/cctransort__run_cctransort.rst", "autodir_options_c/cctransort__semicanonical.rst", "autodir_options_c/cctransort__wfn.rst", "autodir_options_c/cctriples__cc_num_threads.rst", "autodir_options_c/cctriples__reference.rst", "autodir_options_c/cctriples__semicanonical.rst", "autodir_options_c/cctriples__wfn.rst", "autodir_options_c/cfour__cfour_abcdtype.rst", "autodir_options_c/cfour__cfour_active_orbi.rst", "autodir_options_c/cfour__cfour_anh_algorithm.rst", "autodir_options_c/cfour__cfour_anh_derivatives.rst", "autodir_options_c/cfour__cfour_anh_stepsize.rst", "autodir_options_c/cfour__cfour_anh_symmetry.rst", "autodir_options_c/cfour__cfour_anharmonic.rst", "autodir_options_c/cfour__cfour_ao_ladders.rst", "autodir_options_c/cfour__cfour_av_scf.rst", "autodir_options_c/cfour__cfour_basis.rst", "autodir_options_c/cfour__cfour_bruck_conv.rst", "autodir_options_c/cfour__cfour_brueckner.rst", "autodir_options_c/cfour__cfour_cache_recs.rst", "autodir_options_c/cfour__cfour_calc_level.rst", "autodir_options_c/cfour__cfour_cc_conv.rst", "autodir_options_c/cfour__cfour_cc_exporder.rst", "autodir_options_c/cfour__cfour_cc_extrapolation.rst", "autodir_options_c/cfour__cfour_cc_maxcyc.rst", "autodir_options_c/cfour__cfour_cc_program.rst", "autodir_options_c/cfour__cfour_charge.rst", "autodir_options_c/cfour__cfour_cis_conv.rst", "autodir_options_c/cfour__cfour_continuum.rst", "autodir_options_c/cfour__cfour_contraction.rst", "autodir_options_c/cfour__cfour_convergence.rst", "autodir_options_c/cfour__cfour_coordinates.rst", "autodir_options_c/cfour__cfour_core_orbitals.rst", "autodir_options_c/cfour__cfour_cphf_conver.rst", "autodir_options_c/cfour__cfour_cphf_maxcyc.rst", "autodir_options_c/cfour__cfour_curvilinear.rst", "autodir_options_c/cfour__cfour_dboc.rst", "autodir_options_c/cfour__cfour_dct.rst", "autodir_options_c/cfour__cfour_deriv_level.rst", "autodir_options_c/cfour__cfour_diff_type.rst", "autodir_options_c/cfour__cfour_dropmo.rst", "autodir_options_c/cfour__cfour_ecp.rst", "autodir_options_c/cfour__cfour_eigenvector.rst", "autodir_options_c/cfour__cfour_el_anharm.rst", "autodir_options_c/cfour__cfour_eom_nonit.rst", "autodir_options_c/cfour__cfour_estate_conv.rst", "autodir_options_c/cfour__cfour_estate_maxcyc.rst", "autodir_options_c/cfour__cfour_estate_prop.rst", "autodir_options_c/cfour__cfour_estate_sym.rst", "autodir_options_c/cfour__cfour_estate_trans.rst", "autodir_options_c/cfour__cfour_eval_hess.rst", "autodir_options_c/cfour__cfour_excitation.rst", "autodir_options_c/cfour__cfour_excite.rst", "autodir_options_c/cfour__cfour_fc_field.rst", "autodir_options_c/cfour__cfour_fd_calctype.rst", "autodir_options_c/cfour__cfour_fd_irreps.rst", "autodir_options_c/cfour__cfour_fd_project.rst", "autodir_options_c/cfour__cfour_fd_stepsize.rst", "autodir_options_c/cfour__cfour_fd_usegroup.rst", "autodir_options_c/cfour__cfour_file_recsiz.rst", "autodir_options_c/cfour__cfour_file_stripe.rst", "autodir_options_c/cfour__cfour_finite_perturbation.rst", "autodir_options_c/cfour__cfour_fock.rst", "autodir_options_c/cfour__cfour_freq_algorithm.rst", "autodir_options_c/cfour__cfour_frozen_core.rst", "autodir_options_c/cfour__cfour_frozen_virt.rst", "autodir_options_c/cfour__cfour_gamma_abcd.rst", "autodir_options_c/cfour__cfour_genbas_1.rst", "autodir_options_c/cfour__cfour_genbas_2.rst", "autodir_options_c/cfour__cfour_genbas_3.rst", "autodir_options_c/cfour__cfour_genbas_4.rst", "autodir_options_c/cfour__cfour_geo_conv.rst", "autodir_options_c/cfour__cfour_geo_maxcyc.rst", "autodir_options_c/cfour__cfour_geo_maxstep.rst", "autodir_options_c/cfour__cfour_geo_method.rst", "autodir_options_c/cfour__cfour_giao.rst", "autodir_options_c/cfour__cfour_grid.rst", "autodir_options_c/cfour__cfour_guess.rst", "autodir_options_c/cfour__cfour_hbar.rst", "autodir_options_c/cfour__cfour_hfstability.rst", "autodir_options_c/cfour__cfour_incore.rst", "autodir_options_c/cfour__cfour_input_mrcc.rst", "autodir_options_c/cfour__cfour_integrals.rst", "autodir_options_c/cfour__cfour_joda_print.rst", "autodir_options_c/cfour__cfour_lineq_conv.rst", "autodir_options_c/cfour__cfour_lineq_maxcy.rst", "autodir_options_c/cfour__cfour_lineq_type.rst", "autodir_options_c/cfour__cfour_lock_orbocc.rst", "autodir_options_c/cfour__cfour_maxstep.rst", "autodir_options_c/cfour__cfour_mem_unit.rst", "autodir_options_c/cfour__cfour_memory_size.rst", "autodir_options_c/cfour__cfour_method.rst", "autodir_options_c/cfour__cfour_mrcc.rst", "autodir_options_c/cfour__cfour_multiplicity.rst", "autodir_options_c/cfour__cfour_nacoupling.rst", "autodir_options_c/cfour__cfour_negeval.rst", "autodir_options_c/cfour__cfour_newnorm.rst", "autodir_options_c/cfour__cfour_nonhf.rst", "autodir_options_c/cfour__cfour_ntop_tamp.rst", "autodir_options_c/cfour__cfour_occupation.rst", "autodir_options_c/cfour__cfour_omp_num_threads.rst", "autodir_options_c/cfour__cfour_open-shell.rst", "autodir_options_c/cfour__cfour_opt_maxcyc.rst", "autodir_options_c/cfour__cfour_orbitals.rst", "autodir_options_c/cfour__cfour_pert_orb.rst", "autodir_options_c/cfour__cfour_points.rst", "autodir_options_c/cfour__cfour_print.rst", "autodir_options_c/cfour__cfour_prop_integral.rst", "autodir_options_c/cfour__cfour_props.rst", "autodir_options_c/cfour__cfour_qrhf_general.rst", "autodir_options_c/cfour__cfour_qrhf_orbital.rst", "autodir_options_c/cfour__cfour_qrhfgues.rst", "autodir_options_c/cfour__cfour_raman_int.rst", "autodir_options_c/cfour__cfour_raman_orb.rst", "autodir_options_c/cfour__cfour_rdo.rst", "autodir_options_c/cfour__cfour_reference.rst", "autodir_options_c/cfour__cfour_relativistic.rst", "autodir_options_c/cfour__cfour_relax_dens.rst", "autodir_options_c/cfour__cfour_res_raman.rst", "autodir_options_c/cfour__cfour_restart_cc.rst", "autodir_options_c/cfour__cfour_rot_evec.rst", "autodir_options_c/cfour__cfour_save_ints.rst", "autodir_options_c/cfour__cfour_scale_on.rst", "autodir_options_c/cfour__cfour_scf_conv.rst", "autodir_options_c/cfour__cfour_scf_damping.rst", "autodir_options_c/cfour__cfour_scf_exporder.rst", "autodir_options_c/cfour__cfour_scf_expstart.rst", "autodir_options_c/cfour__cfour_scf_extrapolation.rst", "autodir_options_c/cfour__cfour_scf_maxcyc.rst", "autodir_options_c/cfour__cfour_sd_field.rst", "autodir_options_c/cfour__cfour_spherical.rst", "autodir_options_c/cfour__cfour_spin_flip.rst", "autodir_options_c/cfour__cfour_spin_orbit.rst", "autodir_options_c/cfour__cfour_spin_scal.rst", "autodir_options_c/cfour__cfour_spinrotation.rst", "autodir_options_c/cfour__cfour_subgroup.rst", "autodir_options_c/cfour__cfour_sym_check.rst", "autodir_options_c/cfour__cfour_symmetry.rst", "autodir_options_c/cfour__cfour_t3_extrapol.rst", "autodir_options_c/cfour__cfour_tamp_sum.rst", "autodir_options_c/cfour__cfour_thermochemistry.rst", "autodir_options_c/cfour__cfour_trans_inv.rst", "autodir_options_c/cfour__cfour_treat_pert.rst", "autodir_options_c/cfour__cfour_uij_threshold.rst", "autodir_options_c/cfour__cfour_units.rst", "autodir_options_c/cfour__cfour_update_hessian.rst", "autodir_options_c/cfour__cfour_vibration.rst", "autodir_options_c/cfour__cfour_vtran.rst", "autodir_options_c/cfour__cfour_xfield.rst", "autodir_options_c/cfour__cfour_xform_tol.rst", "autodir_options_c/cfour__cfour_yfield.rst", "autodir_options_c/cfour__cfour_zfield.rst", "autodir_options_c/cfour__translate_psi4.rst", "autodir_options_c/cphf__cphf_mem_safety_factor.rst", "autodir_options_c/cphf__cphf_tasks.rst", "autodir_options_c/cphf__debug.rst", "autodir_options_c/cphf__df_basis_scf.rst", "autodir_options_c/cphf__explicit_hamiltonian.rst", "autodir_options_c/cphf__module.rst", "autodir_options_c/cphf__print.rst", "autodir_options_c/cphf__scf_type.rst", "autodir_options_c/cphf__solver_convergence.rst", "autodir_options_c/cphf__solver_maxiter.rst", "autodir_options_c/cphf__solver_n_guess.rst", "autodir_options_c/cphf__solver_precondition.rst", "autodir_options_c/dct__algorithm.rst", "autodir_options_c/dct__ao_basis.rst", "autodir_options_c/dct__cachelevel.rst", "autodir_options_c/dct__damping_percentage.rst", "autodir_options_c/dct__dct_functional.rst", "autodir_options_c/dct__dct_guess.rst", "autodir_options_c/dct__dct_type.rst", "autodir_options_c/dct__df_basis_dct.rst", "autodir_options_c/dct__diis_max_vecs.rst", "autodir_options_c/dct__diis_min_vecs.rst", "autodir_options_c/dct__diis_start_convergence.rst", "autodir_options_c/dct__e_convergence.rst", "autodir_options_c/dct__energy_level_shift.rst", "autodir_options_c/dct__guess_r_convergence.rst", "autodir_options_c/dct__ints_tolerance.rst", "autodir_options_c/dct__maxiter.rst", "autodir_options_c/dct__odc_guess.rst", "autodir_options_c/dct__opdm.rst", "autodir_options_c/dct__orbital_level_shift.rst", "autodir_options_c/dct__qc_coupling.rst", "autodir_options_c/dct__qc_type.rst", "autodir_options_c/dct__r_convergence.rst", "autodir_options_c/dct__reference.rst", "autodir_options_c/dct__relax_guess_orbitals.rst", "autodir_options_c/dct__response_algorithm.rst", "autodir_options_c/dct__stability_add_vectors.rst", "autodir_options_c/dct__stability_augment_space_tol.rst", "autodir_options_c/dct__stability_check.rst", "autodir_options_c/dct__stability_convergence.rst", "autodir_options_c/dct__stability_max_space_size.rst", "autodir_options_c/dct__stability_n_eigenvalues.rst", "autodir_options_c/dct__stability_n_guess_vectors.rst", "autodir_options_c/dct__three_particle.rst", "autodir_options_c/dct__tikhonow_omega.rst", "autodir_options_c/ddx__ddx_diis_max_vecs.rst", "autodir_options_c/ddx__ddx_eta.rst", "autodir_options_c/ddx__ddx_fmm.rst", "autodir_options_c/ddx__ddx_fmm_local_lmax.rst", "autodir_options_c/ddx__ddx_fmm_multipole_lmax.rst", "autodir_options_c/ddx__ddx_incore.rst", "autodir_options_c/ddx__ddx_lmax.rst", "autodir_options_c/ddx__ddx_logfile.rst", "autodir_options_c/ddx__ddx_maxiter.rst", "autodir_options_c/ddx__ddx_model.rst", "autodir_options_c/ddx__ddx_n_lebedev.rst", "autodir_options_c/ddx__ddx_radii.rst", "autodir_options_c/ddx__ddx_radii_scaling.rst", "autodir_options_c/ddx__ddx_radii_set.rst", "autodir_options_c/ddx__ddx_shift.rst", "autodir_options_c/ddx__ddx_solute_radial_points.rst", "autodir_options_c/ddx__ddx_solute_spherical_points.rst", "autodir_options_c/ddx__ddx_solvation_convergence.rst", "autodir_options_c/ddx__ddx_solvent.rst", "autodir_options_c/ddx__ddx_solvent_epsilon.rst", "autodir_options_c/ddx__ddx_solvent_epsilon_optical.rst", "autodir_options_c/ddx__ddx_solvent_kappa.rst", "autodir_options_c/detci__a_ras3_max.rst", "autodir_options_c/detci__avg_states.rst", "autodir_options_c/detci__avg_weights.rst", "autodir_options_c/detci__b_ras3_max.rst", "autodir_options_c/detci__bendazzoli.rst", "autodir_options_c/detci__calc_s_squared.rst", "autodir_options_c/detci__cc.rst", "autodir_options_c/detci__cc_a_ras3_max.rst", "autodir_options_c/detci__cc_b_ras3_max.rst", "autodir_options_c/detci__cc_ex_level.rst", "autodir_options_c/detci__cc_fix_external.rst", "autodir_options_c/detci__cc_fix_external_min.rst", "autodir_options_c/detci__cc_macro.rst", "autodir_options_c/detci__cc_mixed.rst", "autodir_options_c/detci__cc_ras34_max.rst", "autodir_options_c/detci__cc_ras3_max.rst", "autodir_options_c/detci__cc_ras4_max.rst", "autodir_options_c/detci__cc_update_eps.rst", "autodir_options_c/detci__cc_val_ex_level.rst", "autodir_options_c/detci__cc_variational.rst", "autodir_options_c/detci__cc_vecs_read.rst", "autodir_options_c/detci__cc_vecs_write.rst", "autodir_options_c/detci__ci_file_start.rst", "autodir_options_c/detci__ci_maxiter.rst", "autodir_options_c/detci__ci_num_threads.rst", "autodir_options_c/detci__ciblks_print.rst", "autodir_options_c/detci__collapse_size.rst", "autodir_options_c/detci__detci_freeze_core.rst", "autodir_options_c/detci__df_basis_mcscf.rst", "autodir_options_c/detci__diag_method.rst", "autodir_options_c/detci__diis.rst", "autodir_options_c/detci__diis_freq.rst", "autodir_options_c/detci__diis_max_vecs.rst", "autodir_options_c/detci__diis_min_vecs.rst", "autodir_options_c/detci__diis_start_iter.rst", "autodir_options_c/detci__dipmom.rst", "autodir_options_c/detci__e_convergence.rst", "autodir_options_c/detci__ex_allow.rst", "autodir_options_c/detci__ex_level.rst", "autodir_options_c/detci__fci.rst", "autodir_options_c/detci__fci_strings.rst", "autodir_options_c/detci__filter_guess.rst", "autodir_options_c/detci__filter_guess_det1.rst", "autodir_options_c/detci__filter_guess_det2.rst", "autodir_options_c/detci__filter_guess_sign.rst", "autodir_options_c/detci__filter_zero_det.rst", "autodir_options_c/detci__follow_root.rst", "autodir_options_c/detci__follow_vector.rst", "autodir_options_c/detci__guess_vector.rst", "autodir_options_c/detci__h0_block_coupling.rst", "autodir_options_c/detci__h0_block_coupling_size.rst", "autodir_options_c/detci__h0_blocksize.rst", "autodir_options_c/detci__h0_guess_size.rst", "autodir_options_c/detci__hd_avg.rst", "autodir_options_c/detci__hd_otf.rst", "autodir_options_c/detci__icore.rst", "autodir_options_c/detci__istop.rst", "autodir_options_c/detci__lse.rst", "autodir_options_c/detci__lse_collapse.rst", "autodir_options_c/detci__lse_tolerance.rst", "autodir_options_c/detci__max_num_vecs.rst", "autodir_options_c/detci__mcscf_algorithm.rst", "autodir_options_c/detci__mcscf_ci_cleanup.rst", "autodir_options_c/detci__mcscf_diis_error_type.rst", "autodir_options_c/detci__mcscf_diis_freq.rst", "autodir_options_c/detci__mcscf_diis_max_vecs.rst", "autodir_options_c/detci__mcscf_diis_start.rst", "autodir_options_c/detci__mcscf_dpd_cleanup.rst", "autodir_options_c/detci__mcscf_e_convergence.rst", "autodir_options_c/detci__mcscf_guess.rst", "autodir_options_c/detci__mcscf_max_rot.rst", "autodir_options_c/detci__mcscf_maxiter.rst", "autodir_options_c/detci__mcscf_r_convergence.rst", "autodir_options_c/detci__mcscf_rotate.rst", "autodir_options_c/detci__mcscf_so_start_e.rst", "autodir_options_c/detci__mcscf_so_start_grad.rst", "autodir_options_c/detci__mcscf_type.rst", "autodir_options_c/detci__mixed.rst", "autodir_options_c/detci__mixed4.rst", "autodir_options_c/detci__mpn.rst", "autodir_options_c/detci__mpn_order_save.rst", "autodir_options_c/detci__mpn_schmidt.rst", "autodir_options_c/detci__mpn_wigner.rst", "autodir_options_c/detci__ms0.rst", "autodir_options_c/detci__nat_orbs.rst", "autodir_options_c/detci__no_dfile.rst", "autodir_options_c/detci__num_amps_print.rst", "autodir_options_c/detci__num_dets_print.rst", "autodir_options_c/detci__num_init_vecs.rst", "autodir_options_c/detci__num_roots.rst", "autodir_options_c/detci__opdm.rst", "autodir_options_c/detci__perturb_magnitude.rst", "autodir_options_c/detci__preconditioner.rst", "autodir_options_c/detci__r4s.rst", "autodir_options_c/detci__r_convergence.rst", "autodir_options_c/detci__ras34_max.rst", "autodir_options_c/detci__ras3_max.rst", "autodir_options_c/detci__ras4_max.rst", "autodir_options_c/detci__reference.rst", "autodir_options_c/detci__reference_sym.rst", "autodir_options_c/detci__repl_otf.rst", "autodir_options_c/detci__restart.rst", "autodir_options_c/detci__s.rst", "autodir_options_c/detci__sf_restrict.rst", "autodir_options_c/detci__sigma_overlap.rst", "autodir_options_c/detci__tdm.rst", "autodir_options_c/detci__tpdm.rst", "autodir_options_c/detci__update.rst", "autodir_options_c/detci__val_ex_level.rst", "autodir_options_c/detci__wfn.rst", "autodir_options_c/dfep2__df_basis_ep2.rst", "autodir_options_c/dfep2__ep2_convergence.rst", "autodir_options_c/dfep2__ep2_maxiter.rst", "autodir_options_c/dfep2__ep2_num_ea.rst", "autodir_options_c/dfep2__ep2_num_ip.rst", "autodir_options_c/dfep2__ep2_orbitals.rst", "autodir_options_c/dfmp2__basis.rst", "autodir_options_c/dfmp2__df_basis_mp2.rst", "autodir_options_c/dfmp2__df_ints_io.rst", "autodir_options_c/dfmp2__df_ints_num_threads.rst", "autodir_options_c/dfmp2__dfmp2_mem_factor.rst", "autodir_options_c/dfmp2__dfmp2_p2_tolerance.rst", "autodir_options_c/dfmp2__dfmp2_p_tolerance.rst", "autodir_options_c/dfmp2__ints_tolerance.rst", "autodir_options_c/dfmp2__madmp2_sleep.rst", "autodir_options_c/dfmp2__mp2_os_scale.rst", "autodir_options_c/dfmp2__mp2_ss_scale.rst", "autodir_options_c/dfmp2__onepdm.rst", "autodir_options_c/dfmp2__opdm_relax.rst", "autodir_options_c/dfocc__cc_diis_max_vecs.rst", "autodir_options_c/dfocc__cc_diis_min_vecs.rst", "autodir_options_c/dfocc__cc_lambda.rst", "autodir_options_c/dfocc__cc_maxiter.rst", "autodir_options_c/dfocc__cholesky.rst", "autodir_options_c/dfocc__cholesky_tolerance.rst", "autodir_options_c/dfocc__comput_s2.rst", "autodir_options_c/dfocc__cutoff.rst", "autodir_options_c/dfocc__do_diis.rst", "autodir_options_c/dfocc__do_level_shift.rst", "autodir_options_c/dfocc__do_scs.rst", "autodir_options_c/dfocc__do_sos.rst", "autodir_options_c/dfocc__e3_scale.rst", "autodir_options_c/dfocc__e_convergence.rst", "autodir_options_c/dfocc__ekt_ip.rst", "autodir_options_c/dfocc__hess_type.rst", "autodir_options_c/dfocc__integral_cutoff.rst", "autodir_options_c/dfocc__level_shift.rst", "autodir_options_c/dfocc__lineq_solver.rst", "autodir_options_c/dfocc__max_mograd_convergence.rst", "autodir_options_c/dfocc__mo_diis_num_vecs.rst", "autodir_options_c/dfocc__mo_maxiter.rst", "autodir_options_c/dfocc__mo_step_max.rst", "autodir_options_c/dfocc__molden_write.rst", "autodir_options_c/dfocc__mp2_amp_type.rst", "autodir_options_c/dfocc__mp2_os_scale.rst", "autodir_options_c/dfocc__mp2_sos_scale.rst", "autodir_options_c/dfocc__mp2_sos_scale2.rst", "autodir_options_c/dfocc__mp2_ss_scale.rst", "autodir_options_c/dfocc__nat_orbs.rst", "autodir_options_c/dfocc__occ_orbs_print.rst", "autodir_options_c/dfocc__oeprop.rst", "autodir_options_c/dfocc__oo_scale.rst", "autodir_options_c/dfocc__opt_method.rst", "autodir_options_c/dfocc__orb_opt.rst", "autodir_options_c/dfocc__orb_resp_solver.rst", "autodir_options_c/dfocc__orth_type.rst", "autodir_options_c/dfocc__pcg_beta_type.rst", "autodir_options_c/dfocc__pcg_convergence.rst", "autodir_options_c/dfocc__pcg_maxiter.rst", "autodir_options_c/dfocc__ppl_type.rst", "autodir_options_c/dfocc__qchf.rst", "autodir_options_c/dfocc__r_convergence.rst", "autodir_options_c/dfocc__read_scf_3index.rst", "autodir_options_c/dfocc__reg_param.rst", "autodir_options_c/dfocc__regularization.rst", "autodir_options_c/dfocc__remp_a.rst", "autodir_options_c/dfocc__rms_mograd_convergence.rst", "autodir_options_c/dfocc__scs_type.rst", "autodir_options_c/dfocc__sos_type.rst", "autodir_options_c/dfocc__triples_iabc_type.rst", "autodir_options_c/dfocc__wfn_type.rst", "autodir_options_c/dlpno__df_basis_mp2.rst", "autodir_options_c/dlpno__dlpno_algorithm.rst", "autodir_options_c/dlpno__dlpno_local_orbitals.rst", "autodir_options_c/dlpno__dlpno_maxiter.rst", "autodir_options_c/dlpno__doi_basis_tolerance.rst", "autodir_options_c/dlpno__doi_pruning_scheme.rst", "autodir_options_c/dlpno__doi_radial_points.rst", "autodir_options_c/dlpno__doi_spherical_points.rst", "autodir_options_c/dlpno__e_convergence.rst", "autodir_options_c/dlpno__f_cut.rst", "autodir_options_c/dlpno__local_convergence.rst", "autodir_options_c/dlpno__local_maxiter.rst", "autodir_options_c/dlpno__pno_convergence.rst", "autodir_options_c/dlpno__r_convergence.rst", "autodir_options_c/dlpno__s_cut.rst", "autodir_options_c/dlpno__t_cut_clmo.rst", "autodir_options_c/dlpno__t_cut_cpao.rst", "autodir_options_c/dlpno__t_cut_do.rst", "autodir_options_c/dlpno__t_cut_do_ij.rst", "autodir_options_c/dlpno__t_cut_do_pre.rst", "autodir_options_c/dlpno__t_cut_mkn.rst", "autodir_options_c/dlpno__t_cut_pno.rst", "autodir_options_c/dlpno__t_cut_pre.rst", "autodir_options_c/dmrg__dmrg_caspt2_calc.rst", "autodir_options_c/dmrg__dmrg_caspt2_imag.rst", "autodir_options_c/dmrg__dmrg_caspt2_ipea.rst", "autodir_options_c/dmrg__dmrg_caspt2_orbs.rst", "autodir_options_c/dmrg__dmrg_diis.rst", "autodir_options_c/dmrg__dmrg_diis_write.rst", "autodir_options_c/dmrg__dmrg_excitation.rst", "autodir_options_c/dmrg__dmrg_irrep.rst", "autodir_options_c/dmrg__dmrg_local_init.rst", "autodir_options_c/dmrg__dmrg_molden_write.rst", "autodir_options_c/dmrg__dmrg_mps_write.rst", "autodir_options_c/dmrg__dmrg_multiplicity.rst", "autodir_options_c/dmrg__dmrg_opdm_ao_print.rst", "autodir_options_c/dmrg__dmrg_print_corr.rst", "autodir_options_c/dmrg__dmrg_scf_active_space.rst", "autodir_options_c/dmrg__dmrg_scf_diis_thr.rst", "autodir_options_c/dmrg__dmrg_scf_grad_thr.rst", "autodir_options_c/dmrg__dmrg_scf_max_iter.rst", "autodir_options_c/dmrg__dmrg_scf_state_avg.rst", "autodir_options_c/dmrg__dmrg_sweep_dvdson_rtol.rst", "autodir_options_c/dmrg__dmrg_sweep_energy_conv.rst", "autodir_options_c/dmrg__dmrg_sweep_max_sweeps.rst", "autodir_options_c/dmrg__dmrg_sweep_noise_prefac.rst", "autodir_options_c/dmrg__dmrg_sweep_states.rst", "autodir_options_c/dmrg__dmrg_unitary_write.rst", "autodir_options_c/efp__dertype.rst", "autodir_options_c/efp__efp_disp.rst", "autodir_options_c/efp__efp_disp_damping.rst", "autodir_options_c/efp__efp_elst.rst", "autodir_options_c/efp__efp_elst_damping.rst", "autodir_options_c/efp__efp_exch.rst", "autodir_options_c/efp__efp_ind.rst", "autodir_options_c/efp__efp_ind_damping.rst", "autodir_options_c/efp__efp_qm_elst.rst", "autodir_options_c/efp__efp_qm_ind.rst", "autodir_options_c/efp__print.rst", "autodir_options_c/efp__qmefp.rst", "autodir_options_c/findif__disp_size.rst", "autodir_options_c/findif__fd_project.rst", "autodir_options_c/findif__gradient_write.rst", "autodir_options_c/findif__hessian_write.rst", "autodir_options_c/findif__normal_modes_write.rst", "autodir_options_c/findif__points.rst", "autodir_options_c/fisapt__cphf_r_convergence.rst", "autodir_options_c/fisapt__cubic_basis_tolerance.rst", "autodir_options_c/fisapt__cubic_block_max_points.rst", "autodir_options_c/fisapt__cubic_grid_overage.rst", "autodir_options_c/fisapt__cubic_grid_spacing.rst", "autodir_options_c/fisapt__fisapt_charge_completeness.rst", "autodir_options_c/fisapt__fisapt_cube_densmat.rst", "autodir_options_c/fisapt__fisapt_cube_linkibos.rst", "autodir_options_c/fisapt__fisapt_cube_linkihos.rst", "autodir_options_c/fisapt__fisapt_do_fsapt.rst", "autodir_options_c/fisapt__fisapt_do_fsapt_disp.rst", "autodir_options_c/fisapt__fisapt_do_plot.rst", "autodir_options_c/fisapt__fisapt_exch_parperp.rst", "autodir_options_c/fisapt__fisapt_fsapt_exch_scale.rst", "autodir_options_c/fisapt__fisapt_fsapt_filepath.rst", "autodir_options_c/fisapt__fisapt_fsapt_ind_response.rst", "autodir_options_c/fisapt__fisapt_fsapt_ind_scale.rst", "autodir_options_c/fisapt__fisapt_fssapt_filepath.rst", "autodir_options_c/fisapt__fisapt_link_assignment.rst", "autodir_options_c/fisapt__fisapt_link_ortho.rst", "autodir_options_c/fisapt__fisapt_link_selection.rst", "autodir_options_c/fisapt__fisapt_manual_links.rst", "autodir_options_c/fisapt__fisapt_mem_safety_factor.rst", "autodir_options_c/fisapt__fisapt_plot_filepath.rst", "autodir_options_c/fisapt__ints_tolerance.rst", "autodir_options_c/fisapt__local_convergence.rst", "autodir_options_c/fisapt__local_ibo_condition.rst", "autodir_options_c/fisapt__local_ibo_power.rst", "autodir_options_c/fisapt__local_ibo_stars.rst", "autodir_options_c/fisapt__local_ibo_stars_completeness.rst", "autodir_options_c/fisapt__local_ibo_use_stars.rst", "autodir_options_c/fisapt__local_maxiter.rst", "autodir_options_c/fisapt__local_use_ghosts.rst", "autodir_options_c/fisapt__maxiter.rst", "autodir_options_c/fisapt__minao_basis.rst", "autodir_options_c/fisapt__ssapt0_scale.rst", "autodir_options_c/fnocc__active_nat_orbs.rst", "autodir_options_c/fnocc__brueckner_maxiter.rst", "autodir_options_c/fnocc__cc_scale_os.rst", "autodir_options_c/fnocc__cc_scale_ss.rst", "autodir_options_c/fnocc__cc_timings.rst", "autodir_options_c/fnocc__cepa_level.rst", "autodir_options_c/fnocc__cepa_no_singles.rst", "autodir_options_c/fnocc__cholesky_tolerance.rst", "autodir_options_c/fnocc__compute_mp4_triples.rst", "autodir_options_c/fnocc__compute_triples.rst", "autodir_options_c/fnocc__df_basis_cc.rst", "autodir_options_c/fnocc__dfcc.rst", "autodir_options_c/fnocc__diis_max_vecs.rst", "autodir_options_c/fnocc__dipmom.rst", "autodir_options_c/fnocc__e_convergence.rst", "autodir_options_c/fnocc__maxiter.rst", "autodir_options_c/fnocc__mp2_scale_os.rst", "autodir_options_c/fnocc__mp2_scale_ss.rst", "autodir_options_c/fnocc__nat_orbs.rst", "autodir_options_c/fnocc__occ_percentage.rst", "autodir_options_c/fnocc__occ_tolerance.rst", "autodir_options_c/fnocc__r_convergence.rst", "autodir_options_c/fnocc__run_ccsd.rst", "autodir_options_c/fnocc__run_cepa.rst", "autodir_options_c/fnocc__run_mp2.rst", "autodir_options_c/fnocc__run_mp3.rst", "autodir_options_c/fnocc__run_mp4.rst", "autodir_options_c/fnocc__scs_ccsd.rst", "autodir_options_c/fnocc__scs_cepa.rst", "autodir_options_c/fnocc__scs_mp2.rst", "autodir_options_c/fnocc__triples_low_memory.rst", "autodir_options_c/fnocc__use_df_ints.rst", "autodir_options_c/gdma__gdma_limit.rst", "autodir_options_c/gdma__gdma_multipole_units.rst", "autodir_options_c/gdma__gdma_origin.rst", "autodir_options_c/gdma__gdma_radius.rst", "autodir_options_c/gdma__gdma_switch.rst", "autodir_options_c/globals__active.rst", "autodir_options_c/globals__basis_relativistic.rst", "autodir_options_c/globals__bench.rst", "autodir_options_c/globals__brianqc_enable.rst", "autodir_options_c/globals__cc_type.rst", "autodir_options_c/globals__ci_type.rst", "autodir_options_c/globals__cubeprop_basis_functions.rst", "autodir_options_c/globals__cubeprop_filepath.rst", "autodir_options_c/globals__cubeprop_isocontour_threshold.rst", "autodir_options_c/globals__cubeprop_orbitals.rst", "autodir_options_c/globals__cubeprop_tasks.rst", "autodir_options_c/globals__cubic_basis_tolerance.rst", "autodir_options_c/globals__cubic_block_max_points.rst", "autodir_options_c/globals__cubic_grid_overage.rst", "autodir_options_c/globals__cubic_grid_spacing.rst", "autodir_options_c/globals__ddx.rst", "autodir_options_c/globals__debug.rst", "autodir_options_c/globals__dertype.rst", "autodir_options_c/globals__df_basis_cc.rst", "autodir_options_c/globals__die_if_not_converged.rst", "autodir_options_c/globals__dkh_order.rst", "autodir_options_c/globals__docc.rst", "autodir_options_c/globals__external_potential_symmetry.rst", "autodir_options_c/globals__freeze_core.rst", "autodir_options_c/globals__freeze_core_policy.rst", "autodir_options_c/globals__frozen_docc.rst", "autodir_options_c/globals__frozen_uocc.rst", "autodir_options_c/globals__integral_package.rst", "autodir_options_c/globals__literal_cfour.rst", "autodir_options_c/globals__ls_thc_basis_tolerance.rst", "autodir_options_c/globals__ls_thc_df.rst", "autodir_options_c/globals__ls_thc_pruning_scheme.rst", "autodir_options_c/globals__ls_thc_radial_points.rst", "autodir_options_c/globals__ls_thc_s_epsilon.rst", "autodir_options_c/globals__ls_thc_spherical_points.rst", "autodir_options_c/globals__ls_thc_weights_tolerance.rst", "autodir_options_c/globals__mat_num_column_print.rst", "autodir_options_c/globals__max_radial_moment.rst", "autodir_options_c/globals__mbis_d_convergence.rst", "autodir_options_c/globals__mbis_maxiter.rst", "autodir_options_c/globals__mbis_pruning_scheme.rst", "autodir_options_c/globals__mbis_radial_points.rst", "autodir_options_c/globals__mbis_spherical_points.rst", "autodir_options_c/globals__molden_with_virtual.rst", "autodir_options_c/globals__mp2_type.rst", "autodir_options_c/globals__mp_type.rst", "autodir_options_c/globals__num_frozen_docc.rst", "autodir_options_c/globals__num_frozen_uocc.rst", "autodir_options_c/globals__parent_symmetry.rst", "autodir_options_c/globals__pcm.rst", "autodir_options_c/globals__pe.rst", "autodir_options_c/globals__print.rst", "autodir_options_c/globals__print_noons.rst", "autodir_options_c/globals__properties.rst", "autodir_options_c/globals__properties_origin.rst", "autodir_options_c/globals__puream.rst", "autodir_options_c/globals__qc_module.rst", "autodir_options_c/globals__ras1.rst", "autodir_options_c/globals__ras2.rst", "autodir_options_c/globals__ras3.rst", "autodir_options_c/globals__ras4.rst", "autodir_options_c/globals__relativistic.rst", "autodir_options_c/globals__restricted_docc.rst", "autodir_options_c/globals__restricted_uocc.rst", "autodir_options_c/globals__scf_type.rst", "autodir_options_c/globals__screening.rst", "autodir_options_c/globals__socc.rst", "autodir_options_c/globals__wfn.rst", "autodir_options_c/globals__writer_file_label.rst", "autodir_options_c/mcscf__canonicalize_active_favg.rst", "autodir_options_c/mcscf__canonicalize_inactive_favg.rst", "autodir_options_c/mcscf__ci_diis.rst", "autodir_options_c/mcscf__d_convergence.rst", "autodir_options_c/mcscf__diis.rst", "autodir_options_c/mcscf__diis_max_vecs.rst", "autodir_options_c/mcscf__docc.rst", "autodir_options_c/mcscf__e_convergence.rst", "autodir_options_c/mcscf__favg.rst", "autodir_options_c/mcscf__favg_start.rst", "autodir_options_c/mcscf__follow_root.rst", "autodir_options_c/mcscf__force_twocon.rst", "autodir_options_c/mcscf__internal_rotations.rst", "autodir_options_c/mcscf__level_shift.rst", "autodir_options_c/mcscf__maxiter.rst", "autodir_options_c/mcscf__mo_read.rst", "autodir_options_c/mcscf__reference.rst", "autodir_options_c/mcscf__rotate_mo_angle.rst", "autodir_options_c/mcscf__rotate_mo_irrep.rst", "autodir_options_c/mcscf__rotate_mo_p.rst", "autodir_options_c/mcscf__rotate_mo_q.rst", "autodir_options_c/mcscf__socc.rst", "autodir_options_c/mcscf__turn_on_actv.rst", "autodir_options_c/mcscf__wfn_sym.rst", "autodir_options_c/mints__basis.rst", "autodir_options_c/mints__omega_erf.rst", "autodir_options_c/module__adc.rst", "autodir_options_c/module__ccdensity.rst", "autodir_options_c/module__ccenergy.rst", "autodir_options_c/module__cceom.rst", "autodir_options_c/module__cchbar.rst", "autodir_options_c/module__cclambda.rst", "autodir_options_c/module__ccresponse.rst", "autodir_options_c/module__cctransort.rst", "autodir_options_c/module__cctriples.rst", "autodir_options_c/module__cfour.rst", "autodir_options_c/module__cphf.rst", "autodir_options_c/module__dct.rst", "autodir_options_c/module__ddx.rst", "autodir_options_c/module__detci.rst", "autodir_options_c/module__dfep2.rst", "autodir_options_c/module__dfmp2.rst", "autodir_options_c/module__dfocc.rst", "autodir_options_c/module__dlpno.rst", "autodir_options_c/module__dmrg.rst", "autodir_options_c/module__efp.rst", "autodir_options_c/module__findif.rst", "autodir_options_c/module__fisapt.rst", "autodir_options_c/module__fnocc.rst", "autodir_options_c/module__gdma.rst", "autodir_options_c/module__globals.rst", "autodir_options_c/module__mcscf.rst", "autodir_options_c/module__mints.rst", "autodir_options_c/module__mrcc.rst", "autodir_options_c/module__occ.rst", "autodir_options_c/module__optking.rst", "autodir_options_c/module__pcm.rst", "autodir_options_c/module__pe.rst", "autodir_options_c/module__psimrcc.rst", "autodir_options_c/module__sapt.rst", "autodir_options_c/module__scf.rst", "autodir_options_c/module__thermo.rst", "autodir_options_c/mrcc__e_convergence.rst", "autodir_options_c/mrcc__ints_tolerance.rst", "autodir_options_c/mrcc__mrcc_level.rst", "autodir_options_c/mrcc__mrcc_method.rst", "autodir_options_c/mrcc__mrcc_num_doublet_roots.rst", "autodir_options_c/mrcc__mrcc_num_singlet_roots.rst", "autodir_options_c/mrcc__mrcc_num_triplet_roots.rst", "autodir_options_c/mrcc__mrcc_omp_num_threads.rst", "autodir_options_c/mrcc__mrcc_restart.rst", "autodir_options_c/occ__cachelevel.rst", "autodir_options_c/occ__cc_maxiter.rst", "autodir_options_c/occ__ccl_energy.rst", "autodir_options_c/occ__cepa_os_scale.rst", "autodir_options_c/occ__cepa_sos_scale.rst", "autodir_options_c/occ__cepa_ss_scale.rst", "autodir_options_c/occ__cepa_type.rst", "autodir_options_c/occ__cutoff.rst", "autodir_options_c/occ__diis_max_vecs.rst", "autodir_options_c/occ__diis_min_vecs.rst", "autodir_options_c/occ__do_diis.rst", "autodir_options_c/occ__do_level_shift.rst", "autodir_options_c/occ__do_scs.rst", "autodir_options_c/occ__do_sos.rst", "autodir_options_c/occ__e3_scale.rst", "autodir_options_c/occ__e_convergence.rst", "autodir_options_c/occ__ea_poles.rst", "autodir_options_c/occ__ekt_ea.rst", "autodir_options_c/occ__ekt_ip.rst", "autodir_options_c/occ__ep_ea_poles.rst", "autodir_options_c/occ__ep_ip_poles.rst", "autodir_options_c/occ__ep_maxiter.rst", "autodir_options_c/occ__ip_poles.rst", "autodir_options_c/occ__level_shift.rst", "autodir_options_c/occ__max_mograd_convergence.rst", "autodir_options_c/occ__mo_maxiter.rst", "autodir_options_c/occ__mo_read.rst", "autodir_options_c/occ__mo_step_max.rst", "autodir_options_c/occ__mo_write.rst", "autodir_options_c/occ__mograd_damping.rst", "autodir_options_c/occ__mp2_os_scale.rst", "autodir_options_c/occ__mp2_sos_scale.rst", "autodir_options_c/occ__mp2_sos_scale2.rst", "autodir_options_c/occ__mp2_ss_scale.rst", "autodir_options_c/occ__nat_orbs.rst", "autodir_options_c/occ__occ_orbs_print.rst", "autodir_options_c/occ__oeprop.rst", "autodir_options_c/occ__opt_method.rst", "autodir_options_c/occ__orb_opt.rst", "autodir_options_c/occ__orb_resp_solver.rst", "autodir_options_c/occ__orth_type.rst", "autodir_options_c/occ__os_scale.rst", "autodir_options_c/occ__pcg_beta_type.rst", "autodir_options_c/occ__pcg_convergence.rst", "autodir_options_c/occ__pcg_maxiter.rst", "autodir_options_c/occ__r_convergence.rst", "autodir_options_c/occ__relaxed.rst", "autodir_options_c/occ__remp_a.rst", "autodir_options_c/occ__rms_mograd_convergence.rst", "autodir_options_c/occ__scs_type.rst", "autodir_options_c/occ__sos_type.rst", "autodir_options_c/occ__spin_scale_type.rst", "autodir_options_c/occ__ss_scale.rst", "autodir_options_c/occ__symmetrize.rst", "autodir_options_c/occ__tpdm_abcd_type.rst", "autodir_options_c/occ__wfn_type.rst", "autodir_options_c/optking__add_auxiliary_bonds.rst", "autodir_options_c/optking__auxiliary_bond_factor.rst", "autodir_options_c/optking__cart_hess_read.rst", "autodir_options_c/optking__cartesian_sym_tolerance.rst", "autodir_options_c/optking__consecutive_backsteps.rst", "autodir_options_c/optking__covalent_connect.rst", "autodir_options_c/optking__custom_coords.rst", "autodir_options_c/optking__dynamic_level.rst", "autodir_options_c/optking__ensure_bt_convergence.rst", "autodir_options_c/optking__ext_force_bend.rst", "autodir_options_c/optking__ext_force_cartesian.rst", "autodir_options_c/optking__ext_force_dihedral.rst", "autodir_options_c/optking__ext_force_distance.rst", "autodir_options_c/optking__ext_force_oofp.rst", "autodir_options_c/optking__flexible_g_convergence.rst", "autodir_options_c/optking__frag_mode.rst", "autodir_options_c/optking__frag_ref_atoms.rst", "autodir_options_c/optking__freeze_all_dihedrals.rst", "autodir_options_c/optking__freeze_interfrag.rst", "autodir_options_c/optking__freeze_intrafrag.rst", "autodir_options_c/optking__frozen_bend.rst", "autodir_options_c/optking__frozen_cartesian.rst", "autodir_options_c/optking__frozen_dihedral.rst", "autodir_options_c/optking__frozen_distance.rst", "autodir_options_c/optking__frozen_oofp.rst", "autodir_options_c/optking__full_hess_every.rst", "autodir_options_c/optking__g_convergence.rst", "autodir_options_c/optking__geom_maxiter.rst", "autodir_options_c/optking__h_bond_connect.rst", "autodir_options_c/optking__h_guess_every.rst", "autodir_options_c/optking__h_update_den_tol.rst", "autodir_options_c/optking__hess_update.rst", "autodir_options_c/optking__hess_update_limit.rst", "autodir_options_c/optking__hess_update_limit_max.rst", "autodir_options_c/optking__hess_update_limit_scale.rst", "autodir_options_c/optking__hess_update_use_last.rst", "autodir_options_c/optking__intcos_generate_exit.rst", "autodir_options_c/optking__interfrag_collinear_tol.rst", "autodir_options_c/optking__interfrag_coords.rst", "autodir_options_c/optking__interfrag_dist_inv.rst", "autodir_options_c/optking__interfrag_hess.rst", "autodir_options_c/optking__interfrag_mode.rst", "autodir_options_c/optking__interfrag_step_limit.rst", "autodir_options_c/optking__interfragment_connect.rst", "autodir_options_c/optking__intrafrag_hess.rst", "autodir_options_c/optking__intrafrag_step_limit.rst", "autodir_options_c/optking__intrafrag_step_limit_max.rst", "autodir_options_c/optking__intrafrag_step_limit_min.rst", "autodir_options_c/optking__irc_direction.rst", "autodir_options_c/optking__irc_points.rst", "autodir_options_c/optking__irc_step_size.rst", "autodir_options_c/optking__max_disp_g_convergence.rst", "autodir_options_c/optking__max_energy_g_convergence.rst", "autodir_options_c/optking__max_force_g_convergence.rst", "autodir_options_c/optking__opt_coordinates.rst", "autodir_options_c/optking__opt_restart.rst", "autodir_options_c/optking__opt_type.rst", "autodir_options_c/optking__print_opt_params.rst", "autodir_options_c/optking__print_trajectory_xyz_file.rst", "autodir_options_c/optking__ranged_bend.rst", "autodir_options_c/optking__ranged_dihedral.rst", "autodir_options_c/optking__ranged_distance.rst", "autodir_options_c/optking__ranged_oofp.rst", "autodir_options_c/optking__rfo_follow_root.rst", "autodir_options_c/optking__rfo_normalization_max.rst", "autodir_options_c/optking__rfo_root.rst", "autodir_options_c/optking__rms_disp_g_convergence.rst", "autodir_options_c/optking__rms_force_g_convergence.rst", "autodir_options_c/optking__rsrfo_alpha_max.rst", "autodir_options_c/optking__save_optimization.rst", "autodir_options_c/optking__step_type.rst", "autodir_options_c/optking__test_b.rst", "autodir_options_c/optking__test_derivative_b.rst", "autodir_options_c/optking__unfreeze_dihedrals.rst", "autodir_options_c/optking__write_opt_history.rst", "autodir_options_c/optking__write_opt_result.rst", "autodir_options_c/optking__write_trajectory.rst", "autodir_options_c/pcm__pcm_cc_type.rst", "autodir_options_c/pcm__pcm_scf_type.rst", "autodir_options_c/pcm__pcmsolver_parsed_fname.rst", "autodir_options_c/pe__border.rst", "autodir_options_c/pe__border_n_redist.rst", "autodir_options_c/pe__border_redist_order.rst", "autodir_options_c/pe__border_redist_pol.rst", "autodir_options_c/pe__border_rmin.rst", "autodir_options_c/pe__border_rmin_unit.rst", "autodir_options_c/pe__border_type.rst", "autodir_options_c/pe__damp_induced.rst", "autodir_options_c/pe__damp_multipole.rst", "autodir_options_c/pe__damping_factor_induced.rst", "autodir_options_c/pe__damping_factor_multipole.rst", "autodir_options_c/pe__induced_convergence.rst", "autodir_options_c/pe__isotropic_pol.rst", "autodir_options_c/pe__maxiter.rst", "autodir_options_c/pe__pe_ecp.rst", "autodir_options_c/pe__potfile.rst", "autodir_options_c/pe__summation_fields.rst", "autodir_options_c/pe__tree_expansion_order.rst", "autodir_options_c/pe__tree_theta.rst", "autodir_options_c/psimrcc__cc_num_threads.rst", "autodir_options_c/psimrcc__corr_ansatz.rst", "autodir_options_c/psimrcc__corr_ccsd_t.rst", "autodir_options_c/psimrcc__corr_charge.rst", "autodir_options_c/psimrcc__corr_multp.rst", "autodir_options_c/psimrcc__corr_wfn.rst", "autodir_options_c/psimrcc__coupling.rst", "autodir_options_c/psimrcc__coupling_terms.rst", "autodir_options_c/psimrcc__damping_percentage.rst", "autodir_options_c/psimrcc__diagonal_ccsd_t.rst", "autodir_options_c/psimrcc__diagonalize_heff.rst", "autodir_options_c/psimrcc__diis_max_vecs.rst", "autodir_options_c/psimrcc__diis_start.rst", "autodir_options_c/psimrcc__e_convergence.rst", "autodir_options_c/psimrcc__favg_ccsd_t.rst", "autodir_options_c/psimrcc__follow_root.rst", "autodir_options_c/psimrcc__heff4.rst", "autodir_options_c/psimrcc__heff_print.rst", "autodir_options_c/psimrcc__lock_singlet.rst", "autodir_options_c/psimrcc__maxiter.rst", "autodir_options_c/psimrcc__mp2_ccsd_method.rst", "autodir_options_c/psimrcc__mp2_guess.rst", "autodir_options_c/psimrcc__no_singles.rst", "autodir_options_c/psimrcc__offdiagonal_ccsd_t.rst", "autodir_options_c/psimrcc__perturb_cbs.rst", "autodir_options_c/psimrcc__perturb_cbs_coupling.rst", "autodir_options_c/psimrcc__pt_energy.rst", "autodir_options_c/psimrcc__r_convergence.rst", "autodir_options_c/psimrcc__small_cutoff.rst", "autodir_options_c/psimrcc__tikhonow_max.rst", "autodir_options_c/psimrcc__tikhonow_omega.rst", "autodir_options_c/psimrcc__tikhonow_triples.rst", "autodir_options_c/psimrcc__triples_algorithm.rst", "autodir_options_c/psimrcc__triples_diis.rst", "autodir_options_c/psimrcc__use_spin_sym.rst", "autodir_options_c/psimrcc__use_spin_symmetry.rst", "autodir_options_c/psimrcc__wfn_sym.rst", "autodir_options_c/psimrcc__zero_internal_amps.rst", "autodir_options_c/sapt__aio_cphf.rst", "autodir_options_c/sapt__aio_df_ints.rst", "autodir_options_c/sapt__basis.rst", "autodir_options_c/sapt__ccd_e_convergence.rst", "autodir_options_c/sapt__ccd_maxiter.rst", "autodir_options_c/sapt__ccd_t_convergence.rst", "autodir_options_c/sapt__coupled_induction.rst", "autodir_options_c/sapt__cphf_r_convergence.rst", "autodir_options_c/sapt__denominator_algorithm.rst", "autodir_options_c/sapt__denominator_delta.rst", "autodir_options_c/sapt__df_basis_elst.rst", "autodir_options_c/sapt__df_basis_sapt.rst", "autodir_options_c/sapt__do_ccd_disp.rst", "autodir_options_c/sapt__do_disp_exch_sinf.rst", "autodir_options_c/sapt__do_ind30_exch_sinf.rst", "autodir_options_c/sapt__do_ind_exch_sinf.rst", "autodir_options_c/sapt__do_mbpt_disp.rst", "autodir_options_c/sapt__do_third_order.rst", "autodir_options_c/sapt__exch_scale_alpha.rst", "autodir_options_c/sapt__freeze_core.rst", "autodir_options_c/sapt__ints_tolerance.rst", "autodir_options_c/sapt__max_ccd_diisvecs.rst", "autodir_options_c/sapt__maxiter.rst", "autodir_options_c/sapt__min_ccd_diisvecs.rst", "autodir_options_c/sapt__nat_orbs_t2.rst", "autodir_options_c/sapt__nat_orbs_t3.rst", "autodir_options_c/sapt__nat_orbs_v4.rst", "autodir_options_c/sapt__occ_tolerance.rst", "autodir_options_c/sapt__print.rst", "autodir_options_c/sapt__sapt0_e10.rst", "autodir_options_c/sapt__sapt0_e20disp.rst", "autodir_options_c/sapt__sapt0_e20ind.rst", "autodir_options_c/sapt__sapt_dft_do_dhf.rst", "autodir_options_c/sapt__sapt_dft_do_hybrid.rst", "autodir_options_c/sapt__sapt_dft_exch_disp_fixed_scale.rst", "autodir_options_c/sapt__sapt_dft_exch_disp_scale_scheme.rst", "autodir_options_c/sapt__sapt_dft_functional.rst", "autodir_options_c/sapt__sapt_dft_grac_determination.rst", "autodir_options_c/sapt__sapt_dft_grac_shift_a.rst", "autodir_options_c/sapt__sapt_dft_grac_shift_b.rst", "autodir_options_c/sapt__sapt_dft_mp2_disp_alg.rst", "autodir_options_c/sapt__sapt_fdds_disp_leg_lambda.rst", "autodir_options_c/sapt__sapt_fdds_disp_num_points.rst", "autodir_options_c/sapt__sapt_fdds_v2_rho_cutoff.rst", "autodir_options_c/sapt__sapt_level.rst", "autodir_options_c/sapt__sapt_mem_check.rst", "autodir_options_c/sapt__sapt_mem_factor.rst", "autodir_options_c/sapt__sapt_mem_safety.rst", "autodir_options_c/sapt__sapt_quiet.rst", "autodir_options_c/scf__basis.rst", "autodir_options_c/scf__basis_guess.rst", "autodir_options_c/scf__cholesky_tolerance.rst", "autodir_options_c/scf__cosx_basis_tolerance.rst", "autodir_options_c/scf__cosx_density_tolerance.rst", "autodir_options_c/scf__cosx_ints_tolerance.rst", "autodir_options_c/scf__cosx_maxiter_final.rst", "autodir_options_c/scf__cosx_overlap_fitting.rst", "autodir_options_c/scf__cosx_pruning_scheme.rst", "autodir_options_c/scf__cosx_radial_points_final.rst", "autodir_options_c/scf__cosx_radial_points_initial.rst", "autodir_options_c/scf__cosx_spherical_points_final.rst", "autodir_options_c/scf__cosx_spherical_points_initial.rst", "autodir_options_c/scf__d_convergence.rst", "autodir_options_c/scf__damping_convergence.rst", "autodir_options_c/scf__damping_percentage.rst", "autodir_options_c/scf__df_basis_guess.rst", "autodir_options_c/scf__df_basis_sad.rst", "autodir_options_c/scf__df_basis_scf.rst", "autodir_options_c/scf__df_bump_r0.rst", "autodir_options_c/scf__df_bump_r1.rst", "autodir_options_c/scf__df_domains.rst", "autodir_options_c/scf__df_fitting_condition.rst", "autodir_options_c/scf__df_ints_io.rst", "autodir_options_c/scf__df_ints_num_threads.rst", "autodir_options_c/scf__df_metric.rst", "autodir_options_c/scf__df_scf_guess.rst", "autodir_options_c/scf__df_theta.rst", "autodir_options_c/scf__dft_alpha.rst", "autodir_options_c/scf__dft_alpha_c.rst", "autodir_options_c/scf__dft_basis_tolerance.rst", "autodir_options_c/scf__dft_block_max_points.rst", "autodir_options_c/scf__dft_block_max_radius.rst", "autodir_options_c/scf__dft_block_min_points.rst", "autodir_options_c/scf__dft_block_scheme.rst", "autodir_options_c/scf__dft_bs_radius_alpha.rst", "autodir_options_c/scf__dft_density_tolerance.rst", "autodir_options_c/scf__dft_dispersion_parameters.rst", "autodir_options_c/scf__dft_grac_alpha.rst", "autodir_options_c/scf__dft_grac_beta.rst", "autodir_options_c/scf__dft_grac_c_func.rst", "autodir_options_c/scf__dft_grac_shift.rst", "autodir_options_c/scf__dft_grac_x_func.rst", "autodir_options_c/scf__dft_grid_name.rst", "autodir_options_c/scf__dft_nuclear_scheme.rst", "autodir_options_c/scf__dft_omega.rst", "autodir_options_c/scf__dft_omega_c.rst", "autodir_options_c/scf__dft_pruning_alpha.rst", "autodir_options_c/scf__dft_pruning_scheme.rst", "autodir_options_c/scf__dft_radial_points.rst", "autodir_options_c/scf__dft_radial_scheme.rst", "autodir_options_c/scf__dft_remove_distant_points.rst", "autodir_options_c/scf__dft_spherical_points.rst", "autodir_options_c/scf__dft_spherical_scheme.rst", "autodir_options_c/scf__dft_v2_rho_cutoff.rst", "autodir_options_c/scf__dft_vv10_b.rst", "autodir_options_c/scf__dft_vv10_c.rst", "autodir_options_c/scf__dft_vv10_postscf.rst", "autodir_options_c/scf__dft_vv10_radial_points.rst", "autodir_options_c/scf__dft_vv10_rho_cutoff.rst", "autodir_options_c/scf__dft_vv10_spherical_points.rst", "autodir_options_c/scf__dft_weights_tolerance.rst", "autodir_options_c/scf__diis.rst", "autodir_options_c/scf__diis_max_vecs.rst", "autodir_options_c/scf__diis_min_vecs.rst", "autodir_options_c/scf__diis_rms_error.rst", "autodir_options_c/scf__diis_start.rst", "autodir_options_c/scf__distributed_matrix.rst", "autodir_options_c/scf__e_convergence.rst", "autodir_options_c/scf__extern.rst", "autodir_options_c/scf__fail_on_maxiter.rst", "autodir_options_c/scf__follow_step_increment.rst", "autodir_options_c/scf__follow_step_scale.rst", "autodir_options_c/scf__frac_diis.rst", "autodir_options_c/scf__frac_load.rst", "autodir_options_c/scf__frac_occ.rst", "autodir_options_c/scf__frac_renormalize.rst", "autodir_options_c/scf__frac_start.rst", "autodir_options_c/scf__frac_val.rst", "autodir_options_c/scf__guess.rst", "autodir_options_c/scf__guess_mix.rst", "autodir_options_c/scf__guess_persist.rst", "autodir_options_c/scf__incfock.rst", "autodir_options_c/scf__incfock_convergence.rst", "autodir_options_c/scf__incfock_full_fock_every.rst", "autodir_options_c/scf__ints_tolerance.rst", "autodir_options_c/scf__level_shift.rst", "autodir_options_c/scf__level_shift_cutoff.rst", "autodir_options_c/scf__link_ints_tolerance.rst", "autodir_options_c/scf__local_convergence.rst", "autodir_options_c/scf__local_maxiter.rst", "autodir_options_c/scf__max_attempts.rst", "autodir_options_c/scf__max_mem_buf.rst", "autodir_options_c/scf__maxiter.rst", "autodir_options_c/scf__molden_write.rst", "autodir_options_c/scf__mom_occ.rst", "autodir_options_c/scf__mom_start.rst", "autodir_options_c/scf__mom_vir.rst", "autodir_options_c/scf__nl_dispersion_parameters.rst", "autodir_options_c/scf__onepot_grid_read.rst", "autodir_options_c/scf__orbitals_write.rst", "autodir_options_c/scf__parallel.rst", "autodir_options_c/scf__perturb_dipole.rst", "autodir_options_c/scf__perturb_h.rst", "autodir_options_c/scf__perturb_magnitude.rst", "autodir_options_c/scf__perturb_with.rst", "autodir_options_c/scf__phi_points.rst", "autodir_options_c/scf__pk_all_nonsym.rst", "autodir_options_c/scf__pk_max_buckets.rst", "autodir_options_c/scf__print_basis.rst", "autodir_options_c/scf__print_mos.rst", "autodir_options_c/scf__process_grid.rst", "autodir_options_c/scf__qchf.rst", "autodir_options_c/scf__r_points.rst", "autodir_options_c/scf__radius.rst", "autodir_options_c/scf__reference.rst", "autodir_options_c/scf__s_cholesky_tolerance.rst", "autodir_options_c/scf__s_orthogonalization.rst", "autodir_options_c/scf__s_tolerance.rst", "autodir_options_c/scf__sad_chol_tolerance.rst", "autodir_options_c/scf__sad_d_convergence.rst", "autodir_options_c/scf__sad_e_convergence.rst", "autodir_options_c/scf__sad_frac_occ.rst", "autodir_options_c/scf__sad_maxiter.rst", "autodir_options_c/scf__sad_print.rst", "autodir_options_c/scf__sad_scf_type.rst", "autodir_options_c/scf__sad_spin_average.rst", "autodir_options_c/scf__sapgau_basis.rst", "autodir_options_c/scf__sapt.rst", "autodir_options_c/scf__save_jk.rst", "autodir_options_c/scf__save_uhf_nos.rst", "autodir_options_c/scf__scf_initial_accelerator.rst", "autodir_options_c/scf__scf_initial_finish_diis_transition.rst", "autodir_options_c/scf__scf_initial_start_diis_transition.rst", "autodir_options_c/scf__scf_mem_safety_factor.rst", "autodir_options_c/scf__scf_properties.rst", "autodir_options_c/scf__scf_subtype.rst", "autodir_options_c/scf__snlink_basis_tolerance.rst", "autodir_options_c/scf__snlink_density_tolerance.rst", "autodir_options_c/scf__snlink_force_cartesian.rst", "autodir_options_c/scf__snlink_gpu_mem.rst", "autodir_options_c/scf__snlink_grid_batch_size.rst", "autodir_options_c/scf__snlink_integrator_kernel.rst", "autodir_options_c/scf__snlink_ints_tolerance.rst", "autodir_options_c/scf__snlink_load_balancer_kernel.rst", "autodir_options_c/scf__snlink_lwd_kernel.rst", "autodir_options_c/scf__snlink_mol_weights_kernel.rst", "autodir_options_c/scf__snlink_pruning_scheme.rst", "autodir_options_c/scf__snlink_radial_points.rst", "autodir_options_c/scf__snlink_radial_scheme.rst", "autodir_options_c/scf__snlink_reduction_kernel.rst", "autodir_options_c/scf__snlink_spherical_points.rst", "autodir_options_c/scf__snlink_use_debug_grid.rst", "autodir_options_c/scf__snlink_use_gpu.rst", "autodir_options_c/scf__solver_convergence.rst", "autodir_options_c/scf__solver_maxiter.rst", "autodir_options_c/scf__solver_n_guess.rst", "autodir_options_c/scf__solver_n_root.rst", "autodir_options_c/scf__solver_roots_per_irrep.rst", "autodir_options_c/scf__soscf.rst", "autodir_options_c/scf__soscf_conv.rst", "autodir_options_c/scf__soscf_max_iter.rst", "autodir_options_c/scf__soscf_min_iter.rst", "autodir_options_c/scf__soscf_print.rst", "autodir_options_c/scf__soscf_start_convergence.rst", "autodir_options_c/scf__stability_analysis.rst", "autodir_options_c/scf__tdscf_coeff_cutoff.rst", "autodir_options_c/scf__tdscf_guess.rst", "autodir_options_c/scf__tdscf_maxiter.rst", "autodir_options_c/scf__tdscf_print.rst", "autodir_options_c/scf__tdscf_r_convergence.rst", "autodir_options_c/scf__tdscf_states.rst", "autodir_options_c/scf__tdscf_tda.rst", "autodir_options_c/scf__tdscf_tdm_print.rst", "autodir_options_c/scf__tdscf_triplets.rst", "autodir_options_c/scf__theta_points.rst", "autodir_options_c/scf__thickness.rst", "autodir_options_c/scf__tile_sz.rst", "autodir_options_c/scf__uhf_noons.rst", "autodir_options_c/scf__wcombine.rst", "autodir_options_c/scf__wfn.rst", "autodir_options_c/thermo__p.rst", "autodir_options_c/thermo__rotational_symmetry_number.rst", "autodir_options_c/thermo__t.rst", "autodir_psivariables/module__adc.rst", "autodir_psivariables/module__ccenergy.rst", "autodir_psivariables/module__cfour.rst", "autodir_psivariables/module__dct.rst", "autodir_psivariables/module__ddx.rst", "autodir_psivariables/module__detci.rst", "autodir_psivariables/module__dfmp2.rst", "autodir_psivariables/module__dfocc.rst", "autodir_psivariables/module__dlpno.rst", "autodir_psivariables/module__dmrg.rst", "autodir_psivariables/module__efp.rst", "autodir_psivariables/module__fisapt.rst", "autodir_psivariables/module__fnocc.rst", "autodir_psivariables/module__gdma.rst", "autodir_psivariables/module__mcscf.rst", "autodir_psivariables/module__mrcc.rst", "autodir_psivariables/module__occ.rst", "autodir_psivariables/module__oeprop.rst", "autodir_psivariables/module__pcm.rst", "autodir_psivariables/module__pe.rst", "autodir_psivariables/module__psimrcc.rst", "autodir_psivariables/module__sapt.rst", "autodir_psivariables/module__scf.rst", "autodir_psivariables/module__thermo.rst", "autodoc_available_databases.rst", "autodoc_available_efpfrag.rst", "autodoc_basissets_byfamily.rst", "autodoc_dft_all.rst", "autodoc_dft_dhybrid.rst", "autodoc_dft_disp.rst", "autodoc_dft_energy.rst", "autodoc_dft_gga.rst", "autodoc_dft_hybrid.rst", "autodoc_dft_lrc.rst", "autodoc_dft_meta.rst", "autodoc_dft_opt.rst", "autodoc_glossary_options_c.rst", "autodoc_options_c_bymodule.rst", "autodoc_physconst.rst", "autodoc_psi4bases.rst", "autodoc_psifiles.rst", "autodoc_psivariables_bymodule.rst", "autodoc_testsuite_brianqc.rst", "autodoc_testsuite_cfour.rst", "autodoc_testsuite_chemps2.rst", "autodoc_testsuite_cookbook.rst", "autodoc_testsuite_corepsi4.rst", "autodoc_testsuite_dftd3.rst", "autodoc_testsuite_dftd4.rst", "autodoc_testsuite_dkh.rst", "autodoc_testsuite_gcp.rst", "autodoc_testsuite_gdma.rst", "autodoc_testsuite_gpu_dfcc.rst", "autodoc_testsuite_json.rst", "autodoc_testsuite_libefp.rst", "autodoc_testsuite_mrcc.rst", "autodoc_testsuite_pcmsolver.rst", "autodoc_testsuite_psi4numpy.rst", "autodoc_testsuite_python.rst", "autodoc_testsuite_simint.rst", "autodoc_testsuite_snsmp2.rst", "autodoc_testsuite_v2rdm_casscf.rst", "basissets.rst", "basissets_byelement.rst", "basissets_byfamily.rst", "basissets_tables.rst", "bibliography.rst", "brianqc.rst", "build_faq.rst", "build_obtaining.rst", "build_planning.rst", "capabilities.rst", "cbs.rst", "cbs_eqn.rst", "cc.rst", "cfour.rst", "cfour_table_energy.rst", "cfour_table_grad.rst", "chemps2.rst", "code_style.rst", "conda.rst", "cppe.rst", "cubeprop.rst", "customizing.rst", "db.rst", "dct.rst", "ddx.rst", "detci.rst", "dfmp2.rst", "dft.rst", "dft_byfunctional.rst", "dftd3.rst", "dftnl.rst", "diatomic.rst", "dkh.rst", "dlpnomp2.rst", "documentation.rst", "ecpint.rst", "energy.rst", "external.rst", "external_apis.rst", "fchk.rst", "fisapt.rst", "fnocc.rst", "freq.rst", "gau2grid.rst", "gcp.rst", "gdma.rst", "glossary_psivariables.rst", "index.rst", "index_tutorials.rst", "intercalls.rst", "interfacing.rst", "introduction.rst", "libefp.rst", "libint.rst", "libxc.rst", "manage_addon.rst", "manage_git.rst", "manage_index.rst", "manage_release.rst", "mcscf.rst", "methods.rst", "molden.rst", "mrcc.rst", "mrcc_table_energy.rst", "nbody.rst", "notes_c.rst", "notes_py.rst", "numpy.rst", "occ.rst", "oeprop.rst", "opt.rst", "optionshandling.rst", "optking.rst", "pcmsolver.rst", "pep0001.rst", "plugin_psi4fockci.rst", "plugin_snsmp2.rst", "plugin_v2rdm_casscf.rst", "plugins.rst", "proc_py.rst", "prog_blas.rst", "prog_conduct.rst", "prog_corelibs.rst", "prog_debug_profile.rst", "prog_faq.rst", "prog_full_integration.rst", "prog_help.rst", "prog_integrals.rst", "prog_intro.rst", "prog_newcode.rst", "prog_setup.rst", "prog_style_c.rst", "prog_style_py.rst", "prog_tour.rst", "prog_ways_to_add.rst", "prog_welcome.rst", "prop.rst", "psi4api.rst", "psiapi.ipynb", "psimrcc.rst", "psipep.rst", "psithonfunc.rst", "psithoninput.rst", "psithonmol.rst", "quickaddalias.rst", "quickadddatabase.rst", "relativistic.rst", "sapt.rst", "scf.rst", "simint.rst", "sowreap.rst", "tdscf.rst", "testsuite.rst", "thermo.rst", "tutorial.rst"], "indexentries": {"(at) correction energy": [[1776, "psivar-AT-CORRECTION-ENERGY", false]], "(t) correction energy": [[1776, "psivar-0", false]], "--append": [[1767, "cmdoption-psi4-a", false]], "--help": [[1767, "cmdoption-psi4-h", false]], "--inplace": [[1767, "cmdoption-psi4-inplace", false]], "--input": [[1767, "cmdoption-psi4-i", false]], "--loglevel": [[1767, "cmdoption-psi4-loglevel", false]], "--memory": [[1767, "cmdoption-psi4-memory", false]], "--messy": [[1767, "cmdoption-psi4-m", false]], "--module": [[1767, "cmdoption-psi4-module", false]], "--nthread": [[1767, "cmdoption-psi4-n", false]], "--output": [[1767, "cmdoption-psi4-o", false]], "--psiapi-path": [[1767, "cmdoption-psi4-psiapi-path", false]], "--psidatadir": [[1767, "cmdoption-psi4-l", false]], "--qcschema": [[1767, "cmdoption-psi4-qcschema", false]], "--schema": [[1767, "cmdoption-psi4-qcschema", false]], "--scratch": [[1767, "cmdoption-psi4-s", false]], "--skip-preprocessor": [[1767, "cmdoption-psi4-k", false]], "--test": [[1767, "cmdoption-psi4-t", false]], "--verbose": [[1767, "cmdoption-psi4-v", false]], "--version": [[1767, "cmdoption-psi4-V", false]], "-a": [[1767, "cmdoption-psi4-a", false]], "-h": [[1767, "cmdoption-psi4-h", false]], "-i": [[1767, "cmdoption-psi4-i", false]], "-k": [[1767, "cmdoption-psi4-k", false]], "-l": [[1767, "cmdoption-psi4-l", false]], "-m": [[1767, "cmdoption-psi4-m", false]], "-n": [[1767, "cmdoption-psi4-n", false]], "-o": [[1767, "cmdoption-psi4-o", false]], "-s": [[1767, "cmdoption-psi4-s", false]], "-t": [[1767, "cmdoption-psi4-t", false]], "-v": [[1767, "cmdoption-psi4-V", false], [1767, "cmdoption-psi4-v", false]], "2-body pairwise dispersion correction analysis": [[1776, "psivar-2-BODY-PAIRWISE-DISPERSION-CORRECTION-ANALYSIS", false]], "[t] correction energy": [[1776, "psivar-T-CORRECTION-ENERGY", false]], "_get_default_xtpl() (in module psi4.driver.driver_cbs)": [[1740, "psi4.driver.driver_cbs._get_default_xtpl", false]], "_to_array() (in module psi4.driver.p4util.numpy_helper)": [[1797, "psi4.driver.p4util.numpy_helper._to_array", false]], "a-(t) correction energy": [[1776, "psivar-A-T-CORRECTION-ENERGY", false]], "a-ccsd(t) correlation energy": [[1776, "psivar-A-CCSD-T-CORRELATION-ENERGY", false]], "a-ccsd(t) total energy": [[1776, "psivar-A-CCSD-T-TOTAL-ENERGY", false]], "a1() (psi4.core.dispersion method)": [[68, "psi4.core.Dispersion.a1", false]], "a2() (psi4.core.dispersion method)": [[68, "psi4.core.Dispersion.a2", false]], "a_ras3_max (detci)": [[1704, "term-A_RAS3_MAX-DETCI", true]], "aaa (t) correction energy": [[1776, "psivar-AAA-T-CORRECTION-ENERGY", false]], "aab (t) correction energy": [[1776, "psivar-AAB-T-CORRECTION-ENERGY", false]], "ab initio polarization propagator": [[0, "index-1", false]], "abb (t) correction energy": [[1776, "psivar-ABB-T-CORRECTION-ENERGY", false]], "abcd (ccenergy)": [[1704, "term-ABCD-CCENERGY", true]], "abcd (cceom)": [[1704, "term-ABCD-CCEOM", true]], "abcd (cclambda)": [[1704, "term-ABCD-CCLAMBDA", true]], "abcd (ccresponse)": [[1704, "term-ABCD-CCRESPONSE", true]], "absent (psi4.core.fragmenttype attribute)": [[79, "psi4.core.FragmentType.Absent", false]], "absmax() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.absmax", false]], "accumulate_product() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.accumulate_product", false]], "acpf correlation energy": [[1776, "psivar-ACPF-CORRELATION-ENERGY", false]], "acpf dipole": [[1776, "psivar-ACPF-DIPOLE", false]], "acpf doubles energy": [[1776, "psivar-ACPF-DOUBLES-ENERGY", false]], "acpf opposite-spin correlation energy": [[1776, "psivar-ACPF-OPPOSITE-SPIN-CORRELATION-ENERGY", false]], "acpf quadrupole": [[1776, "psivar-ACPF-QUADRUPOLE", false]], "acpf same-spin correlation energy": [[1776, "psivar-ACPF-SAME-SPIN-CORRELATION-ENERGY", false]], "acpf singles energy": [[1776, "psivar-ACPF-SINGLES-ENERGY", false]], "acpf total energy": [[1776, "psivar-ACPF-TOTAL-ENERGY", false]], "activate() (in module psi4.driver)": [[281, "psi4.driver.activate", false]], "activate_all_fragments() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.activate_all_fragments", false]], "active (globals)": [[1704, "term-ACTIVE-GLOBALS", true]], "active_nat_orbs (fnocc)": [[1704, "term-ACTIVE_NAT_ORBS-FNOCC", true]], "adc": [[0, "index-0", false], [0, "index-2", false], [1, "index-0", false]], "adc iterations": [[1776, "psivar-ADC-ITERATIONS", false]], "adc root 0 (h) -> root n (i) electric transition dipole moment (len)": [[1776, "psivar-ADC-ROOT-0-h-ROOT-n-i-ELECTRIC-TRANSITION-DIPOLE-MOMENT-LEN", false]], "adc root 0 (h) -> root n (i) excitation energy": [[1776, "psivar-ADC-ROOT-0-h-ROOT-n-i-EXCITATION-ENERGY", false]], "adc root 0 (h) -> root n (i) oscillator strength (len)": [[1776, "psivar-ADC-ROOT-0-h-ROOT-n-i-OSCILLATOR-STRENGTH-LEN", false]], "adc root 0 (h) -> root n (i) oscillator strength (vel)": [[1776, "psivar-ADC-ROOT-0-h-ROOT-n-i-OSCILLATOR-STRENGTH-VEL", false]], "adc root 0 (h) -> root n (i) rotatory strength (vel)": [[1776, "psivar-ADC-ROOT-0-h-ROOT-n-i-ROTATORY-STRENGTH-VEL", false]], "adc root 0 (in h) -> root n (in i) electric transition dipole moment (len)": [[1776, "psivar-ADC-ROOT-0-IN-h-ROOT-n-IN-i-ELECTRIC-TRANSITION-DIPOLE-MOMENT-LEN", false]], "adc root 0 (in h) -> root n (in i) excitation energy": [[1776, "psivar-ADC-ROOT-0-IN-h-ROOT-n-IN-i-EXCITATION-ENERGY", false]], "adc root 0 (in h) -> root n (in i) oscillator strength (len)": [[1776, "psivar-ADC-ROOT-0-IN-h-ROOT-n-IN-i-OSCILLATOR-STRENGTH-LEN", false]], "adc root 0 (in h) -> root n (in i) oscillator strength (vel)": [[1776, "psivar-ADC-ROOT-0-IN-h-ROOT-n-IN-i-OSCILLATOR-STRENGTH-VEL", false]], "adc root 0 (in h) -> root n (in i) rotatory strength (vel)": [[1776, "psivar-ADC-ROOT-0-IN-h-ROOT-n-IN-i-ROTATORY-STRENGTH-VEL", false]], "adc root 0 -> root n electric transition dipole moment (len)": [[1776, "psivar-ADC-ROOT-0-ROOT-n-ELECTRIC-TRANSITION-DIPOLE-MOMENT-LEN", false]], "adc root 0 -> root n electric transition dipole moment (len) - h transition": [[1776, "psivar-ADC-ROOT-0-ROOT-n-ELECTRIC-TRANSITION-DIPOLE-MOMENT-LEN-h-TRANSITION", false]], "adc root 0 -> root n excitation energy": [[1776, "psivar-ADC-ROOT-0-ROOT-n-EXCITATION-ENERGY", false]], "adc root 0 -> root n excitation energy - h transition": [[1776, "psivar-ADC-ROOT-0-ROOT-n-EXCITATION-ENERGY-h-TRANSITION", false]], "adc root 0 -> root n oscillator strength (len)": [[1776, "psivar-ADC-ROOT-0-ROOT-n-OSCILLATOR-STRENGTH-LEN", false]], "adc root 0 -> root n oscillator strength (len) - h transition": [[1776, "psivar-ADC-ROOT-0-ROOT-n-OSCILLATOR-STRENGTH-LEN-h-TRANSITION", false]], "adc root 0 -> root n oscillator strength (vel)": [[1776, "psivar-ADC-ROOT-0-ROOT-n-OSCILLATOR-STRENGTH-VEL", false]], "adc root 0 -> root n oscillator strength (vel) - h transition": [[1776, "psivar-ADC-ROOT-0-ROOT-n-OSCILLATOR-STRENGTH-VEL-h-TRANSITION", false]], "adc root 0 -> root n rotatory strength (vel)": [[1776, "psivar-ADC-ROOT-0-ROOT-n-ROTATORY-STRENGTH-VEL", false]], "adc root 0 -> root n rotatory strength (vel) - h transition": [[1776, "psivar-ADC-ROOT-0-ROOT-n-ROTATORY-STRENGTH-VEL-h-TRANSITION", false]], "adcc": [[1, "index-0", false]], "add() (psi4.core.intvector method)": [[88, "psi4.core.IntVector.add", false]], "add() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.add", false]], "add() (psi4.core.oeprop method)": [[111, "psi4.core.OEProp.add", false]], "add() (psi4.core.vector method)": [[148, "psi4.core.Vector.add", false]], "add() (psi4.driver.p4util.diis method)": [[321, "psi4.driver.p4util.DIIS.add", false]], "add_and_orthogonalize_row() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.add_and_orthogonalize_row", false]], "add_array() (psi4.core.options method)": [[114, "psi4.core.Options.add_array", false]], "add_atom() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.add_atom", false]], "add_auxiliary_bonds (optking)": [[1704, "term-ADD_AUXILIARY_BONDS-OPTKING", true]], "add_bool() (psi4.core.options method)": [[114, "psi4.core.Options.add_bool", false]], "add_c_functional() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.add_c_functional", false]], "add_int() (psi4.core.options method)": [[114, "psi4.core.Options.add_int", false]], "add_option() (psi4.driver.p4util.optionsstate method)": [[327, "psi4.driver.p4util.OptionsState.add_option", false]], "add_space() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.add_space", false]], "add_str() (psi4.core.options method)": [[114, "psi4.core.Options.add_str", false]], "add_str_i() (psi4.core.options method)": [[114, "psi4.core.Options.add_str_i", false]], "add_transformation() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.add_transformation", false]], "add_x_functional() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.add_x_functional", false]], "addbasis() (psi4.core.externalpotential method)": [[73, "psi4.core.ExternalPotential.addBasis", false]], "addcharge() (psi4.core.externalpotential method)": [[73, "psi4.core.ExternalPotential.addCharge", false]], "addchargeangstrom() (psi4.driver.qmmmbohr method)": [[275, "psi4.driver.QMMMbohr.addChargeAngstrom", false]], "addchargebohr() (psi4.driver.qmmmbohr method)": [[275, "psi4.driver.QMMMbohr.addChargeBohr", false]], "adddiffuse() (psi4.driver.qmmmbohr method)": [[275, "psi4.driver.QMMMbohr.addDiffuse", false]], "adding new": [[1730, "index-3", false], [1782, "index-1", false], [1834, "index-0", false], [1835, "index-0", false]], "advanced-keywords": [[1771, "index-3", false]], "aindex() (psi4.core.mospace method)": [[98, "psi4.core.MOSpace.aIndex", false]], "aio_cphf (sapt)": [[1704, "term-AIO_CPHF-SAPT", true]], "aio_df_ints (sapt)": [[1704, "term-AIO_DF_INTS-SAPT", true]], "algorithm (dct)": [[1704, "term-ALGORITHM-DCT", true]], "all() (psi4.core.mospace static method)": [[98, "psi4.core.MOSpace.all", false]], "all_casings() (in module psi4.driver.p4util)": [[330, "psi4.driver.p4util.all_casings", false]], "allen_focal_point() (in module psi4.driver.aliases)": [[1740, "psi4.driver.aliases.allen_focal_point", false]], "allocate() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.allocate", false]], "alpha() (psi4.core.functional method)": [[80, "psi4.core.Functional.alpha", false]], "alpha_corr_to_pitzer() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.alpha_corr_to_pitzer", false]], "alpha_orbital_space() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.alpha_orbital_space", false]], "am (psi4.core.gaussianshell attribute)": [[81, "psi4.core.GaussianShell.am", false]], "amchar (psi4.core.gaussianshell attribute)": [[81, "psi4.core.GaussianShell.AMCHAR", false], [81, "psi4.core.GaussianShell.amchar", false]], "analyze (ccenergy)": [[1704, "term-ANALYZE-CCENERGY", true]], "analyze (ccresponse)": [[1704, "term-ANALYZE-CCRESPONSE", true]], "angstrom (psi4.core.geometryunits attribute)": [[83, "psi4.core.GeometryUnits.Angstrom", false]], "angularmomentumint (class in psi4.core)": [[4, "psi4.core.AngularMomentumInt", false]], "anharmonicity()": [[1761, "index-0", false]], "anharmonicity() (in module psi4.driver.diatomic)": [[1761, "psi4.driver.diatomic.anharmonicity", false]], "ansatz() (psi4.core.pointfunctions method)": [[119, "psi4.core.PointFunctions.ansatz", false]], "ansatz() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.ansatz", false]], "ao_3center_deriv1() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_3center_deriv1", false]], "ao_3coverlap() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_3coverlap", false]], "ao_angular_momentum() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.ao_angular_momentum", false]], "ao_angular_momentum() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_angular_momentum", false]], "ao_basis (ccdensity)": [[1704, "term-AO_BASIS-CCDENSITY", true]], "ao_basis (ccenergy)": [[1704, "term-AO_BASIS-CCENERGY", true]], "ao_basis (cclambda)": [[1704, "term-AO_BASIS-CCLAMBDA", true]], "ao_basis (cctransort)": [[1704, "term-AO_BASIS-CCTRANSORT", true]], "ao_basis (dct)": [[1704, "term-AO_BASIS-DCT", true]], "ao_dipole() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.ao_dipole", false]], "ao_dipole() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_dipole", false]], "ao_dkh() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_dkh", false]], "ao_efp_multipole_potential() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_efp_multipole_potential", false]], "ao_elec_dip_deriv1() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_elec_dip_deriv1", false]], "ao_erf_eri() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_erf_eri", false]], "ao_eri() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_eri", false]], "ao_eri_shell() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_eri_shell", false]], "ao_f12() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_f12", false]], "ao_f12_double_commutator() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_f12_double_commutator", false]], "ao_f12_squared() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_f12_squared", false]], "ao_f12g12() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_f12g12", false]], "ao_kinetic() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.ao_kinetic", false]], "ao_kinetic() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_kinetic", false]], "ao_metric_deriv1() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_metric_deriv1", false]], "ao_multipole_potential() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.ao_multipole_potential", false]], "ao_multipole_potential() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_multipole_potential", false]], "ao_multipoles() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.ao_multipoles", false]], "ao_multipoles() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_multipoles", false]], "ao_nabla() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.ao_nabla", false]], "ao_nabla() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_nabla", false]], "ao_oei_deriv1() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_oei_deriv1", false]], "ao_oei_deriv2() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_oei_deriv2", false]], "ao_overlap() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.ao_overlap", false]], "ao_overlap() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_overlap", false]], "ao_overlap_half_deriv1() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_overlap_half_deriv1", false]], "ao_potential() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.ao_potential", false]], "ao_potential() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_potential", false]], "ao_potential_erf() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_potential_erf", false]], "ao_potential_erf_complement() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_potential_erf_complement", false]], "ao_pvp() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_pvp", false]], "ao_quadrupole() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.ao_quadrupole", false]], "ao_quadrupole() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_quadrupole", false]], "ao_tei_deriv1() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_tei_deriv1", false]], "ao_tei_deriv2() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_tei_deriv2", false]], "ao_to_shell() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.ao_to_shell", false]], "ao_traceless_quadrupole() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.ao_traceless_quadrupole", false]], "ao_traceless_quadrupole() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.ao_traceless_quadrupole", false]], "aorbs() (psi4.core.mospace method)": [[98, "psi4.core.MOSpace.aOrbs", false]], "aoshellcombinationsiterator (class in psi4.core)": [[3, "psi4.core.AOShellCombinationsIterator", false]], "aotoso() (psi4.core.petitelist method)": [[118, "psi4.core.PetiteList.aotoso", false]], "aotoso() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.aotoso", false]], "append() (psi4.core.bsvec method)": [[5, "psi4.core.BSVec.append", false]], "appendcharges() (psi4.core.externalpotential method)": [[73, "psi4.core.ExternalPotential.appendCharges", false]], "apply_denominator() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.apply_denominator", false]], "approx_solve() (psi4.core.somcscf method)": [[133, "psi4.core.SOMCSCF.approx_solve", false]], "aqcc correlation energy": [[1776, "psivar-AQCC-CORRELATION-ENERGY", false]], "aqcc dipole": [[1776, "psivar-AQCC-DIPOLE", false]], "aqcc doubles energy": [[1776, "psivar-AQCC-DOUBLES-ENERGY", false]], "aqcc opposite-spin correlation energy": [[1776, "psivar-AQCC-OPPOSITE-SPIN-CORRELATION-ENERGY", false]], "aqcc quadrupole": [[1776, "psivar-AQCC-QUADRUPOLE", false]], "aqcc same-spin correlation energy": [[1776, "psivar-AQCC-SAME-SPIN-CORRELATION-ENERGY", false]], "aqcc singles energy": [[1776, "psivar-AQCC-SINGLES-ENERGY", false]], "aqcc total energy": [[1776, "psivar-AQCC-TOTAL-ENERGY", false]], "arbitrary-order coupled-cluster theory": [[1755, "index-5", false]], "arbitrary-order perturbation theory": [[1755, "index-4", false]], "architectures": [[1781, "index-0", false]], "array_interface() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.array_interface", false]], "array_interface() (psi4.core.vector method)": [[148, "psi4.core.Vector.array_interface", false]], "array_to_matrix() (in module psi4.driver.p4util)": [[331, "psi4.driver.p4util.array_to_matrix", false]], "array_to_matrix() (in module psi4.driver.p4util.numpy_helper)": [[1797, "psi4.driver.p4util.numpy_helper.array_to_matrix", false]], "array_variable() (in module psi4.core)": [[151, "psi4.core.array_variable", false]], "array_variable() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.array_variable", false]], "array_variables() (in module psi4.core)": [[152, "psi4.core.array_variables", false]], "array_variables() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.array_variables", false]], "arrays() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.arrays", false]], "ascending (psi4.core.diagonalizeorder attribute)": [[63, "psi4.core.DiagonalizeOrder.Ascending", false]], "atom (psi4.core.salccomponent attribute)": [[134, "psi4.core.SalcComponent.atom", false]], "atom_at_position() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.atom_at_position", false]], "atomic_blocks() (psi4.core.moleculargrid method)": [[105, "psi4.core.MolecularGrid.atomic_blocks", false]], "atomic_point_charges() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.atomic_point_charges", false]], "atoms (psi4.driver.p4util.inpsight attribute)": [[323, "psi4.driver.p4util.InPsight.atoms", false]], "attempt_number_ (psi4.core.hf attribute)": [[84, "psi4.core.HF.attempt_number_", false]], "auto_fragments() (in module psi4.driver.wrapper_autofrag)": [[1768, "psi4.driver.wrapper_autofrag.auto_fragments", false]], "aux_overlap() (psi4.core.fdds_dispersion method)": [[75, "psi4.core.FDDS_Dispersion.aux_overlap", false]], "auxiliary": [[1730, "index-2", false]], "auxiliary_bond_factor (optking)": [[1704, "term-AUXILIARY_BOND_FACTOR-OPTKING", true]], "available": [[1752, "index-4", false]], "available by element": [[1731, "index-0", false]], "available by family": [[1730, "index-0", false], [1733, "index-0", false]], "available functionals": [[1758, "index-0", false]], "avg_states (detci)": [[1704, "term-AVG_STATES-DETCI", true]], "avg_weights (detci)": [[1704, "term-AVG_WEIGHTS-DETCI", true]], "axpby() (psi4.core.vector method)": [[148, "psi4.core.Vector.axpby", false]], "axpy() (psi4.core.civector method)": [[12, "psi4.core.CIVector.axpy", false]], "axpy() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.axpy", false]], "axpy() (psi4.core.vector method)": [[148, "psi4.core.Vector.axpy", false]], "axpy_matrix() (psi4.core.dpdbuf4 method)": [[183, "psi4.core.dpdbuf4.axpy_matrix", false]], "axpy_matrix() (psi4.core.dpdfile2 method)": [[184, "psi4.core.dpdfile2.axpy_matrix", false]], "azimuth (psi4.driver.p4util.inpsight attribute)": [[323, "psi4.driver.p4util.InPsight.azimuth", false]], "b787() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.B787", false]], "b_ras3_max (detci)": [[1704, "term-B_RAS3_MAX-DETCI", true]], "back_transform() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.back_transform", false]], "backtransform_density() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.backtransform_density", false]], "backtransform_tpdm_restricted() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.backtransform_tpdm_restricted", false]], "backtransform_tpdm_unrestricted() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.backtransform_tpdm_unrestricted", false]], "banner() (in module psi4.driver)": [[282, "psi4.driver.banner", false]], "banner() (in module psi4.driver.p4util)": [[332, "psi4.driver.p4util.banner", false]], "basic-keywords": [[1755, "index-2", false], [1771, "index-2", false]], "basis (dfmp2)": [[1704, "term-BASIS-DFMP2", true]], "basis (mints)": [[1704, "term-BASIS-MINTS", true]], "basis (psi4.core.onebodyaoint attribute)": [[112, "psi4.core.OneBodyAOInt.basis", false]], "basis (psi4.core.onebodysoint attribute)": [[113, "psi4.core.OneBodySOInt.basis", false]], "basis (psi4.driver.atomiccomputer attribute)": [[265, "psi4.driver.AtomicComputer.basis", false]], "basis (psi4.driver.driver_cbs.compositecomputer attribute)": [[1740, "psi4.driver.driver_cbs.CompositeComputer.basis", false]], "basis (psi4.driver.driver_nbody.manybodycomputer attribute)": [[1794, "psi4.driver.driver_nbody.ManyBodyComputer.basis", false]], "basis (sapt)": [[1704, "term-BASIS-SAPT", true]], "basis (scf)": [[1704, "term-BASIS-SCF", true]], "basis set": [[1730, "index-0", false], [1730, "index-1", false], [1730, "index-2", false], [1730, "index-3", false], [1731, "index-0", false], [1732, "index-0", false], [1733, "index-0", false], [1740, "index-0", false], [1740, "index-3", false]], "basis() (psi4.core.basisextents method)": [[6, "psi4.core.BasisExtents.basis", false]], "basis() (psi4.core.vbase method)": [[147, "psi4.core.VBase.basis", false]], "basis1 (psi4.core.onebodyaoint attribute)": [[112, "psi4.core.OneBodyAOInt.basis1", false]], "basis1 (psi4.core.onebodysoint attribute)": [[113, "psi4.core.OneBodySOInt.basis1", false]], "basis2 (psi4.core.onebodyaoint attribute)": [[112, "psi4.core.OneBodyAOInt.basis2", false]], "basis2 (psi4.core.onebodysoint attribute)": [[113, "psi4.core.OneBodySOInt.basis2", false]], "basis_guess (scf)": [[1704, "term-BASIS_GUESS-SCF", true]], "basis_helper() (in module psi4.driver)": [[283, "psi4.driver.basis_helper", false]], "basis_helper() (in module psi4.driver.p4util)": [[333, "psi4.driver.p4util.basis_helper", false]], "basis_on_atom() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.basis_on_atom", false]], "basis_projection() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.basis_projection", false]], "basis_relativistic (globals)": [[1704, "term-BASIS_RELATIVISTIC-GLOBALS", true]], "basis_values() (psi4.core.basisfunctions method)": [[7, "psi4.core.BasisFunctions.basis_values", false]], "basisextents (class in psi4.core)": [[6, "psi4.core.BasisExtents", false]], "basisfunctions (class in psi4.core)": [[7, "psi4.core.BasisFunctions", false]], "basisset (class in psi4.core)": [[8, "psi4.core.BasisSet", false]], "basisset() (psi4.core.cubeproperties method)": [[21, "psi4.core.CubeProperties.basisset", false]], "basisset() (psi4.core.jk method)": [[92, "psi4.core.JK.basisset", false]], "basisset() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.basisset", false]], "basisset() (psi4.core.orbitalspace method)": [[115, "psi4.core.OrbitalSpace.basisset", false]], "basisset() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.basisset", false]], "bbb (t) correction energy": [[1776, "psivar-BBB-T-CORRECTION-ENERGY", false]], "bccd_maxiter (ccenergy)": [[1704, "term-BCCD_MAXITER-CCENERGY", true]], "be_quiet() (in module psi4.core)": [[153, "psi4.core.be_quiet", false]], "begin() (psi4.core.slice method)": [[137, "psi4.core.Slice.begin", false]], "bench (globals)": [[1704, "term-BENCH-GLOBALS", true]], "benchmark_blas1() (in module psi4.core)": [[154, "psi4.core.benchmark_blas1", false]], "benchmark_blas2() (in module psi4.core)": [[155, "psi4.core.benchmark_blas2", false]], "benchmark_blas3() (in module psi4.core)": [[156, "psi4.core.benchmark_blas3", false]], "benchmark_disk() (in module psi4.core)": [[157, "psi4.core.benchmark_disk", false]], "benchmark_integrals() (in module psi4.core)": [[158, "psi4.core.benchmark_integrals", false]], "benchmark_math() (in module psi4.core)": [[159, "psi4.core.benchmark_math", false]], "bendazzoli (detci)": [[1704, "term-BENDAZZOLI-DETCI", true]], "beta_corr_to_pitzer() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.beta_corr_to_pitzer", false]], "beta_orbital_space() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.beta_orbital_space", false]], "bfs() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.BFS", false]], "bibtex() (psi4.core.dispersion method)": [[68, "psi4.core.Dispersion.bibtex", false]], "bindex() (psi4.core.mospace method)": [[98, "psi4.core.MOSpace.bIndex", false]], "bits() (psi4.core.pointgroup method)": [[120, "psi4.core.PointGroup.bits", false]], "blank() (psi4.core.superfunctional static method)": [[138, "psi4.core.SuperFunctional.blank", false]], "blend() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.blend", false]], "block_diagonal_array() (in module psi4.driver.p4util)": [[334, "psi4.driver.p4util.block_diagonal_array", false]], "blockopoints (class in psi4.core)": [[9, "psi4.core.BlockOPoints", false]], "blocks() (psi4.core.moleculargrid method)": [[105, "psi4.core.MolecularGrid.blocks", false]], "bohr (psi4.core.geometryunits attribute)": [[83, "psi4.core.GeometryUnits.Bohr", false]], "bohr_per_ang (psi4.driver.p4util.inpsight attribute)": [[323, "psi4.driver.p4util.InPsight.bohr_per_ang", false]], "bond_width (psi4.driver.p4util.inpsight attribute)": [[323, "psi4.driver.p4util.InPsight.bond_width", false]], "bonding_alpha (psi4.driver.p4util.inpsight attribute)": [[323, "psi4.driver.p4util.InPsight.bonding_alpha", false]], "bonds (psi4.driver.p4util.inpsight attribute)": [[323, "psi4.driver.p4util.InPsight.bonds", false]], "borbs() (psi4.core.mospace method)": [[98, "psi4.core.MOSpace.bOrbs", false]], "border (pe)": [[1704, "term-BORDER-PE", true]], "border_n_redist (pe)": [[1704, "term-BORDER_N_REDIST-PE", true]], "border_redist_order (pe)": [[1704, "term-BORDER_REDIST_ORDER-PE", true]], "border_redist_pol (pe)": [[1704, "term-BORDER_REDIST_POL-PE", true]], "border_rmin (pe)": [[1704, "term-BORDER_RMIN-PE", true]], "border_rmin_unit (pe)": [[1704, "term-BORDER_RMIN_UNIT-PE", true]], "border_type (pe)": [[1704, "term-BORDER_TYPE-PE", true]], "boyslocalizer (class in psi4.core)": [[10, "psi4.core.BoysLocalizer", false]], "brianqc": [[1735, "index-0", false]], "brianqc_enable": [[1735, "envvar-BRIANQC_ENABLE", false], [1735, "index-4", false]], "brianqc_enable (globals)": [[1704, "term-BRIANQC_ENABLE-GLOBALS", true]], "brianqc_install_path": [[1735, "envvar-BRIANQC_INSTALL_PATH", false], [1735, "index-2", false], [1735, "index-3", false]], "brianqc_sdk_install": [[1735, "envvar-BRIANQC_SDK_INSTALL", false], [1735, "index-1", false]], "brueckner converged": [[1776, "psivar-BRUECKNER-CONVERGED", false]], "brueckner_maxiter (fnocc)": [[1704, "term-BRUECKNER_MAXITER-FNOCC", true]], "brueckner_orbs_r_convergence (ccenergy)": [[1704, "term-BRUECKNER_ORBS_R_CONVERGENCE-CCENERGY", true]], "bsse": [[1794, "index-0", false]], "bsse_type (psi4.driver.driver_nbody.manybodycomputer attribute)": [[1794, "psi4.driver.driver_nbody.ManyBodyComputer.bsse_type", false]], "bsseenum (class in psi4.driver.driver_nbody)": [[1794, "psi4.driver.driver_nbody.BsseEnum", false]], "bsvec (class in psi4.core)": [[5, "psi4.core.BSVec", false]], "bugs": [[1781, "index-3", false]], "build() (psi4.core.basisset static method)": [[8, "psi4.core.BasisSet.build", false]], "build() (psi4.core.dftgrid static method)": [[29, "psi4.core.DFTGrid.build", false]], "build() (psi4.core.dispersion static method)": [[68, "psi4.core.Dispersion.build", false]], "build() (psi4.core.jk static method)": [[92, "psi4.core.JK.build", false]], "build() (psi4.core.localizer static method)": [[97, "psi4.core.Localizer.build", false]], "build() (psi4.core.vbase static method)": [[147, "psi4.core.VBase.build", false]], "build() (psi4.core.wavefunction static method)": [[150, "psi4.core.Wavefunction.build", false]], "build_base() (psi4.core.functional static method)": [[80, "psi4.core.Functional.build_base", false]], "build_cabs_space() (psi4.core.orbitalspace static method)": [[115, "psi4.core.OrbitalSpace.build_cabs_space", false]], "build_collocation_cache() (psi4.core.vbase method)": [[147, "psi4.core.VBase.build_collocation_cache", false]], "build_jk() (psi4.core.jk static method)": [[92, "psi4.core.JK.build_JK", false]], "build_ri_space() (psi4.core.orbitalspace static method)": [[115, "psi4.core.OrbitalSpace.build_ri_space", false]], "build_sad() (psi4.core.sadguess static method)": [[131, "psi4.core.SADGuess.build_SAD", false]], "build_tasks() (psi4.driver.driver_cbs.compositecomputer method)": [[1740, "psi4.driver.driver_cbs.CompositeComputer.build_tasks", false]], "build_tasks() (psi4.driver.driver_findif.finitedifferencecomputer method)": [[1772, "psi4.driver.driver_findif.FiniteDifferenceComputer.build_tasks", false]], "build_tasks() (psi4.driver.driver_nbody.manybodycomputer method)": [[1794, "psi4.driver.driver_nbody.ManyBodyComputer.build_tasks", false]], "c() (psi4.core.orbitalspace method)": [[115, "psi4.core.OrbitalSpace.C", false]], "c1_deep_copy() (psi4.core.cuhf method)": [[14, "psi4.core.CUHF.c1_deep_copy", false]], "c1_deep_copy() (psi4.core.rhf method)": [[128, "psi4.core.RHF.c1_deep_copy", false]], "c1_deep_copy() (psi4.core.rohf method)": [[130, "psi4.core.ROHF.c1_deep_copy", false]], "c1_deep_copy() (psi4.core.uhf method)": [[145, "psi4.core.UHF.c1_deep_copy", false]], "c1_deep_copy() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.c1_deep_copy", false]], "c2_x() (psi4.core.symmetryoperation method)": [[139, "psi4.core.SymmetryOperation.c2_x", false]], "c2_y() (psi4.core.symmetryoperation method)": [[139, "psi4.core.SymmetryOperation.c2_y", false]], "c2_z() (psi4.core.symmetryoperation method)": [[139, "psi4.core.SymmetryOperation.c2_z", false]], "c_add() (psi4.core.jk method)": [[92, "psi4.core.JK.C_add", false]], "c_alpha() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.c_alpha", false]], "c_clear() (psi4.core.jk method)": [[92, "psi4.core.JK.C_clear", false]], "c_functional() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.c_functional", false]], "c_functionals() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.c_functionals", false]], "c_left_add() (psi4.core.jk method)": [[92, "psi4.core.JK.C_left_add", false]], "c_omega() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.c_omega", false]], "c_os_alpha() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.c_os_alpha", false]], "c_right_add() (psi4.core.jk method)": [[92, "psi4.core.JK.C_right_add", false]], "c_ss_alpha() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.c_ss_alpha", false]], "ca() (psi4.core.sadguess method)": [[131, "psi4.core.SADGuess.Ca", false]], "ca() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.Ca", false]], "ca_subset() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.Ca_subset", false]], "cachelevel (ccdensity)": [[1704, "term-CACHELEVEL-CCDENSITY", true]], "cachelevel (ccenergy)": [[1704, "term-CACHELEVEL-CCENERGY", true]], "cachelevel (cceom)": [[1704, "term-CACHELEVEL-CCEOM", true]], "cachelevel (cchbar)": [[1704, "term-CACHELEVEL-CCHBAR", true]], "cachelevel (cclambda)": [[1704, "term-CACHELEVEL-CCLAMBDA", true]], "cachelevel (ccresponse)": [[1704, "term-CACHELEVEL-CCRESPONSE", true]], "cachelevel (cctransort)": [[1704, "term-CACHELEVEL-CCTRANSORT", true]], "cachelevel (dct)": [[1704, "term-CACHELEVEL-DCT", true]], "cachelevel (occ)": [[1704, "term-CACHELEVEL-OCC", true]], "cachetype (ccenergy)": [[1704, "term-CACHETYPE-CCENERGY", true]], "cachetype (cceom)": [[1704, "term-CACHETYPE-CCEOM", true]], "calc_s_squared (detci)": [[1704, "term-CALC_S_SQUARED-DETCI", true]], "canonicalize_active_favg (mcscf)": [[1704, "term-CANONICALIZE_ACTIVE_FAVG-MCSCF", true]], "canonicalize_inactive_favg (mcscf)": [[1704, "term-CANONICALIZE_INACTIVE_FAVG-MCSCF", true]], "cart_hess_read (optking)": [[1704, "term-CART_HESS_READ-OPTKING", true]], "cartesian (psi4.core.gaussiantype attribute)": [[82, "psi4.core.GaussianType.Cartesian", false]], "cartesian_sym_tolerance (optking)": [[1704, "term-CARTESIAN_SYM_TOLERANCE-OPTKING", true]], "cb() (psi4.core.sadguess method)": [[131, "psi4.core.SADGuess.Cb", false]], "cb() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.Cb", false]], "cb_subset() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.Cb_subset", false]], "cbs correlation energy": [[1776, "psivar-CBS-CORRELATION-ENERGY", false]], "cbs number": [[1776, "psivar-CBS-NUMBER", false]], "cbs reference energy": [[1776, "psivar-CBS-REFERENCE-ENERGY", false]], "cbs total energy": [[1776, "psivar-CBS-TOTAL-ENERGY", false]], "cbs()": [[284, "index-0", false], [1740, "index-0", false], [1740, "index-1", false], [1740, "index-2", false], [1740, "index-3", false], [1741, "index-0", false]], "cbs() (in module psi4.driver)": [[284, "psi4.driver.cbs", false]], "cbsrec (psi4.driver.driver_cbs.compositecomputer attribute)": [[1740, "psi4.driver.driver_cbs.CompositeComputer.cbsrec", false]], "cc": [[1742, "index-0", false]], "cc (detci)": [[1704, "term-CC-DETCI", true]], "cc alpha-alpha pair energies": [[1776, "psivar-CC-ALPHA-ALPHA-PAIR-ENERGIES", false]], "cc alpha-beta pair energies": [[1776, "psivar-CC-ALPHA-BETA-PAIR-ENERGIES", false]], "cc correlation energy": [[1776, "psivar-CC-CORRELATION-ENERGY", false]], "cc correlation kinetic energy": [[1776, "psivar-CC-CORRELATION-KINETIC-ENERGY", false]], "cc correlation potential energy": [[1776, "psivar-CC-CORRELATION-POTENTIAL-ENERGY", false]], "cc correlation virial ratio": [[1776, "psivar-CC-CORRELATION-VIRIAL-RATIO", false]], "cc d1 diagnostic": [[1776, "psivar-CC-D1-DIAGNOSTIC", false]], "cc d2 diagnostic": [[1776, "psivar-CC-D2-DIAGNOSTIC", false]], "cc dipole": [[1776, "psivar-CC-DIPOLE", false]], "cc new d1 diagnostic": [[1776, "psivar-CC-NEW-D1-DIAGNOSTIC", false]], "cc singlet pair energies": [[1776, "psivar-CC-SINGLET-PAIR-ENERGIES", false]], "cc t1 diagnostic": [[1776, "psivar-CC-T1-DIAGNOSTIC", false]], "cc total energy": [[1776, "psivar-CC-TOTAL-ENERGY", false]], "cc triplet pair energies": [[1776, "psivar-CC-TRIPLET-PAIR-ENERGIES", false]], "cc virial ratio": [[1776, "psivar-CC-VIRIAL-RATIO", false]], "cc(n-1)(n) correlation energy": [[1776, "psivar-CC-n-1-n-CORRELATION-ENERGY", false]], "cc(n-1)(n) total energy": [[1776, "psivar-CC-n-1-n-TOTAL-ENERGY", false]], "cc(n-1)(n)_l correlation energy": [[1776, "psivar-CC-n-1-n-_L-CORRELATION-ENERGY", false]], "cc(n-1)(n)_l total energy": [[1776, "psivar-CC-n-1-n-_L-TOTAL-ENERGY", false]], "cc, coupled cluster": [[1742, "index-0", false]], "cc2 alpha-alpha pair energies": [[1776, "psivar-CC2-ALPHA-ALPHA-PAIR-ENERGIES", false]], "cc2 alpha-beta pair energies": [[1776, "psivar-CC2-ALPHA-BETA-PAIR-ENERGIES", false]], "cc2 correlation energy": [[1776, "psivar-CC2-CORRELATION-ENERGY", false]], "cc2 dipole polarizability @ xnm": [[1776, "psivar-CC2-DIPOLE-POLARIZABILITY-xNM", false]], "cc2 dipole polarizability tensor @ xnm": [[1776, "psivar-CC2-DIPOLE-POLARIZABILITY-TENSOR-xNM", false]], "cc2 quadrupole polarizability @ xnm": [[1776, "psivar-CC2-QUADRUPOLE-POLARIZABILITY-xNM", false]], "cc2 quadrupole polarizability tensor @ xnm": [[1776, "psivar-CC2-QUADRUPOLE-POLARIZABILITY-TENSOR-xNM", false]], "cc2 rotation (len) origin-dependence @ xnm": [[1776, "psivar-CC2-ROTATION-LEN-ORIGIN-DEPENDENCE-xNM", false]], "cc2 singlet pair energies": [[1776, "psivar-CC2-SINGLET-PAIR-ENERGIES", false]], "cc2 specific rotation (len) @ xnm": [[1776, "psivar-CC2-SPECIFIC-ROTATION-LEN-xNM", false]], "cc2 specific rotation (mvg) @ xnm": [[1776, "psivar-CC2-SPECIFIC-ROTATION-MVG-xNM", false]], "cc2 specific rotation (vel) @ xnm": [[1776, "psivar-CC2-SPECIFIC-ROTATION-VEL-xNM", false]], "cc2 total energy": [[1776, "psivar-CC2-TOTAL-ENERGY", false]], "cc2 triplet pair energies": [[1776, "psivar-CC2-TRIPLET-PAIR-ENERGIES", false]], "cc3 alpha-alpha pair energies": [[1776, "psivar-CC3-ALPHA-ALPHA-PAIR-ENERGIES", false]], "cc3 alpha-beta pair energies": [[1776, "psivar-CC3-ALPHA-BETA-PAIR-ENERGIES", false]], "cc3 correlation energy": [[1776, "psivar-CC3-CORRELATION-ENERGY", false]], "cc3 singlet pair energies": [[1776, "psivar-CC3-SINGLET-PAIR-ENERGIES", false]], "cc3 total energy": [[1776, "psivar-CC3-TOTAL-ENERGY", false]], "cc3 triplet pair energies": [[1776, "psivar-CC3-TRIPLET-PAIR-ENERGIES", false]], "cc3_follow_root (cceom)": [[1704, "term-CC3_FOLLOW_ROOT-CCEOM", true]], "cc4 correlation energy": [[1776, "psivar-CC4-CORRELATION-ENERGY", false]], "cc4 total energy": [[1776, "psivar-CC4-TOTAL-ENERGY", false]], "cc_a_ras3_max (detci)": [[1704, "term-CC_A_RAS3_MAX-DETCI", true]], "cc_b_ras3_max (detci)": [[1704, "term-CC_B_RAS3_MAX-DETCI", true]], "cc_diis_max_vecs (dfocc)": [[1704, "term-CC_DIIS_MAX_VECS-DFOCC", true]], "cc_diis_min_vecs (dfocc)": [[1704, "term-CC_DIIS_MIN_VECS-DFOCC", true]], "cc_ex_level (detci)": [[1704, "term-CC_EX_LEVEL-DETCI", true]], "cc_fix_external (detci)": [[1704, "term-CC_FIX_EXTERNAL-DETCI", true]], "cc_fix_external_min (detci)": [[1704, "term-CC_FIX_EXTERNAL_MIN-DETCI", true]], "cc_lambda (dfocc)": [[1704, "term-CC_LAMBDA-DFOCC", true]], "cc_macro (detci)": [[1704, "term-CC_MACRO-DETCI", true]], "cc_maxiter (dfocc)": [[1704, "term-CC_MAXITER-DFOCC", true]], "cc_maxiter (occ)": [[1704, "term-CC_MAXITER-OCC", true]], "cc_mixed (detci)": [[1704, "term-CC_MIXED-DETCI", true]], "cc_num_threads (ccenergy)": [[1704, "term-CC_NUM_THREADS-CCENERGY", true]], "cc_num_threads (cceom)": [[1704, "term-CC_NUM_THREADS-CCEOM", true]], "cc_num_threads (cctriples)": [[1704, "term-CC_NUM_THREADS-CCTRIPLES", true]], "cc_num_threads (psimrcc)": [[1704, "term-CC_NUM_THREADS-PSIMRCC", true]], "cc_os_scale (ccenergy)": [[1704, "term-CC_OS_SCALE-CCENERGY", true]], "cc_ras34_max (detci)": [[1704, "term-CC_RAS34_MAX-DETCI", true]], "cc_ras3_max (detci)": [[1704, "term-CC_RAS3_MAX-DETCI", true]], "cc_ras4_max (detci)": [[1704, "term-CC_RAS4_MAX-DETCI", true]], "cc_scale_os (fnocc)": [[1704, "term-CC_SCALE_OS-FNOCC", true]], "cc_scale_ss (fnocc)": [[1704, "term-CC_SCALE_SS-FNOCC", true]], "cc_ss_scale (ccenergy)": [[1704, "term-CC_SS_SCALE-CCENERGY", true]], "cc_timings (fnocc)": [[1704, "term-CC_TIMINGS-FNOCC", true]], "cc_type (globals)": [[1704, "term-CC_TYPE-GLOBALS", true]], "cc_update_eps (detci)": [[1704, "term-CC_UPDATE_EPS-DETCI", true]], "cc_val_ex_level (detci)": [[1704, "term-CC_VAL_EX_LEVEL-DETCI", true]], "cc_variational (detci)": [[1704, "term-CC_VARIATIONAL-DETCI", true]], "cc_vecs_read (detci)": [[1704, "term-CC_VECS_READ-DETCI", true]], "cc_vecs_write (detci)": [[1704, "term-CC_VECS_WRITE-DETCI", true]], "ccd correlation energy": [[1776, "psivar-CCD-CORRELATION-ENERGY", false]], "ccd doubles energy": [[1776, "psivar-CCD-DOUBLES-ENERGY", false]], "ccd opposite-spin correlation energy": [[1776, "psivar-CCD-OPPOSITE-SPIN-CORRELATION-ENERGY", false]], "ccd same-spin correlation energy": [[1776, "psivar-CCD-SAME-SPIN-CORRELATION-ENERGY", false]], "ccd singles energy": [[1776, "psivar-CCD-SINGLES-ENERGY", false]], "ccd total energy": [[1776, "psivar-CCD-TOTAL-ENERGY", false]], "ccd_e_convergence (sapt)": [[1704, "term-CCD_E_CONVERGENCE-SAPT", true]], "ccd_maxiter (sapt)": [[1704, "term-CCD_MAXITER-SAPT", true]], "ccd_t_convergence (sapt)": [[1704, "term-CCD_T_CONVERGENCE-SAPT", true]], "ccdensity() (in module psi4.core)": [[160, "psi4.core.ccdensity", false]], "ccenergy() (in module psi4.core)": [[161, "psi4.core.ccenergy", false]], "cceom() (in module psi4.core)": [[162, "psi4.core.cceom", false]], "cchbar() (in module psi4.core)": [[163, "psi4.core.cchbar", false]], "ccl_energy (occ)": [[1704, "term-CCL_ENERGY-OCC", true]], "cclambda() (in module psi4.core)": [[164, "psi4.core.cclambda", false]], "ccn correlation energy": [[1776, "psivar-CCn-CORRELATION-ENERGY", false]], "ccn total energy": [[1776, "psivar-CCn-TOTAL-ENERGY", false]], "ccn-1a correlation energy": [[1776, "psivar-CCn-1a-CORRELATION-ENERGY", false]], "ccn-1a total energy": [[1776, "psivar-CCn-1a-TOTAL-ENERGY", false]], "ccn-1b correlation energy": [[1776, "psivar-CCn-1b-CORRELATION-ENERGY", false]], "ccn-1b total energy": [[1776, "psivar-CCn-1b-TOTAL-ENERGY", false]], "ccn-3 correlation energy": [[1776, "psivar-CCn-3-CORRELATION-ENERGY", false]], "ccn-3 total energy": [[1776, "psivar-CCn-3-TOTAL-ENERGY", false]], "ccname root m (h) -> root n (i) einstein a (len)": [[1776, "psivar-CCname-ROOT-m-h-ROOT-n-i-EINSTEIN-A-LEN", false]], "ccname root m (h) -> root n (i) einstein b (len)": [[1776, "psivar-CCname-ROOT-m-h-ROOT-n-i-EINSTEIN-B-LEN", false]], "ccname root m (h) -> root n (i) oscillator strength (len)": [[1776, "psivar-CCname-ROOT-m-h-ROOT-n-i-OSCILLATOR-STRENGTH-LEN", false]], "ccname root m (h) -> root n (i) rotatory strength (len)": [[1776, "psivar-CCname-ROOT-m-h-ROOT-n-i-ROTATORY-STRENGTH-LEN", false]], "ccname root m (h) -> root n (i) rotatory strength (vel)": [[1776, "psivar-CCname-ROOT-m-h-ROOT-n-i-ROTATORY-STRENGTH-VEL", false]], "ccname root m (in h) -> root n (in i) einstein a (len)": [[1776, "psivar-CCname-ROOT-m-IN-h-ROOT-n-IN-i-EINSTEIN-A-LEN", false]], "ccname root m (in h) -> root n (in i) einstein b (len)": [[1776, "psivar-CCname-ROOT-m-IN-h-ROOT-n-IN-i-EINSTEIN-B-LEN", false]], "ccname root m (in h) -> root n (in i) oscillator strength (len)": [[1776, "psivar-CCname-ROOT-m-IN-h-ROOT-n-IN-i-OSCILLATOR-STRENGTH-LEN", false]], "ccname root m (in h) -> root n (in i) rotatory strength (len)": [[1776, "psivar-CCname-ROOT-m-IN-h-ROOT-n-IN-i-ROTATORY-STRENGTH-LEN", false]], "ccname root m (in h) -> root n (in i) rotatory strength (vel)": [[1776, "psivar-CCname-ROOT-m-IN-h-ROOT-n-IN-i-ROTATORY-STRENGTH-VEL", false]], "ccname root m -> root n einstein a (len)": [[1776, "psivar-CCname-ROOT-m-ROOT-n-EINSTEIN-A-LEN", false]], "ccname root m -> root n einstein a (len) - h transition": [[1776, "psivar-CCname-ROOT-m-ROOT-n-EINSTEIN-A-LEN-h-TRANSITION", false]], "ccname root m -> root n einstein b (len)": [[1776, "psivar-CCname-ROOT-m-ROOT-n-EINSTEIN-B-LEN", false]], "ccname root m -> root n einstein b (len) - h transition": [[1776, "psivar-CCname-ROOT-m-ROOT-n-EINSTEIN-B-LEN-h-TRANSITION", false]], "ccname root m -> root n oscillator strength (len)": [[1776, "psivar-CCname-ROOT-m-ROOT-n-OSCILLATOR-STRENGTH-LEN", false]], "ccname root m -> root n oscillator strength (len) - h transition": [[1776, "psivar-CCname-ROOT-m-ROOT-n-OSCILLATOR-STRENGTH-LEN-h-TRANSITION", false]], "ccname root m -> root n rotatory strength (len)": [[1776, "psivar-CCname-ROOT-m-ROOT-n-ROTATORY-STRENGTH-LEN", false]], "ccname root m -> root n rotatory strength (len) - h transition": [[1776, "psivar-CCname-ROOT-m-ROOT-n-ROTATORY-STRENGTH-LEN-h-TRANSITION", false]], "ccname root m -> root n rotatory strength (vel)": [[1776, "psivar-CCname-ROOT-m-ROOT-n-ROTATORY-STRENGTH-VEL", false]], "ccname root m -> root n rotatory strength (vel) - h transition": [[1776, "psivar-CCname-ROOT-m-ROOT-n-ROTATORY-STRENGTH-VEL-h-TRANSITION", false]], "ccname root n (h) correlation energy": [[1776, "psivar-CCname-ROOT-n-h-CORRELATION-ENERGY", false]], "ccname root n (h) dipole": [[1776, "psivar-CCname-ROOT-n-h-DIPOLE", false]], "ccname root n (h) quadrupole": [[1776, "psivar-CCname-ROOT-n-h-QUADRUPOLE", false]], "ccname root n (h) total energy": [[1776, "psivar-CCname-ROOT-n-h-TOTAL-ENERGY", false]], "ccname root n (in h) correlation energy": [[1776, "psivar-CCname-ROOT-n-IN-h-CORRELATION-ENERGY", false]], "ccname root n (in h) dipole": [[1776, "psivar-CCname-ROOT-n-IN-h-DIPOLE", false]], "ccname root n (in h) quadrupole": [[1776, "psivar-CCname-ROOT-n-IN-h-QUADRUPOLE", false]], "ccname root n (in h) total energy": [[1776, "psivar-CCname-ROOT-n-IN-h-TOTAL-ENERGY", false]], "ccname root n correlation energy": [[1776, "psivar-CCname-ROOT-n-CORRELATION-ENERGY", false]], "ccname root n correlation energy - h transition": [[1776, "psivar-CCname-ROOT-n-CORRELATION-ENERGY-h-TRANSITION", false]], "ccname root n dipole": [[1776, "psivar-CCname-ROOT-n-DIPOLE", false]], "ccname root n dipole - h transition": [[1776, "psivar-CCname-ROOT-n-DIPOLE-h-TRANSITION", false]], "ccname root n quadrupole": [[1776, "psivar-CCname-ROOT-n-QUADRUPOLE", false]], "ccname root n quadrupole - h transition": [[1776, "psivar-CCname-ROOT-n-QUADRUPOLE-h-TRANSITION", false]], "ccname root n total energy": [[1776, "psivar-CCname-ROOT-n-TOTAL-ENERGY", false]], "ccname root n total energy - h transition": [[1776, "psivar-CCname-ROOT-n-TOTAL-ENERGY-h-TRANSITION", false]], "ccnn correlation energy": [[1776, "psivar-CCnn-CORRELATION-ENERGY", false]], "ccnn total energy": [[1776, "psivar-CCnn-TOTAL-ENERGY", false]], "ccresponse() (in module psi4.core)": [[165, "psi4.core.ccresponse", false]], "ccsd alpha-alpha pair energies": [[1776, "psivar-CCSD-ALPHA-ALPHA-PAIR-ENERGIES", false]], "ccsd alpha-beta pair energies": [[1776, "psivar-CCSD-ALPHA-BETA-PAIR-ENERGIES", false]], "ccsd correlation energy": [[1776, "psivar-CCSD-CORRELATION-ENERGY", false]], "ccsd dipole polarizability @ xnm": [[1776, "psivar-CCSD-DIPOLE-POLARIZABILITY-xNM", false]], "ccsd dipole polarizability tensor @ xnm": [[1776, "psivar-CCSD-DIPOLE-POLARIZABILITY-TENSOR-xNM", false]], "ccsd doubles energy": [[1776, "psivar-CCSD-DOUBLES-ENERGY", false]], "ccsd iterations": [[1776, "psivar-CCSD-ITERATIONS", false]], "ccsd opposite-spin correlation energy": [[1776, "psivar-CCSD-OPPOSITE-SPIN-CORRELATION-ENERGY", false]], "ccsd quadrupole polarizability @ xnm": [[1776, "psivar-CCSD-QUADRUPOLE-POLARIZABILITY-xNM", false]], "ccsd quadrupole polarizability tensor @ xnm": [[1776, "psivar-CCSD-QUADRUPOLE-POLARIZABILITY-TENSOR-xNM", false]], "ccsd rotation (len) origin-dependence @ xnm": [[1776, "psivar-CCSD-ROTATION-LEN-ORIGIN-DEPENDENCE-xNM", false]], "ccsd same-spin correlation energy": [[1776, "psivar-CCSD-SAME-SPIN-CORRELATION-ENERGY", false]], "ccsd singles energy": [[1776, "psivar-CCSD-SINGLES-ENERGY", false]], "ccsd singlet pair energies": [[1776, "psivar-CCSD-SINGLET-PAIR-ENERGIES", false]], "ccsd specific rotation (len) @ xnm": [[1776, "psivar-CCSD-SPECIFIC-ROTATION-LEN-xNM", false]], "ccsd specific rotation (mvg) @ xnm": [[1776, "psivar-CCSD-SPECIFIC-ROTATION-MVG-xNM", false]], "ccsd specific rotation (vel) @ xnm": [[1776, "psivar-CCSD-SPECIFIC-ROTATION-VEL-xNM", false]], "ccsd total energy": [[1776, "psivar-CCSD-TOTAL-ENERGY", false]], "ccsd triplet pair energies": [[1776, "psivar-CCSD-TRIPLET-PAIR-ENERGIES", false]], "ccsd(at) correlation energy": [[1776, "psivar-CCSD-AT-CORRELATION-ENERGY", false]], "ccsd(at) total energy": [[1776, "psivar-CCSD-AT-TOTAL-ENERGY", false]], "ccsd(t)": [[1771, "index-1", false]], "ccsd(t) correlation energy": [[1776, "psivar-CCSD-T-CORRELATION-ENERGY", false]], "ccsd(t) total energy": [[1776, "psivar-CCSD-T-TOTAL-ENERGY", false]], "ccsd(t)_l correlation energy": [[1776, "psivar-CCSD-T-_L-CORRELATION-ENERGY", false]], "ccsd(t)_l total energy": [[1776, "psivar-CCSD-T-_L-TOTAL-ENERGY", false]], "ccsdt correlation energy": [[1776, "psivar-CCSDT-CORRELATION-ENERGY", false]], "ccsdt total energy": [[1776, "psivar-CCSDT-TOTAL-ENERGY", false]], "ccsdt(q) correlation energy": [[1776, "psivar-CCSDT-Q-CORRELATION-ENERGY", false]], "ccsdt(q) total energy": [[1776, "psivar-CCSDT-Q-TOTAL-ENERGY", false]], "ccsdt(q)/a correlation energy": [[1776, "psivar-CCSDT-Q-A-CORRELATION-ENERGY", false]], "ccsdt(q)/a total energy": [[1776, "psivar-CCSDT-Q-A-TOTAL-ENERGY", false]], "ccsdt(q)/b correlation energy": [[1776, "psivar-CCSDT-Q-B-CORRELATION-ENERGY", false]], "ccsdt(q)/b total energy": [[1776, "psivar-CCSDT-Q-B-TOTAL-ENERGY", false]], "ccsdt(q)_l correlation energy": [[1776, "psivar-CCSDT-Q-_L-CORRELATION-ENERGY", false]], "ccsdt(q)_l total energy": [[1776, "psivar-CCSDT-Q-_L-TOTAL-ENERGY", false]], "ccsdt-1a correlation energy": [[1776, "psivar-CCSDT-1a-CORRELATION-ENERGY", false]], "ccsdt-1a total energy": [[1776, "psivar-CCSDT-1a-TOTAL-ENERGY", false]], "ccsdt-1b correlation energy": [[1776, "psivar-CCSDT-1b-CORRELATION-ENERGY", false]], "ccsdt-1b total energy": [[1776, "psivar-CCSDT-1b-TOTAL-ENERGY", false]], "ccsdt-3 correlation energy": [[1776, "psivar-CCSDT-3-CORRELATION-ENERGY", false]], "ccsdt-3 total energy": [[1776, "psivar-CCSDT-3-TOTAL-ENERGY", false]], "ccsdtq correlation energy": [[1776, "psivar-CCSDTQ-CORRELATION-ENERGY", false]], "ccsdtq total energy": [[1776, "psivar-CCSDTQ-TOTAL-ENERGY", false]], "ccsdtq-1a correlation energy": [[1776, "psivar-CCSDTQ-1a-CORRELATION-ENERGY", false]], "ccsdtq-1a total energy": [[1776, "psivar-CCSDTQ-1a-TOTAL-ENERGY", false]], "ccsdtq-1b correlation energy": [[1776, "psivar-CCSDTQ-1b-CORRELATION-ENERGY", false]], "ccsdtq-1b total energy": [[1776, "psivar-CCSDTQ-1b-TOTAL-ENERGY", false]], "ccsdtq-3 correlation energy": [[1776, "psivar-CCSDTQ-3-CORRELATION-ENERGY", false]], "ccsdtq-3 total energy": [[1776, "psivar-CCSDTQ-3-TOTAL-ENERGY", false]], "cctransort() (in module psi4.core)": [[166, "psi4.core.cctransort", false]], "cctriples() (in module psi4.core)": [[167, "psi4.core.cctriples", false]], "ccwavefunction (class in psi4.core)": [[11, "psi4.core.CCWavefunction", false]], "cdsalc (class in psi4.core)": [[15, "psi4.core.CdSalc", false]], "cdsalclist (class in psi4.core)": [[16, "psi4.core.CdSalcList", false]], "cdsalcs() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.cdsalcs", false]], "center_of_mass() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.center_of_mass", false]], "cepa": [[1771, "index-1", false]], "cepa(0) correlation energy": [[1776, "psivar-CEPA-0-CORRELATION-ENERGY", false]], "cepa(0) dipole": [[1776, "psivar-CEPA-0-DIPOLE", false]], "cepa(0) doubles energy": [[1776, "psivar-CEPA-0-DOUBLES-ENERGY", false]], "cepa(0) opposite-spin correlation energy": [[1776, "psivar-CEPA-0-OPPOSITE-SPIN-CORRELATION-ENERGY", false]], "cepa(0) quadrupole": [[1776, "psivar-CEPA-0-QUADRUPOLE", false]], "cepa(0) same-spin correlation energy": [[1776, "psivar-CEPA-0-SAME-SPIN-CORRELATION-ENERGY", false]], "cepa(0) singles energy": [[1776, "psivar-CEPA-0-SINGLES-ENERGY", false]], "cepa(0) total energy": [[1776, "psivar-CEPA-0-TOTAL-ENERGY", false]], "cepa(1) correlation energy": [[1776, "psivar-CEPA-1-CORRELATION-ENERGY", false]], "cepa(1) doubles energy": [[1776, "psivar-CEPA-1-DOUBLES-ENERGY", false]], "cepa(1) opposite-spin correlation energy": [[1776, "psivar-CEPA-1-OPPOSITE-SPIN-CORRELATION-ENERGY", false]], "cepa(1) same-spin correlation energy": [[1776, "psivar-CEPA-1-SAME-SPIN-CORRELATION-ENERGY", false]], "cepa(1) singles energy": [[1776, "psivar-CEPA-1-SINGLES-ENERGY", false]], "cepa(1) total energy": [[1776, "psivar-CEPA-1-TOTAL-ENERGY", false]], "cepa(2) correlation energy": [[1776, "psivar-CEPA-2-CORRELATION-ENERGY", false]], "cepa(2) doubles energy": [[1776, "psivar-CEPA-2-DOUBLES-ENERGY", false]], "cepa(2) opposite-spin correlation energy": [[1776, "psivar-CEPA-2-OPPOSITE-SPIN-CORRELATION-ENERGY", false]], "cepa(2) same-spin correlation energy": [[1776, "psivar-CEPA-2-SAME-SPIN-CORRELATION-ENERGY", false]], "cepa(2) singles energy": [[1776, "psivar-CEPA-2-SINGLES-ENERGY", false]], "cepa(2) total energy": [[1776, "psivar-CEPA-2-TOTAL-ENERGY", false]], "cepa(3) correlation energy": [[1776, "psivar-CEPA-3-CORRELATION-ENERGY", false]], "cepa(3) doubles energy": [[1776, "psivar-CEPA-3-DOUBLES-ENERGY", false]], "cepa(3) opposite-spin correlation energy": [[1776, "psivar-CEPA-3-OPPOSITE-SPIN-CORRELATION-ENERGY", false]], "cepa(3) same-spin correlation energy": [[1776, "psivar-CEPA-3-SAME-SPIN-CORRELATION-ENERGY", false]], "cepa(3) singles energy": [[1776, "psivar-CEPA-3-SINGLES-ENERGY", false]], "cepa(3) total energy": [[1776, "psivar-CEPA-3-TOTAL-ENERGY", false]], "cepa_level (fnocc)": [[1704, "term-CEPA_LEVEL-FNOCC", true]], "cepa_no_singles (fnocc)": [[1704, "term-CEPA_NO_SINGLES-FNOCC", true]], "cepa_os_scale (occ)": [[1704, "term-CEPA_OS_SCALE-OCC", true]], "cepa_sos_scale (occ)": [[1704, "term-CEPA_SOS_SCALE-OCC", true]], "cepa_ss_scale (occ)": [[1704, "term-CEPA_SS_SCALE-OCC", true]], "cepa_type (occ)": [[1704, "term-CEPA_TYPE-OCC", true]], "cfour": [[1743, "index-0", false]], "cfour error code": [[1776, "psivar-CFOUR-ERROR-CODE", false]], "cfour_abcdtype (cfour)": [[1704, "term-CFOUR_ABCDTYPE-CFOUR", true]], "cfour_active_orbi (cfour)": [[1704, "term-CFOUR_ACTIVE_ORBI-CFOUR", true]], "cfour_anh_algorithm (cfour)": [[1704, "term-CFOUR_ANH_ALGORITHM-CFOUR", true]], "cfour_anh_derivatives (cfour)": [[1704, "term-CFOUR_ANH_DERIVATIVES-CFOUR", true]], "cfour_anh_stepsize (cfour)": [[1704, "term-CFOUR_ANH_STEPSIZE-CFOUR", true]], "cfour_anh_symmetry (cfour)": [[1704, "term-CFOUR_ANH_SYMMETRY-CFOUR", true]], "cfour_anharmonic (cfour)": [[1704, "term-CFOUR_ANHARMONIC-CFOUR", true]], "cfour_ao_ladders (cfour)": [[1704, "term-CFOUR_AO_LADDERS-CFOUR", true]], "cfour_av_scf (cfour)": [[1704, "term-CFOUR_AV_SCF-CFOUR", true]], "cfour_basis (cfour)": [[1704, "term-CFOUR_BASIS-CFOUR", true]], "cfour_bruck_conv (cfour)": [[1704, "term-CFOUR_BRUCK_CONV-CFOUR", true]], "cfour_brueckner (cfour)": [[1704, "term-CFOUR_BRUECKNER-CFOUR", true]], "cfour_cache_recs (cfour)": [[1704, "term-CFOUR_CACHE_RECS-CFOUR", true]], "cfour_calc_level (cfour)": [[1704, "term-CFOUR_CALC_LEVEL-CFOUR", true]], "cfour_cc_conv (cfour)": [[1704, "term-CFOUR_CC_CONV-CFOUR", true]], "cfour_cc_exporder (cfour)": [[1704, "term-CFOUR_CC_EXPORDER-CFOUR", true]], "cfour_cc_extrapolation (cfour)": [[1704, "term-CFOUR_CC_EXTRAPOLATION-CFOUR", true]], "cfour_cc_maxcyc (cfour)": [[1704, "term-CFOUR_CC_MAXCYC-CFOUR", true]], "cfour_cc_program (cfour)": [[1704, "term-CFOUR_CC_PROGRAM-CFOUR", true]], "cfour_charge (cfour)": [[1704, "term-CFOUR_CHARGE-CFOUR", true]], "cfour_cis_conv (cfour)": [[1704, "term-CFOUR_CIS_CONV-CFOUR", true]], "cfour_continuum (cfour)": [[1704, "term-CFOUR_CONTINUUM-CFOUR", true]], "cfour_contraction (cfour)": [[1704, "term-CFOUR_CONTRACTION-CFOUR", true]], "cfour_convergence (cfour)": [[1704, "term-CFOUR_CONVERGENCE-CFOUR", true]], "cfour_coordinates (cfour)": [[1704, "term-CFOUR_COORDINATES-CFOUR", true]], "cfour_core_orbitals (cfour)": [[1704, "term-CFOUR_CORE_ORBITALS-CFOUR", true]], "cfour_cphf_conver (cfour)": [[1704, "term-CFOUR_CPHF_CONVER-CFOUR", true]], "cfour_cphf_maxcyc (cfour)": [[1704, "term-CFOUR_CPHF_MAXCYC-CFOUR", true]], "cfour_curvilinear (cfour)": [[1704, "term-CFOUR_CURVILINEAR-CFOUR", true]], "cfour_dboc (cfour)": [[1704, "term-CFOUR_DBOC-CFOUR", true]], "cfour_dct (cfour)": [[1704, "term-CFOUR_DCT-CFOUR", true]], "cfour_deriv_level (cfour)": [[1704, "term-CFOUR_DERIV_LEVEL-CFOUR", true]], "cfour_diff_type (cfour)": [[1704, "term-CFOUR_DIFF_TYPE-CFOUR", true]], "cfour_dropmo (cfour)": [[1704, "term-CFOUR_DROPMO-CFOUR", true]], "cfour_ecp (cfour)": [[1704, "term-CFOUR_ECP-CFOUR", true]], "cfour_eigenvector (cfour)": [[1704, "term-CFOUR_EIGENVECTOR-CFOUR", true]], "cfour_el_anharm (cfour)": [[1704, "term-CFOUR_EL_ANHARM-CFOUR", true]], "cfour_eom_nonit (cfour)": [[1704, "term-CFOUR_EOM_NONIT-CFOUR", true]], "cfour_estate_conv (cfour)": [[1704, "term-CFOUR_ESTATE_CONV-CFOUR", true]], "cfour_estate_maxcyc (cfour)": [[1704, "term-CFOUR_ESTATE_MAXCYC-CFOUR", true]], "cfour_estate_prop (cfour)": [[1704, "term-CFOUR_ESTATE_PROP-CFOUR", true]], "cfour_estate_sym (cfour)": [[1704, "term-CFOUR_ESTATE_SYM-CFOUR", true]], "cfour_estate_trans (cfour)": [[1704, "term-CFOUR_ESTATE_TRANS-CFOUR", true]], "cfour_eval_hess (cfour)": [[1704, "term-CFOUR_EVAL_HESS-CFOUR", true]], "cfour_excitation (cfour)": [[1704, "term-CFOUR_EXCITATION-CFOUR", true]], "cfour_excite (cfour)": [[1704, "term-CFOUR_EXCITE-CFOUR", true]], "cfour_fc_field (cfour)": [[1704, "term-CFOUR_FC_FIELD-CFOUR", true]], "cfour_fd_calctype (cfour)": [[1704, "term-CFOUR_FD_CALCTYPE-CFOUR", true]], "cfour_fd_irreps (cfour)": [[1704, "term-CFOUR_FD_IRREPS-CFOUR", true]], "cfour_fd_project (cfour)": [[1704, "term-CFOUR_FD_PROJECT-CFOUR", true]], "cfour_fd_stepsize (cfour)": [[1704, "term-CFOUR_FD_STEPSIZE-CFOUR", true]], "cfour_fd_usegroup (cfour)": [[1704, "term-CFOUR_FD_USEGROUP-CFOUR", true]], "cfour_file_recsiz (cfour)": [[1704, "term-CFOUR_FILE_RECSIZ-CFOUR", true]], "cfour_file_stripe (cfour)": [[1704, "term-CFOUR_FILE_STRIPE-CFOUR", true]], "cfour_finite_perturbation (cfour)": [[1704, "term-CFOUR_FINITE_PERTURBATION-CFOUR", true]], "cfour_fock (cfour)": [[1704, "term-CFOUR_FOCK-CFOUR", true]], "cfour_freq_algorithm (cfour)": [[1704, "term-CFOUR_FREQ_ALGORITHM-CFOUR", true]], "cfour_frozen_core (cfour)": [[1704, "term-CFOUR_FROZEN_CORE-CFOUR", true]], "cfour_frozen_virt (cfour)": [[1704, "term-CFOUR_FROZEN_VIRT-CFOUR", true]], "cfour_gamma_abcd (cfour)": [[1704, "term-CFOUR_GAMMA_ABCD-CFOUR", true]], "cfour_genbas_1 (cfour)": [[1704, "term-CFOUR_GENBAS_1-CFOUR", true]], "cfour_genbas_2 (cfour)": [[1704, "term-CFOUR_GENBAS_2-CFOUR", true]], "cfour_genbas_3 (cfour)": [[1704, "term-CFOUR_GENBAS_3-CFOUR", true]], "cfour_genbas_4 (cfour)": [[1704, "term-CFOUR_GENBAS_4-CFOUR", true]], "cfour_geo_conv (cfour)": [[1704, "term-CFOUR_GEO_CONV-CFOUR", true]], "cfour_geo_maxcyc (cfour)": [[1704, "term-CFOUR_GEO_MAXCYC-CFOUR", true]], "cfour_geo_maxstep (cfour)": [[1704, "term-CFOUR_GEO_MAXSTEP-CFOUR", true]], "cfour_geo_method (cfour)": [[1704, "term-CFOUR_GEO_METHOD-CFOUR", true]], "cfour_giao (cfour)": [[1704, "term-CFOUR_GIAO-CFOUR", true]], "cfour_grid (cfour)": [[1704, "term-CFOUR_GRID-CFOUR", true]], "cfour_guess (cfour)": [[1704, "term-CFOUR_GUESS-CFOUR", true]], "cfour_hbar (cfour)": [[1704, "term-CFOUR_HBAR-CFOUR", true]], "cfour_hfstability (cfour)": [[1704, "term-CFOUR_HFSTABILITY-CFOUR", true]], "cfour_incore (cfour)": [[1704, "term-CFOUR_INCORE-CFOUR", true]], "cfour_input_mrcc (cfour)": [[1704, "term-CFOUR_INPUT_MRCC-CFOUR", true]], "cfour_integrals (cfour)": [[1704, "term-CFOUR_INTEGRALS-CFOUR", true]], "cfour_joda_print (cfour)": [[1704, "term-CFOUR_JODA_PRINT-CFOUR", true]], "cfour_lineq_conv (cfour)": [[1704, "term-CFOUR_LINEQ_CONV-CFOUR", true]], "cfour_lineq_maxcy (cfour)": [[1704, "term-CFOUR_LINEQ_MAXCY-CFOUR", true]], "cfour_lineq_type (cfour)": [[1704, "term-CFOUR_LINEQ_TYPE-CFOUR", true]], "cfour_lock_orbocc (cfour)": [[1704, "term-CFOUR_LOCK_ORBOCC-CFOUR", true]], "cfour_maxstep (cfour)": [[1704, "term-CFOUR_MAXSTEP-CFOUR", true]], "cfour_mem_unit (cfour)": [[1704, "term-CFOUR_MEM_UNIT-CFOUR", true]], "cfour_memory_size (cfour)": [[1704, "term-CFOUR_MEMORY_SIZE-CFOUR", true]], "cfour_method (cfour)": [[1704, "term-CFOUR_METHOD-CFOUR", true]], "cfour_mrcc (cfour)": [[1704, "term-CFOUR_MRCC-CFOUR", true]], "cfour_multiplicity (cfour)": [[1704, "term-CFOUR_MULTIPLICITY-CFOUR", true]], "cfour_nacoupling (cfour)": [[1704, "term-CFOUR_NACOUPLING-CFOUR", true]], "cfour_negeval (cfour)": [[1704, "term-CFOUR_NEGEVAL-CFOUR", true]], "cfour_newnorm (cfour)": [[1704, "term-CFOUR_NEWNORM-CFOUR", true]], "cfour_nonhf (cfour)": [[1704, "term-CFOUR_NONHF-CFOUR", true]], "cfour_ntop_tamp (cfour)": [[1704, "term-CFOUR_NTOP_TAMP-CFOUR", true]], "cfour_occupation (cfour)": [[1704, "term-CFOUR_OCCUPATION-CFOUR", true]], "cfour_omp_num_threads (cfour)": [[1704, "term-CFOUR_OMP_NUM_THREADS-CFOUR", true]], "cfour_open-shell (cfour)": [[1704, "term-CFOUR_OPEN-SHELL-CFOUR", true]], "cfour_opt_maxcyc (cfour)": [[1704, "term-CFOUR_OPT_MAXCYC-CFOUR", true]], "cfour_orbitals (cfour)": [[1704, "term-CFOUR_ORBITALS-CFOUR", true]], "cfour_pert_orb (cfour)": [[1704, "term-CFOUR_PERT_ORB-CFOUR", true]], "cfour_points (cfour)": [[1704, "term-CFOUR_POINTS-CFOUR", true]], "cfour_print (cfour)": [[1704, "term-CFOUR_PRINT-CFOUR", true]], "cfour_prop_integral (cfour)": [[1704, "term-CFOUR_PROP_INTEGRAL-CFOUR", true]], "cfour_props (cfour)": [[1704, "term-CFOUR_PROPS-CFOUR", true]], "cfour_qrhf_general (cfour)": [[1704, "term-CFOUR_QRHF_GENERAL-CFOUR", true]], "cfour_qrhf_orbital (cfour)": [[1704, "term-CFOUR_QRHF_ORBITAL-CFOUR", true]], "cfour_qrhfgues (cfour)": [[1704, "term-CFOUR_QRHFGUES-CFOUR", true]], "cfour_raman_int (cfour)": [[1704, "term-CFOUR_RAMAN_INT-CFOUR", true]], "cfour_raman_orb (cfour)": [[1704, "term-CFOUR_RAMAN_ORB-CFOUR", true]], "cfour_rdo (cfour)": [[1704, "term-CFOUR_RDO-CFOUR", true]], "cfour_reference (cfour)": [[1704, "term-CFOUR_REFERENCE-CFOUR", true]], "cfour_relativistic (cfour)": [[1704, "term-CFOUR_RELATIVISTIC-CFOUR", true]], "cfour_relax_dens (cfour)": [[1704, "term-CFOUR_RELAX_DENS-CFOUR", true]], "cfour_res_raman (cfour)": [[1704, "term-CFOUR_RES_RAMAN-CFOUR", true]], "cfour_restart_cc (cfour)": [[1704, "term-CFOUR_RESTART_CC-CFOUR", true]], "cfour_rot_evec (cfour)": [[1704, "term-CFOUR_ROT_EVEC-CFOUR", true]], "cfour_save_ints (cfour)": [[1704, "term-CFOUR_SAVE_INTS-CFOUR", true]], "cfour_scale_on (cfour)": [[1704, "term-CFOUR_SCALE_ON-CFOUR", true]], "cfour_scf_conv (cfour)": [[1704, "term-CFOUR_SCF_CONV-CFOUR", true]], "cfour_scf_damping (cfour)": [[1704, "term-CFOUR_SCF_DAMPING-CFOUR", true]], "cfour_scf_exporder (cfour)": [[1704, "term-CFOUR_SCF_EXPORDER-CFOUR", true]], "cfour_scf_expstart (cfour)": [[1704, "term-CFOUR_SCF_EXPSTART-CFOUR", true]], "cfour_scf_extrapolation (cfour)": [[1704, "term-CFOUR_SCF_EXTRAPOLATION-CFOUR", true]], "cfour_scf_maxcyc (cfour)": [[1704, "term-CFOUR_SCF_MAXCYC-CFOUR", true]], "cfour_sd_field (cfour)": [[1704, "term-CFOUR_SD_FIELD-CFOUR", true]], "cfour_spherical (cfour)": [[1704, "term-CFOUR_SPHERICAL-CFOUR", true]], "cfour_spin_flip (cfour)": [[1704, "term-CFOUR_SPIN_FLIP-CFOUR", true]], "cfour_spin_orbit (cfour)": [[1704, "term-CFOUR_SPIN_ORBIT-CFOUR", true]], "cfour_spin_scal (cfour)": [[1704, "term-CFOUR_SPIN_SCAL-CFOUR", true]], "cfour_spinrotation (cfour)": [[1704, "term-CFOUR_SPINROTATION-CFOUR", true]], "cfour_subgroup (cfour)": [[1704, "term-CFOUR_SUBGROUP-CFOUR", true]], "cfour_sym_check (cfour)": [[1704, "term-CFOUR_SYM_CHECK-CFOUR", true]], "cfour_symmetry (cfour)": [[1704, "term-CFOUR_SYMMETRY-CFOUR", true]], "cfour_t3_extrapol (cfour)": [[1704, "term-CFOUR_T3_EXTRAPOL-CFOUR", true]], "cfour_tamp_sum (cfour)": [[1704, "term-CFOUR_TAMP_SUM-CFOUR", true]], "cfour_thermochemistry (cfour)": [[1704, "term-CFOUR_THERMOCHEMISTRY-CFOUR", true]], "cfour_trans_inv (cfour)": [[1704, "term-CFOUR_TRANS_INV-CFOUR", true]], "cfour_treat_pert (cfour)": [[1704, "term-CFOUR_TREAT_PERT-CFOUR", true]], "cfour_uij_threshold (cfour)": [[1704, "term-CFOUR_UIJ_THRESHOLD-CFOUR", true]], "cfour_units (cfour)": [[1704, "term-CFOUR_UNITS-CFOUR", true]], "cfour_update_hessian (cfour)": [[1704, "term-CFOUR_UPDATE_HESSIAN-CFOUR", true]], "cfour_vibration (cfour)": [[1704, "term-CFOUR_VIBRATION-CFOUR", true]], "cfour_vtran (cfour)": [[1704, "term-CFOUR_VTRAN-CFOUR", true]], "cfour_xfield (cfour)": [[1704, "term-CFOUR_XFIELD-CFOUR", true]], "cfour_xform_tol (cfour)": [[1704, "term-CFOUR_XFORM_TOL-CFOUR", true]], "cfour_yfield (cfour)": [[1704, "term-CFOUR_YFIELD-CFOUR", true]], "cfour_zfield (cfour)": [[1704, "term-CFOUR_ZFIELD-CFOUR", true]], "cg_solver() (in module psi4.driver.p4util)": [[335, "psi4.driver.p4util.cg_solver", false]], "chain_dot() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.chain_dot", false]], "change_file_namespace() (psi4.core.io static method)": [[86, "psi4.core.IO.change_file_namespace", false]], "char_table() (psi4.core.pointgroup method)": [[120, "psi4.core.PointGroup.char_table", false]], "character() (psi4.core.irreduciblerepresentation method)": [[91, "psi4.core.IrreducibleRepresentation.character", false]], "charactertable (class in psi4.core)": [[17, "psi4.core.CharacterTable", false]], "charge": [[1833, "index-2", false]], "charge() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.charge", false]], "charge-transfer": [[1837, "index-4", false]], "check_phases() (psi4.core.hf method)": [[84, "psi4.core.HF.check_phases", false]], "chemps2": [[1746, "index-0", false]], "cholesky (dfocc)": [[1704, "term-CHOLESKY-DFOCC", true]], "cholesky_factorize() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.cholesky_factorize", false]], "cholesky_tolerance (dfocc)": [[1704, "term-CHOLESKY_TOLERANCE-DFOCC", true]], "cholesky_tolerance (fnocc)": [[1704, "term-CHOLESKY_TOLERANCE-FNOCC", true]], "cholesky_tolerance (scf)": [[1704, "term-CHOLESKY_TOLERANCE-SCF", true]], "ci": [[1755, "index-0", false], [1755, "index-1", false], [1755, "index-2", false], [1755, "index-3", false], [1755, "index-4", false], [1755, "index-5", false], [1789, "index-2", false]], "ci correlation energy": [[1776, "psivar-CI-CORRELATION-ENERGY", false]], "ci dipole": [[1776, "psivar-CI-DIPOLE", false]], "ci quadrupole": [[1776, "psivar-CI-QUADRUPOLE", false]], "ci root n -> root m dipole": [[1776, "psivar-CI-ROOT-n-ROOT-m-DIPOLE", false]], "ci root n -> root m quadrupole": [[1776, "psivar-CI-ROOT-n-ROOT-m-QUADRUPOLE", false]], "ci root n correlation energy": [[1776, "psivar-CI-ROOT-n-CORRELATION-ENERGY", false]], "ci root n dipole": [[1776, "psivar-CI-ROOT-n-DIPOLE", false]], "ci root n quadrupole": [[1776, "psivar-CI-ROOT-n-QUADRUPOLE", false]], "ci root n total energy": [[1776, "psivar-CI-ROOT-n-TOTAL-ENERGY", false]], "ci state-averaged correlation energy": [[1776, "psivar-CI-STATE-AVERAGED-CORRELATION-ENERGY", false]], "ci state-averaged total energy": [[1776, "psivar-CI-STATE-AVERAGED-TOTAL-ENERGY", false]], "ci total energy": [[1776, "psivar-CI-TOTAL-ENERGY", false]], "ci_diis (mcscf)": [[1704, "term-CI_DIIS-MCSCF", true]], "ci_file_start (detci)": [[1704, "term-CI_FILE_START-DETCI", true]], "ci_maxiter (detci)": [[1704, "term-CI_MAXITER-DETCI", true]], "ci_nat_orbs() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.ci_nat_orbs", false]], "ci_num_threads (detci)": [[1704, "term-CI_NUM_THREADS-DETCI", true]], "ci_type (globals)": [[1704, "term-CI_TYPE-GLOBALS", true]], "ciblks_print (detci)": [[1704, "term-CIBLKS_PRINT-DETCI", true]], "cin correlation energy": [[1776, "psivar-CIn-CORRELATION-ENERGY", false]], "cin total energy": [[1776, "psivar-CIn-TOTAL-ENERGY", false]], "cisd correlation energy": [[1776, "psivar-CISD-CORRELATION-ENERGY", false]], "cisd dipole": [[1776, "psivar-CISD-DIPOLE", false]], "cisd doubles energy": [[1776, "psivar-CISD-DOUBLES-ENERGY", false]], "cisd opposite-spin correlation energy": [[1776, "psivar-CISD-OPPOSITE-SPIN-CORRELATION-ENERGY", false]], "cisd quadrupole": [[1776, "psivar-CISD-QUADRUPOLE", false]], "cisd same-spin correlation energy": [[1776, "psivar-CISD-SAME-SPIN-CORRELATION-ENERGY", false]], "cisd singles energy": [[1776, "psivar-CISD-SINGLES-ENERGY", false]], "cisd total energy": [[1776, "psivar-CISD-TOTAL-ENERGY", false]], "cisdt correlation energy": [[1776, "psivar-CISDT-CORRELATION-ENERGY", false]], "cisdt total energy": [[1776, "psivar-CISDT-TOTAL-ENERGY", false]], "cisdtq correlation energy": [[1776, "psivar-CISDTQ-CORRELATION-ENERGY", false]], "cisdtq total energy": [[1776, "psivar-CISDTQ-TOTAL-ENERGY", false]], "citation() (psi4.core.dispersion method)": [[68, "psi4.core.Dispersion.citation", false]], "citation() (psi4.core.functional method)": [[80, "psi4.core.Functional.citation", false]], "citation() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.citation", false]], "civector (class in psi4.core)": [[12, "psi4.core.CIVector", false]], "ciwavefunction (class in psi4.core)": [[13, "psi4.core.CIWavefunction", false]], "ck() (psi4.core.somcscf method)": [[133, "psi4.core.SOMCSCF.Ck", false]], "clean() (in module psi4.core)": [[168, "psi4.core.clean", false]], "clean_options() (in module psi4.core)": [[169, "psi4.core.clean_options", false]], "clean_timers() (in module psi4.core)": [[170, "psi4.core.clean_timers", false]], "clean_variables() (in module psi4.core)": [[171, "psi4.core.clean_variables", false]], "cleanup_ci() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.cleanup_ci", false]], "cleanup_dpd() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.cleanup_dpd", false]], "clear() (psi4.core.bsvec method)": [[5, "psi4.core.BSVec.clear", false]], "clear() (psi4.core.externalpotential method)": [[73, "psi4.core.ExternalPotential.clear", false]], "clear() (psi4.core.oeprop method)": [[111, "psi4.core.OEProp.clear", false]], "clear_all() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.clear_all", false]], "clear_collocation_cache() (psi4.core.vbase method)": [[147, "psi4.core.VBase.clear_collocation_cache", false]], "clear_d_prev() (psi4.core.compositejk method)": [[18, "psi4.core.CompositeJK.clear_D_prev", false]], "clear_external_cpscf_perturbations() (psi4.core.hf method)": [[84, "psi4.core.HF.clear_external_cpscf_perturbations", false]], "clear_external_potentials() (psi4.core.hf method)": [[84, "psi4.core.HF.clear_external_potentials", false]], "clear_spaces() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.clear_spaces", false]], "clone() (psi4.core.intvector method)": [[88, "psi4.core.IntVector.clone", false]], "clone() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.clone", false]], "clone() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.clone", false]], "clone() (psi4.core.vector method)": [[148, "psi4.core.Vector.clone", false]], "close() (psi4.core.io method)": [[86, "psi4.core.IO.close", false]], "close_io_files() (psi4.core.civector method)": [[12, "psi4.core.CIVector.close_io_files", false]], "close_outfile() (in module psi4.core)": [[172, "psi4.core.close_outfile", false]], "coef (psi4.core.salccomponent attribute)": [[134, "psi4.core.SalcComponent.coef", false]], "coef() (psi4.core.gaussianshell method)": [[81, "psi4.core.GaussianShell.coef", false]], "coldim() (psi4.core.dpdbuf4 method)": [[183, "psi4.core.dpdbuf4.coldim", false]], "coldim() (psi4.core.dpdfile2 method)": [[184, "psi4.core.dpdfile2.coldim", false]], "coldim() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.coldim", false]], "collapse_size (detci)": [[1704, "term-COLLAPSE_SIZE-DETCI", true]], "collapse_with_last (cceom)": [[1704, "term-COLLAPSE_WITH_LAST-CCEOM", true]], "collapse_with_last_cc3 (cceom)": [[1704, "term-COLLAPSE_WITH_LAST_CC3-CCEOM", true]], "collocation": [[1773, "index-0", false]], "collocation_size() (psi4.core.moleculargrid method)": [[105, "psi4.core.MolecularGrid.collocation_size", false]], "colors (psi4.driver.p4util.inpsight attribute)": [[323, "psi4.driver.p4util.InPsight.colors", false]], "cols() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.cols", false]], "com_fixed() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.com_fixed", false]], "comment() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.comment", false]], "compare() (in module psi4)": [[2, "psi4.compare", false]], "compare_cubes() (in module psi4)": [[2, "psi4.compare_cubes", false]], "compare_fchkfiles() (in module psi4)": [[2, "psi4.compare_fchkfiles", false]], "compare_fchkfiles() (in module psi4.driver)": [[285, "psi4.driver.compare_fchkfiles", false]], "compare_fchkfiles() (in module psi4.driver.p4util)": [[336, "psi4.driver.p4util.compare_fchkfiles", false]], "compare_fcidumps() (in module psi4)": [[2, "psi4.compare_fcidumps", false]], "compare_fcidumps() (in module psi4.driver)": [[286, "psi4.driver.compare_fcidumps", false]], "compare_fcidumps() (in module psi4.driver.p4util)": [[337, "psi4.driver.p4util.compare_fcidumps", false]], "compare_integers() (in module psi4)": [[2, "psi4.compare_integers", false]], "compare_matrices() (in module psi4)": [[2, "psi4.compare_matrices", false]], "compare_moldenfiles() (in module psi4)": [[2, "psi4.compare_moldenfiles", false]], "compare_moldenfiles() (in module psi4.driver)": [[287, "psi4.driver.compare_moldenfiles", false]], "compare_moldenfiles() (in module psi4.driver.p4util)": [[338, "psi4.driver.p4util.compare_moldenfiles", false]], "compare_molrecs() (in module psi4)": [[2, "psi4.compare_molrecs", false]], "compare_recursive() (in module psi4)": [[2, "psi4.compare_recursive", false]], "compare_values() (in module psi4)": [[2, "psi4.compare_values", false]], "compare_vectors() (in module psi4)": [[2, "psi4.compare_vectors", false]], "compare_vibinfos() (in module psi4.driver.qcdb.vib)": [[383, "psi4.driver.qcdb.vib.compare_vibinfos", false]], "compare_vibinfos() (in module qcdb)": [[2, "qcdb.compare_vibinfos", false]], "compare_wavefunctions() (in module psi4)": [[2, "psi4.compare_wavefunctions", false]], "compilers": [[1781, "index-1", false]], "compiling": [[1738, "index-0", false]], "complete_basis_set()": [[1740, "index-0", false]], "complex_tolerance (cceom)": [[1704, "term-COMPLEX_TOLERANCE-CCEOM", true]], "compositejk (class in psi4.core)": [[18, "psi4.core.CompositeJK", false]], "comput_s2 (dfocc)": [[1704, "term-COMPUT_S2-DFOCC", true]], "compute() (psi4.core.deriv method)": [[61, "psi4.core.Deriv.compute", false]], "compute() (psi4.core.dfep2wavefunction method)": [[26, "psi4.core.DFEP2Wavefunction.compute", false]], "compute() (psi4.core.jk method)": [[92, "psi4.core.JK.compute", false]], "compute() (psi4.core.oeprop method)": [[111, "psi4.core.OEProp.compute", false]], "compute() (psi4.core.onebodyaoint method)": [[112, "psi4.core.OneBodyAOInt.compute", false]], "compute() (psi4.driver.atomiccomputer method)": [[265, "psi4.driver.AtomicComputer.compute", false]], "compute() (psi4.driver.driver_cbs.compositecomputer method)": [[1740, "psi4.driver.driver_cbs.CompositeComputer.compute", false]], "compute() (psi4.driver.driver_findif.finitedifferencecomputer method)": [[1772, "psi4.driver.driver_findif.FiniteDifferenceComputer.compute", false]], "compute() (psi4.driver.driver_nbody.manybodycomputer method)": [[1794, "psi4.driver.driver_nbody.ManyBodyComputer.compute", false]], "compute() (psi4.driver.task_base.basecomputer method)": [[1768, "psi4.driver.task_base.BaseComputer.compute", false]], "compute_afock() (psi4.core.somcscf method)": [[133, "psi4.core.SOMCSCF.compute_AFock", false]], "compute_density() (psi4.core.cubeproperties method)": [[21, "psi4.core.CubeProperties.compute_density", false]], "compute_df() (psi4.core.deriv method)": [[61, "psi4.core.Deriv.compute_df", false]], "compute_e() (psi4.core.hf method)": [[84, "psi4.core.HF.compute_E", false]], "compute_energy() (psi4.core.dispersion method)": [[68, "psi4.core.Dispersion.compute_energy", false]], "compute_energy() (psi4.core.hf method)": [[84, "psi4.core.HF.compute_energy", false]], "compute_energy() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.compute_energy", false]], "compute_energy() (psi4.driver.empiricaldispersion method)": [[267, "psi4.driver.EmpiricalDispersion.compute_energy", false]], "compute_esp_over_grid_in_memory() (psi4.core.esppropcalc method)": [[70, "psi4.core.ESPPropCalc.compute_esp_over_grid_in_memory", false]], "compute_field_over_grid_in_memory() (psi4.core.esppropcalc method)": [[70, "psi4.core.ESPPropCalc.compute_field_over_grid_in_memory", false]], "compute_fock_like_matrices() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.compute_fock_like_matrices", false]], "compute_functional() (psi4.core.functional method)": [[80, "psi4.core.Functional.compute_functional", false]], "compute_functional() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.compute_functional", false]], "compute_functions() (psi4.core.basisfunctions method)": [[7, "psi4.core.BasisFunctions.compute_functions", false]], "compute_fvpi() (psi4.core.hf method)": [[84, "psi4.core.HF.compute_fvpi", false]], "compute_gradient() (psi4.core.dispersion method)": [[68, "psi4.core.Dispersion.compute_gradient", false]], "compute_gradient() (psi4.core.vbase method)": [[147, "psi4.core.VBase.compute_gradient", false]], "compute_gradient() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.compute_gradient", false]], "compute_gradient() (psi4.driver.empiricaldispersion method)": [[267, "psi4.driver.EmpiricalDispersion.compute_gradient", false]], "compute_guess() (psi4.core.sadguess method)": [[131, "psi4.core.SADGuess.compute_guess", false]], "compute_hessain() (psi4.core.vbase method)": [[147, "psi4.core.VBase.compute_hessain", false]], "compute_hessian() (psi4.core.dispersion method)": [[68, "psi4.core.Dispersion.compute_hessian", false]], "compute_hessian() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.compute_hessian", false]], "compute_hessian() (psi4.driver.empiricaldispersion method)": [[267, "psi4.driver.EmpiricalDispersion.compute_hessian", false]], "compute_hk() (psi4.core.somcscf method)": [[133, "psi4.core.SOMCSCF.compute_Hk", false]], "compute_initial_e() (psi4.core.hf method)": [[84, "psi4.core.HF.compute_initial_E", false]], "compute_list (psi4.driver.driver_cbs.compositecomputer attribute)": [[1740, "psi4.driver.driver_cbs.CompositeComputer.compute_list", false]], "compute_mp4_triples (fnocc)": [[1704, "term-COMPUTE_MP4_TRIPLES-FNOCC", true]], "compute_orbital_gradient() (psi4.core.cuhf method)": [[14, "psi4.core.CUHF.compute_orbital_gradient", false]], "compute_orbital_gradient() (psi4.core.hf method)": [[84, "psi4.core.HF.compute_orbital_gradient", false]], "compute_orbital_gradient() (psi4.core.rhf method)": [[128, "psi4.core.RHF.compute_orbital_gradient", false]], "compute_orbital_gradient() (psi4.core.rohf method)": [[130, "psi4.core.ROHF.compute_orbital_gradient", false]], "compute_orbital_gradient() (psi4.core.uhf method)": [[145, "psi4.core.UHF.compute_orbital_gradient", false]], "compute_orbitals() (psi4.core.cubeproperties method)": [[21, "psi4.core.CubeProperties.compute_orbitals", false]], "compute_phi() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.compute_phi", false]], "compute_points() (psi4.core.pointfunctions method)": [[119, "psi4.core.PointFunctions.compute_points", false]], "compute_products() (psi4.driver.p4util.solverengine method)": [[329, "psi4.driver.p4util.SolverEngine.compute_products", false]], "compute_properties() (psi4.core.cubeproperties method)": [[21, "psi4.core.CubeProperties.compute_properties", false]], "compute_q() (psi4.core.somcscf method)": [[133, "psi4.core.SOMCSCF.compute_Q", false]], "compute_qk() (psi4.core.somcscf method)": [[133, "psi4.core.SOMCSCF.compute_Qk", false]], "compute_shell() (psi4.core.onebodyaoint method)": [[112, "psi4.core.OneBodyAOInt.compute_shell", false]], "compute_shell() (psi4.core.threecenteroverlapint method)": [[141, "psi4.core.ThreeCenterOverlapInt.compute_shell", false]], "compute_shell() (psi4.core.twobodyaoint method)": [[143, "psi4.core.TwoBodyAOInt.compute_shell", false]], "compute_shell() (psi4.core.twoelectronint method)": [[144, "psi4.core.TwoElectronInt.compute_shell", false]], "compute_spin_contamination() (psi4.core.hf method)": [[84, "psi4.core.HF.compute_spin_contamination", false]], "compute_state_transfer() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.compute_state_transfer", false]], "compute_thc_factorization() (psi4.core.ls_thc_computer method)": [[94, "psi4.core.LS_THC_Computer.compute_thc_factorization", false]], "compute_triples (fnocc)": [[1704, "term-COMPUTE_TRIPLES-FNOCC", true]], "compute_v() (psi4.core.vbase method)": [[147, "psi4.core.VBase.compute_V", false]], "compute_vx() (psi4.core.vbase method)": [[147, "psi4.core.VBase.compute_Vx", false]], "computed (psi4.driver.atomiccomputer attribute)": [[265, "psi4.driver.AtomicComputer.computed", false]], "computed_shells_per_iter() (psi4.core.jk method)": [[92, "psi4.core.JK.computed_shells_per_iter", false]], "computeexternexterninteraction() (psi4.core.externalpotential method)": [[73, "psi4.core.ExternalPotential.computeExternExternInteraction", false]], "computenuclearenergy() (psi4.core.externalpotential method)": [[73, "psi4.core.ExternalPotential.computeNuclearEnergy", false]], "computepotentialmatrix() (psi4.core.externalpotential method)": [[73, "psi4.core.ExternalPotential.computePotentialMatrix", false]], "computer (psi4.driver.driver_findif.finitedifferencecomputer attribute)": [[1772, "psi4.driver.driver_findif.FiniteDifferenceComputer.computer", false]], "conda_prefix": [[1738, "index-20", false], [1738, "index-22", false], [1767, "envvar-CONDA_PREFIX", false]], "connectivity() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.connectivity", false]], "consecutive_backsteps (optking)": [[1704, "term-CONSECUTIVE_BACKSTEPS-OPTKING", true]], "constrained": [[1802, "index-2", false]], "construct_from_pydict() (psi4.core.basisset static method)": [[8, "psi4.core.BasisSet.construct_from_pydict", false]], "contact": [[1781, "index-3", false]], "continuum solvation": [[1754, "index-0", false], [1803, "index-0", false]], "converged (psi4.core.localizer attribute)": [[97, "psi4.core.Localizer.converged", false]], "convergence criteria": [[1802, "index-3", false]], "convergenceerror": [[266, "psi4.driver.ConvergenceError", false]], "coord() (psi4.core.gaussianshell method)": [[81, "psi4.core.GaussianShell.coord", false]], "copy() (psi4.core.civector method)": [[12, "psi4.core.CIVector.copy", false]], "copy() (psi4.core.intvector method)": [[88, "psi4.core.IntVector.copy", false]], "copy() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.copy", false]], "copy() (psi4.core.vector method)": [[148, "psi4.core.Vector.copy", false]], "copy_file_from_scratch() (in module psi4.driver)": [[288, "psi4.driver.copy_file_from_scratch", false]], "copy_file_from_scratch() (in module psi4.driver.p4util)": [[339, "psi4.driver.p4util.copy_file_from_scratch", false]], "copy_file_to_scratch() (in module psi4.driver)": [[289, "psi4.driver.copy_file_to_scratch", false]], "copy_file_to_scratch() (in module psi4.driver.p4util)": [[340, "psi4.driver.p4util.copy_file_to_scratch", false]], "copy_lower_to_upper() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.copy_lower_to_upper", false]], "copy_upper_to_lower() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.copy_upper_to_lower", false]], "core_hamiltonian_grad() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.core_hamiltonian_grad", false]], "corl_xtpl_helgaker_2() (in module psi4.driver.driver_cbs_helper)": [[1740, "psi4.driver.driver_cbs_helper.corl_xtpl_helgaker_2", false]], "corr_ansatz (psimrcc)": [[1704, "term-CORR_ANSATZ-PSIMRCC", true]], "corr_ccsd_t (psimrcc)": [[1704, "term-CORR_CCSD_T-PSIMRCC", true]], "corr_charge (psimrcc)": [[1704, "term-CORR_CHARGE-PSIMRCC", true]], "corr_multp (psimrcc)": [[1704, "term-CORR_MULTP-PSIMRCC", true]], "corr_wfn (psimrcc)": [[1704, "term-CORR_WFN-PSIMRCC", true]], "correlated (psi4.core.derivcalctype attribute)": [[62, "psi4.core.DerivCalcType.Correlated", false]], "correlationfactor (class in psi4.core)": [[19, "psi4.core.CorrelationFactor", false]], "correlationtable (class in psi4.core)": [[20, "psi4.core.CorrelationTable", false]], "cosmo": [[1754, "index-0", false]], "cosx_basis_tolerance (scf)": [[1704, "term-COSX_BASIS_TOLERANCE-SCF", true]], "cosx_density_tolerance (scf)": [[1704, "term-COSX_DENSITY_TOLERANCE-SCF", true]], "cosx_ints_tolerance (scf)": [[1704, "term-COSX_INTS_TOLERANCE-SCF", true]], "cosx_maxiter_final (scf)": [[1704, "term-COSX_MAXITER_FINAL-SCF", true]], "cosx_overlap_fitting (scf)": [[1704, "term-COSX_OVERLAP_FITTING-SCF", true]], "cosx_pruning_scheme (scf)": [[1704, "term-COSX_PRUNING_SCHEME-SCF", true]], "cosx_radial_points_final (scf)": [[1704, "term-COSX_RADIAL_POINTS_FINAL-SCF", true]], "cosx_radial_points_initial (scf)": [[1704, "term-COSX_RADIAL_POINTS_INITIAL-SCF", true]], "cosx_spherical_points_final (scf)": [[1704, "term-COSX_SPHERICAL_POINTS_FINAL-SCF", true]], "cosx_spherical_points_initial (scf)": [[1704, "term-COSX_SPHERICAL_POINTS_INITIAL-SCF", true]], "cotton-ordering": [[1833, "index-6", false]], "coulomb() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.coulomb", false]], "count() (psi4.core.bsvec method)": [[5, "psi4.core.BSVec.count", false]], "counterpoise correction": [[1794, "index-1", false]], "coupled_induction (sapt)": [[1704, "term-COUPLED_INDUCTION-SAPT", true]], "coupling (psimrcc)": [[1704, "term-COUPLING-PSIMRCC", true]], "coupling_terms (psimrcc)": [[1704, "term-COUPLING_TERMS-PSIMRCC", true]], "covalent_connect (optking)": [[1704, "term-COVALENT_CONNECT-OPTKING", true]], "cp": [[1794, "index-1", false]], "cp (psi4.driver.driver_nbody.bsseenum attribute)": [[1794, "psi4.driver.driver_nbody.BsseEnum.cp", false]], "cp-corrected 2-body interaction energy": [[1776, "psivar-CP-CORRECTED-2-BODY-INTERACTION-ENERGY", false]], "cphf_converged() (psi4.core.hf method)": [[84, "psi4.core.HF.cphf_converged", false]], "cphf_hx() (psi4.core.hf method)": [[84, "psi4.core.HF.cphf_Hx", false]], "cphf_mem_safety_factor (cphf)": [[1704, "term-CPHF_MEM_SAFETY_FACTOR-CPHF", true]], "cphf_r_convergence (fisapt)": [[1704, "term-CPHF_R_CONVERGENCE-FISAPT", true]], "cphf_r_convergence (sapt)": [[1704, "term-CPHF_R_CONVERGENCE-SAPT", true]], "cphf_solve() (psi4.core.hf method)": [[84, "psi4.core.HF.cphf_solve", false]], "cphf_tasks (cphf)": [[1704, "term-CPHF_TASKS-CPHF", true]], "cppe": [[1749, "index-0", false]], "crashclean() (psi4.core.iomanager method)": [[87, "psi4.core.IOManager.crashclean", false]], "cray_add_rpath": [[1738, "envvar-CRAY_ADD_RPATH", false]], "craype_link_type": [[1738, "envvar-CRAYPE_LINK_TYPE", false]], "create_matrices() (psi4.core.cdsalclist method)": [[16, "psi4.core.CdSalcList.create_matrices", false]], "create_matrices() (psi4.core.multipolesymmetry method)": [[108, "psi4.core.MultipoleSymmetry.create_matrices", false]], "create_matrix() (psi4.core.matrixfactory method)": [[101, "psi4.core.MatrixFactory.create_matrix", false]], "create_plugin() (in module psi4.driver)": [[290, "psi4.driver.create_plugin", false]], "create_psi4_string_from_molecule() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.create_psi4_string_from_molecule", false]], "cross() (psi4.core.vector3 method)": [[149, "psi4.core.Vector3.cross", false]], "ct() (psi4.core.rohf method)": [[130, "psi4.core.ROHF.Ct", false]], "cube": [[1750, "index-0", false]], "cubeprop": [[1750, "index-0", false]], "cubeprop() (in module psi4.driver)": [[291, "psi4.driver.cubeprop", false]], "cubeprop() (in module psi4.driver.p4util)": [[341, "psi4.driver.p4util.cubeprop", false]], "cubeprop_basis_functions (globals)": [[1704, "term-CUBEPROP_BASIS_FUNCTIONS-GLOBALS", true]], "cubeprop_filepath (globals)": [[1704, "term-CUBEPROP_FILEPATH-GLOBALS", true]], "cubeprop_isocontour_threshold (globals)": [[1704, "term-CUBEPROP_ISOCONTOUR_THRESHOLD-GLOBALS", true]], "cubeprop_orbitals (globals)": [[1704, "term-CUBEPROP_ORBITALS-GLOBALS", true]], "cubeprop_tasks (globals)": [[1704, "term-CUBEPROP_TASKS-GLOBALS", true]], "cubeproperties (class in psi4.core)": [[21, "psi4.core.CubeProperties", false]], "cubic_basis_tolerance (fisapt)": [[1704, "term-CUBIC_BASIS_TOLERANCE-FISAPT", true]], "cubic_basis_tolerance (globals)": [[1704, "term-CUBIC_BASIS_TOLERANCE-GLOBALS", true]], "cubic_block_max_points (fisapt)": [[1704, "term-CUBIC_BLOCK_MAX_POINTS-FISAPT", true]], "cubic_block_max_points (globals)": [[1704, "term-CUBIC_BLOCK_MAX_POINTS-GLOBALS", true]], "cubic_grid_overage (fisapt)": [[1704, "term-CUBIC_GRID_OVERAGE-FISAPT", true]], "cubic_grid_overage (globals)": [[1704, "term-CUBIC_GRID_OVERAGE-GLOBALS", true]], "cubic_grid_spacing (fisapt)": [[1704, "term-CUBIC_GRID_SPACING-FISAPT", true]], "cubic_grid_spacing (globals)": [[1704, "term-CUBIC_GRID_SPACING-GLOBALS", true]], "cuhf (class in psi4.core)": [[14, "psi4.core.CUHF", false]], "current correlation energy": [[1776, "psivar-CURRENT-CORRELATION-ENERGY", false]], "current dipole": [[1776, "psivar-CURRENT-DIPOLE", false]], "current dipole gradient": [[1776, "psivar-CURRENT-DIPOLE-GRADIENT", false]], "current energy": [[1776, "psivar-CURRENT-ENERGY", false]], "current gradient": [[1776, "psivar-CURRENT-GRADIENT", false]], "current hessian": [[1776, "psivar-CURRENT-HESSIAN", false]], "current reference energy": [[1776, "psivar-CURRENT-REFERENCE-ENERGY", false]], "current_afock() (psi4.core.somcscf method)": [[133, "psi4.core.SOMCSCF.current_AFock", false]], "current_ci_energy() (psi4.core.somcscf method)": [[133, "psi4.core.SOMCSCF.current_ci_energy", false]], "current_docc_energy() (psi4.core.somcscf method)": [[133, "psi4.core.SOMCSCF.current_docc_energy", false]], "current_ifock() (psi4.core.somcscf method)": [[133, "psi4.core.SOMCSCF.current_IFock", false]], "current_total_energy() (psi4.core.somcscf method)": [[133, "psi4.core.SOMCSCF.current_total_energy", false]], "custom scs-lccd correlation energy": [[1776, "psivar-CUSTOM-SCS-LCCD-CORRELATION-ENERGY", false]], "custom scs-lccd total energy": [[1776, "psivar-CUSTOM-SCS-LCCD-TOTAL-ENERGY", false]], "custom scs-mp2 correlation energy": [[1776, "psivar-CUSTOM-SCS-MP2-CORRELATION-ENERGY", false]], "custom scs-mp2 total energy": [[1776, "psivar-CUSTOM-SCS-MP2-TOTAL-ENERGY", false]], "custom scs-mp2.5 correlation energy": [[1776, "psivar-CUSTOM-SCS-MP2.5-CORRELATION-ENERGY", false]], "custom scs-mp2.5 total energy": [[1776, "psivar-CUSTOM-SCS-MP2.5-TOTAL-ENERGY", false]], "custom scs-mp3 correlation energy": [[1776, "psivar-CUSTOM-SCS-MP3-CORRELATION-ENERGY", false]], "custom scs-mp3 total energy": [[1776, "psivar-CUSTOM-SCS-MP3-TOTAL-ENERGY", false]], "custom scs-olccd correlation energy": [[1776, "psivar-CUSTOM-SCS-OLCCD-CORRELATION-ENERGY", false]], "custom scs-olccd total energy": [[1776, "psivar-CUSTOM-SCS-OLCCD-TOTAL-ENERGY", false]], "custom scs-omp2 correlation energy": [[1776, "psivar-CUSTOM-SCS-OMP2-CORRELATION-ENERGY", false]], "custom scs-omp2 total energy": [[1776, "psivar-CUSTOM-SCS-OMP2-TOTAL-ENERGY", false]], "custom scs-omp2.5 correlation energy": [[1776, "psivar-CUSTOM-SCS-OMP2.5-CORRELATION-ENERGY", false]], "custom scs-omp2.5 total energy": [[1776, "psivar-CUSTOM-SCS-OMP2.5-TOTAL-ENERGY", false]], "custom scs-omp3 correlation energy": [[1776, "psivar-CUSTOM-SCS-OMP3-CORRELATION-ENERGY", false]], "custom scs-omp3 total energy": [[1776, "psivar-CUSTOM-SCS-OMP3-TOTAL-ENERGY", false]], "custom scs-oremp2 correlation energy": [[1776, "psivar-CUSTOM-SCS-OREMP2-CORRELATION-ENERGY", false]], "custom scs-oremp2 total energy": [[1776, "psivar-CUSTOM-SCS-OREMP2-TOTAL-ENERGY", false]], "custom scs-remp2 correlation energy": [[1776, "psivar-CUSTOM-SCS-REMP2-CORRELATION-ENERGY", false]], "custom scs-remp2 total energy": [[1776, "psivar-CUSTOM-SCS-REMP2-TOTAL-ENERGY", false]], "custom_coords (optking)": [[1704, "term-CUSTOM_COORDS-OPTKING", true]], "cutoff (dfocc)": [[1704, "term-CUTOFF-DFOCC", true]], "cutoff (occ)": [[1704, "term-CUTOFF-OCC", true]], "cutoff_amps_print (adc)": [[1704, "term-CUTOFF_AMPS_PRINT-ADC", true]], "d() (psi4.core.dispersion method)": [[68, "psi4.core.Dispersion.d", false]], "d() (psi4.core.jk method)": [[92, "psi4.core.JK.D", false]], "d_conv (psi4.driver.scfconvergenceerror attribute)": [[276, "psi4.driver.SCFConvergenceError.d_conv", false]], "d_convergence (mcscf)": [[1704, "term-D_CONVERGENCE-MCSCF", true]], "d_convergence (scf)": [[1704, "term-D_CONVERGENCE-SCF", true]], "d_vector() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.D_vector", false]], "da() (psi4.core.sadguess method)": [[131, "psi4.core.SADGuess.Da", false]], "da() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.Da", false]], "da_subset() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.Da_subset", false]], "damp_induced (pe)": [[1704, "term-DAMP_INDUCED-PE", true]], "damp_multipole (pe)": [[1704, "term-DAMP_MULTIPOLE-PE", true]], "damping": [[1838, "index-2", false]], "damping_convergence (scf)": [[1704, "term-DAMPING_CONVERGENCE-SCF", true]], "damping_factor_induced (pe)": [[1704, "term-DAMPING_FACTOR_INDUCED-PE", true]], "damping_factor_multipole (pe)": [[1704, "term-DAMPING_FACTOR_MULTIPOLE-PE", true]], "damping_percentage (dct)": [[1704, "term-DAMPING_PERCENTAGE-DCT", true]], "damping_percentage (psimrcc)": [[1704, "term-DAMPING_PERCENTAGE-PSIMRCC", true]], "damping_percentage (scf)": [[1704, "term-DAMPING_PERCENTAGE-SCF", true]], "damping_update() (psi4.core.hf method)": [[84, "psi4.core.HF.damping_update", false]], "dao() (psi4.core.vbase method)": [[147, "psi4.core.VBase.Dao", false]], "dashcoeff_supplement (psi4.driver.empiricaldispersion attribute)": [[267, "psi4.driver.EmpiricalDispersion.dashcoeff_supplement", false]], "dashcoeff_supplement (psi4.driver.procrouting.empirical_dispersion.empiricaldispersion attribute)": [[1759, "psi4.driver.procrouting.empirical_dispersion.EmpiricalDispersion.dashcoeff_supplement", false]], "dashlevel (psi4.driver.empiricaldispersion attribute)": [[267, "psi4.driver.EmpiricalDispersion.dashlevel", false]], "dashlevel (psi4.driver.procrouting.empirical_dispersion.empiricaldispersion attribute)": [[1759, "psi4.driver.procrouting.empirical_dispersion.EmpiricalDispersion.dashlevel", false]], "dashlevel_citation (psi4.driver.empiricaldispersion attribute)": [[267, "psi4.driver.EmpiricalDispersion.dashlevel_citation", false]], "dashlevel_citation (psi4.driver.procrouting.empirical_dispersion.empiricaldispersion attribute)": [[1759, "psi4.driver.procrouting.empirical_dispersion.EmpiricalDispersion.dashlevel_citation", false]], "dashparams (psi4.driver.empiricaldispersion attribute)": [[267, "psi4.driver.EmpiricalDispersion.dashparams", false]], "dashparams (psi4.driver.procrouting.empirical_dispersion.empiricaldispersion attribute)": [[1759, "psi4.driver.procrouting.empirical_dispersion.EmpiricalDispersion.dashparams", false]], "dashparams_citation (psi4.driver.empiricaldispersion attribute)": [[267, "psi4.driver.EmpiricalDispersion.dashparams_citation", false]], "dashparams_citation (psi4.driver.procrouting.empirical_dispersion.empiricaldispersion attribute)": [[1759, "psi4.driver.procrouting.empirical_dispersion.EmpiricalDispersion.dashparams_citation", false]], "dasum() (in module psi4.core)": [[22, "psi4.core.DASUM", false]], "database()": [[1752, "index-0", false], [1752, "index-3", false], [1752, "index-4", false], [1835, "index-0", false]], "database() (in module psi4.driver.wrapper_database)": [[1752, "psi4.driver.wrapper_database.database", false]], "davidson_solver() (in module psi4.driver.p4util)": [[342, "psi4.driver.p4util.davidson_solver", false]], "daxpy() (in module psi4.core)": [[23, "psi4.core.DAXPY", false]], "db()": [[1752, "index-0", false]], "db() (psi4.core.sadguess method)": [[131, "psi4.core.SADGuess.Db", false]], "db() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.Db", false]], "db_name database mean absolute deviation": [[1776, "psivar-db_name-DATABASE-MEAN-ABSOLUTE-DEVIATION", false]], "db_name database mean signed deviation": [[1776, "psivar-db_name-DATABASE-MEAN-SIGNED-DEVIATION", false]], "db_name database root-mean-square deviation": [[1776, "psivar-db_name-DATABASE-ROOT-MEAN-SQUARE-DEVIATION", false]], "db_subset() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.Db_subset", false]], "dcalc() (psi4.core.civector method)": [[12, "psi4.core.CIVector.dcalc", false]], "dcopy() (in module psi4.core)": [[24, "psi4.core.DCOPY", false]], "dct": [[1753, "index-0", false]], "dct lambda energy": [[1776, "psivar-DCT-LAMBDA-ENERGY", false]], "dct scf energy": [[1776, "psivar-DCT-SCF-ENERGY", false]], "dct three-particle energy": [[1776, "psivar-DCT-THREE-PARTICLE-ENERGY", false]], "dct total energy": [[1776, "psivar-DCT-TOTAL-ENERGY", false]], "dct() (in module psi4.core)": [[173, "psi4.core.dct", false]], "dct_functional (dct)": [[1704, "term-DCT_FUNCTIONAL-DCT", true]], "dct_guess (dct)": [[1704, "term-DCT_GUESS-DCT", true]], "dct_type (dct)": [[1704, "term-DCT_TYPE-DCT", true]], "dd solvation energy": [[1776, "psivar-DD-SOLVATION-ENERGY", false]], "dd_density_integral() (psi4.core.numinthelper method)": [[110, "psi4.core.NumIntHelper.dd_density_integral", false]], "ddot() (in module psi4.core)": [[25, "psi4.core.DDOT", false]], "ddx": [[1754, "index-0", false]], "ddx (globals)": [[1704, "term-DDX-GLOBALS", true]], "ddx_diis_max_vecs (ddx)": [[1704, "term-DDX_DIIS_MAX_VECS-DDX", true]], "ddx_eta (ddx)": [[1704, "term-DDX_ETA-DDX", true]], "ddx_fmm (ddx)": [[1704, "term-DDX_FMM-DDX", true]], "ddx_fmm_local_lmax (ddx)": [[1704, "term-DDX_FMM_LOCAL_LMAX-DDX", true]], "ddx_fmm_multipole_lmax (ddx)": [[1704, "term-DDX_FMM_MULTIPOLE_LMAX-DDX", true]], "ddx_incore (ddx)": [[1704, "term-DDX_INCORE-DDX", true]], "ddx_lmax (ddx)": [[1704, "term-DDX_LMAX-DDX", true]], "ddx_logfile (ddx)": [[1704, "term-DDX_LOGFILE-DDX", true]], "ddx_maxiter (ddx)": [[1704, "term-DDX_MAXITER-DDX", true]], "ddx_model (ddx)": [[1704, "term-DDX_MODEL-DDX", true]], "ddx_n_lebedev (ddx)": [[1704, "term-DDX_N_LEBEDEV-DDX", true]], "ddx_radii (ddx)": [[1704, "term-DDX_RADII-DDX", true]], "ddx_radii_scaling (ddx)": [[1704, "term-DDX_RADII_SCALING-DDX", true]], "ddx_radii_set (ddx)": [[1704, "term-DDX_RADII_SET-DDX", true]], "ddx_shift (ddx)": [[1704, "term-DDX_SHIFT-DDX", true]], "ddx_solute_radial_points (ddx)": [[1704, "term-DDX_SOLUTE_RADIAL_POINTS-DDX", true]], "ddx_solute_spherical_points (ddx)": [[1704, "term-DDX_SOLUTE_SPHERICAL_POINTS-DDX", true]], "ddx_solvation_convergence (ddx)": [[1704, "term-DDX_SOLVATION_CONVERGENCE-DDX", true]], "ddx_solvent (ddx)": [[1704, "term-DDX_SOLVENT-DDX", true]], "ddx_solvent_epsilon (ddx)": [[1704, "term-DDX_SOLVENT_EPSILON-DDX", true]], "ddx_solvent_epsilon_optical (ddx)": [[1704, "term-DDX_SOLVENT_EPSILON_OPTICAL-DDX", true]], "ddx_solvent_kappa (ddx)": [[1704, "term-DDX_SOLVENT_KAPPA-DDX", true]], "deactivate_all_fragments() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.deactivate_all_fragments", false]], "debug (ccdensity)": [[1704, "term-DEBUG-CCDENSITY", true]], "debug (cphf)": [[1704, "term-DEBUG-CPHF", true]], "debug (globals)": [[1704, "term-DEBUG-GLOBALS", true]], "deep_copy() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.deep_copy", false]], "default (psi4.core.derivcalctype attribute)": [[62, "psi4.core.DerivCalcType.Default", false]], "default auxiliary": [[1732, "index-0", false]], "defines (psi4.driver.p4util.inpsight attribute)": [[323, "psi4.driver.p4util.InPsight.defines", false]], "degen() (psi4.core.correlationtable method)": [[20, "psi4.core.CorrelationTable.degen", false]], "del_array_variable() (in module psi4.core)": [[174, "psi4.core.del_array_variable", false]], "del_array_variable() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.del_array_variable", false]], "del_potential_variable() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.del_potential_variable", false]], "del_scalar_variable() (in module psi4.core)": [[175, "psi4.core.del_scalar_variable", false]], "del_scalar_variable() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.del_scalar_variable", false]], "del_variable() (in module psi4.core)": [[176, "psi4.core.del_variable", false]], "del_variable() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.del_variable", false]], "delete_tei (cctransort)": [[1704, "term-DELETE_TEI-CCTRANSORT", true]], "delta correction": [[1740, "index-0", false]], "delta() (psi4.core.basisextents method)": [[6, "psi4.core.BasisExtents.delta", false]], "denominator_algorithm (sapt)": [[1704, "term-DENOMINATOR_ALGORITHM-SAPT", true]], "denominator_delta (sapt)": [[1704, "term-DENOMINATOR_DELTA-SAPT", true]], "denominator_occ() (psi4.core.laplacedenominator method)": [[95, "psi4.core.LaplaceDenominator.denominator_occ", false]], "denominator_occ() (psi4.core.tlaplacedenominator method)": [[140, "psi4.core.TLaplaceDenominator.denominator_occ", false]], "denominator_vir() (psi4.core.laplacedenominator method)": [[95, "psi4.core.LaplaceDenominator.denominator_vir", false]], "denominator_vir() (psi4.core.tlaplacedenominator method)": [[140, "psi4.core.TLaplaceDenominator.denominator_vir", false]], "density-fitting": [[1756, "index-0", false], [1771, "index-1", false]], "density_cutoff() (psi4.core.functional method)": [[80, "psi4.core.Functional.density_cutoff", false]], "density_cutoff() (psi4.core.libxcfunctional method)": [[96, "psi4.core.LibXCFunctional.density_cutoff", false]], "density_integral() (psi4.core.numinthelper method)": [[110, "psi4.core.NumIntHelper.density_integral", false]], "density_tolerance() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.density_tolerance", false]], "deriv (class in psi4.core)": [[61, "psi4.core.Deriv", false]], "deriv() (psi4.core.basisfunctions method)": [[7, "psi4.core.BasisFunctions.deriv", false]], "deriv() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.deriv", false]], "derivcalctype (class in psi4.core)": [[62, "psi4.core.DerivCalcType", false]], "dertype (efp)": [[1704, "term-DERTYPE-EFP", true]], "dertype (globals)": [[1704, "term-DERTYPE-GLOBALS", true]], "descending (psi4.core.diagonalizeorder attribute)": [[63, "psi4.core.DiagonalizeOrder.Descending", false]], "description (psi4.driver.empiricaldispersion attribute)": [[267, "psi4.driver.EmpiricalDispersion.description", false]], "description (psi4.driver.procrouting.empirical_dispersion.empiricaldispersion attribute)": [[1759, "psi4.driver.procrouting.empirical_dispersion.EmpiricalDispersion.description", false]], "description() (psi4.core.dispersion method)": [[68, "psi4.core.Dispersion.description", false]], "description() (psi4.core.functional method)": [[80, "psi4.core.Functional.description", false]], "description() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.description", false]], "detci avg dvec norm": [[1776, "psivar-DETCI-AVG-DVEC-NORM", false]], "detci() (in module psi4.core)": [[177, "psi4.core.detci", false]], "detci_freeze_core (detci)": [[1704, "term-DETCI_FREEZE_CORE-DETCI", true]], "df-ccsd(t)": [[1771, "index-1", false]], "df-mp2": [[1756, "index-0", false], [1756, "index-1", false]], "df_basis_cc (fnocc)": [[1704, "term-DF_BASIS_CC-FNOCC", true]], "df_basis_cc (globals)": [[1704, "term-DF_BASIS_CC-GLOBALS", true]], "df_basis_dct (dct)": [[1704, "term-DF_BASIS_DCT-DCT", true]], "df_basis_elst (sapt)": [[1704, "term-DF_BASIS_ELST-SAPT", true]], "df_basis_ep2 (dfep2)": [[1704, "term-DF_BASIS_EP2-DFEP2", true]], "df_basis_guess (scf)": [[1704, "term-DF_BASIS_GUESS-SCF", true]], "df_basis_mcscf (detci)": [[1704, "term-DF_BASIS_MCSCF-DETCI", true]], "df_basis_mp2 (dfmp2)": [[1704, "term-DF_BASIS_MP2-DFMP2", true]], "df_basis_mp2 (dlpno)": [[1704, "term-DF_BASIS_MP2-DLPNO", true]], "df_basis_sad (scf)": [[1704, "term-DF_BASIS_SAD-SCF", true]], "df_basis_sapt (sapt)": [[1704, "term-DF_BASIS_SAPT-SAPT", true]], "df_basis_scf (cphf)": [[1704, "term-DF_BASIS_SCF-CPHF", true]], "df_basis_scf (scf)": [[1704, "term-DF_BASIS_SCF-SCF", true]], "df_bump_r0 (scf)": [[1704, "term-DF_BUMP_R0-SCF", true]], "df_bump_r1 (scf)": [[1704, "term-DF_BUMP_R1-SCF", true]], "df_domains (scf)": [[1704, "term-DF_DOMAINS-SCF", true]], "df_fitting_condition (scf)": [[1704, "term-DF_FITTING_CONDITION-SCF", true]], "df_ints_io (dfmp2)": [[1704, "term-DF_INTS_IO-DFMP2", true]], "df_ints_io (scf)": [[1704, "term-DF_INTS_IO-SCF", true]], "df_ints_num_threads (dfmp2)": [[1704, "term-DF_INTS_NUM_THREADS-DFMP2", true]], "df_ints_num_threads (scf)": [[1704, "term-DF_INTS_NUM_THREADS-SCF", true]], "df_metric (scf)": [[1704, "term-DF_METRIC-SCF", true]], "df_scf_guess (scf)": [[1704, "term-DF_SCF_GUESS-SCF", true]], "df_theta (scf)": [[1704, "term-DF_THETA-SCF", true]], "dfcc (fnocc)": [[1704, "term-DFCC-FNOCC", true]], "dfep2wavefunction (class in psi4.core)": [[26, "psi4.core.DFEP2Wavefunction", false]], "dfh() (psi4.core.memdfjk method)": [[102, "psi4.core.MemDFJK.dfh", false]], "dfhelper (class in psi4.core)": [[27, "psi4.core.DFHelper", false]], "dfmp2() (in module psi4.core)": [[178, "psi4.core.dfmp2", false]], "dfmp2_mem_factor (dfmp2)": [[1704, "term-DFMP2_MEM_FACTOR-DFMP2", true]], "dfmp2_p2_tolerance (dfmp2)": [[1704, "term-DFMP2_P2_TOLERANCE-DFMP2", true]], "dfmp2_p_tolerance (dfmp2)": [[1704, "term-DFMP2_P_TOLERANCE-DFMP2", true]], "dfocc() (in module psi4.core)": [[179, "psi4.core.dfocc", false]], "dfsomcscf (class in psi4.core)": [[28, "psi4.core.DFSOMCSCF", false]], "dft": [[1757, "index-0", false], [1758, "index-0", false], [1784, "index-0", false]], "dft dipole gradient": [[1776, "psivar-DFT-DIPOLE-GRADIENT", false]], "dft functional total energy": [[1776, "psivar-DFT-FUNCTIONAL-TOTAL-ENERGY", false]], "dft total energy": [[1776, "psivar-DFT-TOTAL-ENERGY", false]], "dft total gradient": [[1776, "psivar-DFT-TOTAL-GRADIENT", false]], "dft total hessian": [[1776, "psivar-DFT-TOTAL-HESSIAN", false]], "dft vv10 energy": [[1776, "psivar-DFT-VV10-ENERGY", false]], "dft xc energy": [[1776, "psivar-DFT-XC-ENERGY", false]], "dft_alpha (scf)": [[1704, "term-DFT_ALPHA-SCF", true]], "dft_alpha_c (scf)": [[1704, "term-DFT_ALPHA_C-SCF", true]], "dft_basis_tolerance (scf)": [[1704, "term-DFT_BASIS_TOLERANCE-SCF", true]], "dft_block_max_points (scf)": [[1704, "term-DFT_BLOCK_MAX_POINTS-SCF", true]], "dft_block_max_radius (scf)": [[1704, "term-DFT_BLOCK_MAX_RADIUS-SCF", true]], "dft_block_min_points (scf)": [[1704, "term-DFT_BLOCK_MIN_POINTS-SCF", true]], "dft_block_scheme (scf)": [[1704, "term-DFT_BLOCK_SCHEME-SCF", true]], "dft_bs_radius_alpha (scf)": [[1704, "term-DFT_BS_RADIUS_ALPHA-SCF", true]], "dft_density_tolerance (scf)": [[1704, "term-DFT_DENSITY_TOLERANCE-SCF", true]], "dft_dispersion_parameters (scf)": [[1704, "term-DFT_DISPERSION_PARAMETERS-SCF", true]], "dft_grac_alpha (scf)": [[1704, "term-DFT_GRAC_ALPHA-SCF", true]], "dft_grac_beta (scf)": [[1704, "term-DFT_GRAC_BETA-SCF", true]], "dft_grac_c_func (scf)": [[1704, "term-DFT_GRAC_C_FUNC-SCF", true]], "dft_grac_shift (scf)": [[1704, "term-DFT_GRAC_SHIFT-SCF", true]], "dft_grac_x_func (scf)": [[1704, "term-DFT_GRAC_X_FUNC-SCF", true]], "dft_grid_name (scf)": [[1704, "term-DFT_GRID_NAME-SCF", true]], "dft_nuclear_scheme (scf)": [[1704, "term-DFT_NUCLEAR_SCHEME-SCF", true]], "dft_omega (scf)": [[1704, "term-DFT_OMEGA-SCF", true]], "dft_omega_c (scf)": [[1704, "term-DFT_OMEGA_C-SCF", true]], "dft_pruning_alpha (scf)": [[1704, "term-DFT_PRUNING_ALPHA-SCF", true]], "dft_pruning_scheme (scf)": [[1704, "term-DFT_PRUNING_SCHEME-SCF", true]], "dft_radial_points (scf)": [[1704, "term-DFT_RADIAL_POINTS-SCF", true]], "dft_radial_scheme (scf)": [[1704, "term-DFT_RADIAL_SCHEME-SCF", true]], "dft_remove_distant_points (scf)": [[1704, "term-DFT_REMOVE_DISTANT_POINTS-SCF", true]], "dft_spherical_points (scf)": [[1704, "term-DFT_SPHERICAL_POINTS-SCF", true]], "dft_spherical_scheme (scf)": [[1704, "term-DFT_SPHERICAL_SCHEME-SCF", true]], "dft_v2_rho_cutoff (scf)": [[1704, "term-DFT_V2_RHO_CUTOFF-SCF", true]], "dft_vv10_b (scf)": [[1704, "term-DFT_VV10_B-SCF", true]], "dft_vv10_c (scf)": [[1704, "term-DFT_VV10_C-SCF", true]], "dft_vv10_postscf (scf)": [[1704, "term-DFT_VV10_POSTSCF-SCF", true]], "dft_vv10_radial_points (scf)": [[1704, "term-DFT_VV10_RADIAL_POINTS-SCF", true]], "dft_vv10_rho_cutoff (scf)": [[1704, "term-DFT_VV10_RHO_CUTOFF-SCF", true]], "dft_vv10_spherical_points (scf)": [[1704, "term-DFT_VV10_SPHERICAL_POINTS-SCF", true]], "dft_weights_tolerance (scf)": [[1704, "term-DFT_WEIGHTS_TOLERANCE-SCF", true]], "dftd3": [[1759, "index-0", false]], "dftd4": [[1759, "index-0", false]], "dftensor (class in psi4.core)": [[30, "psi4.core.DFTensor", false]], "dftgrid (class in psi4.core)": [[29, "psi4.core.DFTGrid", false]], "dftnl": [[1760, "index-0", false]], "dgbmv() (in module psi4.core)": [[31, "psi4.core.DGBMV", false]], "dgeev() (in module psi4.core)": [[32, "psi4.core.DGEEV", false]], "dgemm() (in module psi4.core)": [[33, "psi4.core.DGEMM", false]], "dgemv() (in module psi4.core)": [[34, "psi4.core.DGEMV", false]], "dger() (in module psi4.core)": [[35, "psi4.core.DGER", false]], "dgetrf() (in module psi4.core)": [[36, "psi4.core.DGETRF", false]], "dgetri() (in module psi4.core)": [[37, "psi4.core.DGETRI", false]], "dgetrs() (in module psi4.core)": [[38, "psi4.core.DGETRS", false]], "dhf() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.dHF", false]], "diag_h() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.diag_h", false]], "diag_method (detci)": [[1704, "term-DIAG_METHOD-DETCI", true]], "diagonal_ccsd_t (psimrcc)": [[1704, "term-DIAGONAL_CCSD_T-PSIMRCC", true]], "diagonalize() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.diagonalize", false]], "diagonalize_heff (psimrcc)": [[1704, "term-DIAGONALIZE_HEFF-PSIMRCC", true]], "diagonalizeorder (class in psi4.core)": [[63, "psi4.core.DiagonalizeOrder", false]], "die_if_not_converged (globals)": [[1704, "term-DIE_IF_NOT_CONVERGED-GLOBALS", true]], "diis": [[1838, "index-2", false]], "diis (ccenergy)": [[1704, "term-DIIS-CCENERGY", true]], "diis (cclambda)": [[1704, "term-DIIS-CCLAMBDA", true]], "diis (ccresponse)": [[1704, "term-DIIS-CCRESPONSE", true]], "diis (class in psi4.driver.p4util)": [[321, "psi4.driver.p4util.DIIS", false]], "diis (detci)": [[1704, "term-DIIS-DETCI", true]], "diis (mcscf)": [[1704, "term-DIIS-MCSCF", true]], "diis (scf)": [[1704, "term-DIIS-SCF", true]], "diis() (psi4.core.cuhf method)": [[14, "psi4.core.CUHF.diis", false]], "diis() (psi4.core.hf method)": [[84, "psi4.core.HF.diis", false]], "diis() (psi4.core.rhf method)": [[128, "psi4.core.RHF.diis", false]], "diis() (psi4.core.rohf method)": [[130, "psi4.core.ROHF.diis", false]], "diis() (psi4.core.uhf method)": [[145, "psi4.core.UHF.diis", false]], "diis_enabled_ (psi4.core.hf attribute)": [[84, "psi4.core.HF.diis_enabled_", false]], "diis_freq (detci)": [[1704, "term-DIIS_FREQ-DETCI", true]], "diis_manager_ (psi4.core.hf attribute)": [[84, "psi4.core.HF.diis_manager_", false]], "diis_max_vecs (dct)": [[1704, "term-DIIS_MAX_VECS-DCT", true]], "diis_max_vecs (detci)": [[1704, "term-DIIS_MAX_VECS-DETCI", true]], "diis_max_vecs (fnocc)": [[1704, "term-DIIS_MAX_VECS-FNOCC", true]], "diis_max_vecs (mcscf)": [[1704, "term-DIIS_MAX_VECS-MCSCF", true]], "diis_max_vecs (occ)": [[1704, "term-DIIS_MAX_VECS-OCC", true]], "diis_max_vecs (psimrcc)": [[1704, "term-DIIS_MAX_VECS-PSIMRCC", true]], "diis_max_vecs (scf)": [[1704, "term-DIIS_MAX_VECS-SCF", true]], "diis_min_vecs (dct)": [[1704, "term-DIIS_MIN_VECS-DCT", true]], "diis_min_vecs (detci)": [[1704, "term-DIIS_MIN_VECS-DETCI", true]], "diis_min_vecs (occ)": [[1704, "term-DIIS_MIN_VECS-OCC", true]], "diis_min_vecs (scf)": [[1704, "term-DIIS_MIN_VECS-SCF", true]], "diis_rms_error (scf)": [[1704, "term-DIIS_RMS_ERROR-SCF", true]], "diis_start (psimrcc)": [[1704, "term-DIIS_START-PSIMRCC", true]], "diis_start (scf)": [[1704, "term-DIIS_START-SCF", true]], "diis_start_ (psi4.core.hf attribute)": [[84, "psi4.core.HF.diis_start_", false]], "diis_start_convergence (dct)": [[1704, "term-DIIS_START_CONVERGENCE-DCT", true]], "diis_start_iter (detci)": [[1704, "term-DIIS_START_ITER-DETCI", true]], "dim() (psi4.core.intvector method)": [[88, "psi4.core.IntVector.dim", false]], "dim() (psi4.core.orbitalspace method)": [[115, "psi4.core.OrbitalSpace.dim", false]], "dim() (psi4.core.vector method)": [[148, "psi4.core.Vector.dim", false]], "dimension (class in psi4.core)": [[64, "psi4.core.Dimension", false]], "dimpi() (psi4.core.intvector method)": [[88, "psi4.core.IntVector.dimpi", false]], "dimpi() (psi4.core.vector method)": [[148, "psi4.core.Vector.dimpi", false]], "dipmom (detci)": [[1704, "term-DIPMOM-DETCI", true]], "dipmom (fnocc)": [[1704, "term-DIPMOM-FNOCC", true]], "dipole_grad() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.dipole_grad", false]], "dipoleint (class in psi4.core)": [[65, "psi4.core.DipoleInt", false]], "directjk (class in psi4.core)": [[66, "psi4.core.DirectJK", false]], "disksomcscf (class in psi4.core)": [[67, "psi4.core.DiskSOMCSCF", false]], "disp (psi4.driver.empiricaldispersion attribute)": [[267, "psi4.driver.EmpiricalDispersion.disp", false]], "disp (psi4.driver.procrouting.empirical_dispersion.empiricaldispersion attribute)": [[1759, "psi4.driver.procrouting.empirical_dispersion.EmpiricalDispersion.disp", false]], "disp() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.disp", false]], "disp_size (findif)": [[1704, "term-DISP_SIZE-FINDIF", true]], "dispersion (class in psi4.core)": [[68, "psi4.core.Dispersion", false]], "dispersion correction energy": [[1776, "psivar-DISPERSION-CORRECTION-ENERGY", false]], "distance() (psi4.core.vector3 method)": [[149, "psi4.core.Vector3.distance", false]], "distance_matrix() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.distance_matrix", false]], "distributed multipole analysis": [[1775, "index-0", false]], "distributed_matrix (scf)": [[1704, "term-DISTRIBUTED_MATRIX-SCF", true]], "divide() (psi4.core.civector method)": [[12, "psi4.core.CIVector.divide", false]], "dkh": [[1762, "index-0", false]], "dkh_order (globals)": [[1704, "term-DKH_ORDER-GLOBALS", true]], "dlpno() (in module psi4.core)": [[180, "psi4.core.dlpno", false]], "dlpno-mp2": [[1763, "index-0", false], [1763, "index-1", false]], "dlpno_algorithm (dlpno)": [[1704, "term-DLPNO_ALGORITHM-DLPNO", true]], "dlpno_local_orbitals (dlpno)": [[1704, "term-DLPNO_LOCAL_ORBITALS-DLPNO", true]], "dlpno_maxiter (dlpno)": [[1704, "term-DLPNO_MAXITER-DLPNO", true]], "dma": [[1775, "index-0", false]], "dma distributed multipoles": [[1776, "psivar-DMA-DISTRIBUTED-MULTIPOLES", false]], "dma total multipoles": [[1776, "psivar-DMA-TOTAL-MULTIPOLES", false]], "dmrg() (in module psi4.core)": [[181, "psi4.core.dmrg", false]], "dmrg-caspt2 total energy": [[1776, "psivar-DMRG-CASPT2-TOTAL-ENERGY", false]], "dmrg-scf total energy": [[1776, "psivar-DMRG-SCF-TOTAL-ENERGY", false]], "dmrg_caspt2_calc (dmrg)": [[1704, "term-DMRG_CASPT2_CALC-DMRG", true]], "dmrg_caspt2_imag (dmrg)": [[1704, "term-DMRG_CASPT2_IMAG-DMRG", true]], "dmrg_caspt2_ipea (dmrg)": [[1704, "term-DMRG_CASPT2_IPEA-DMRG", true]], "dmrg_caspt2_orbs (dmrg)": [[1704, "term-DMRG_CASPT2_ORBS-DMRG", true]], "dmrg_diis (dmrg)": [[1704, "term-DMRG_DIIS-DMRG", true]], "dmrg_diis_write (dmrg)": [[1704, "term-DMRG_DIIS_WRITE-DMRG", true]], "dmrg_excitation (dmrg)": [[1704, "term-DMRG_EXCITATION-DMRG", true]], "dmrg_irrep (dmrg)": [[1704, "term-DMRG_IRREP-DMRG", true]], "dmrg_local_init (dmrg)": [[1704, "term-DMRG_LOCAL_INIT-DMRG", true]], "dmrg_molden_write (dmrg)": [[1704, "term-DMRG_MOLDEN_WRITE-DMRG", true]], "dmrg_mps_write (dmrg)": [[1704, "term-DMRG_MPS_WRITE-DMRG", true]], "dmrg_multiplicity (dmrg)": [[1704, "term-DMRG_MULTIPLICITY-DMRG", true]], "dmrg_opdm_ao_print (dmrg)": [[1704, "term-DMRG_OPDM_AO_PRINT-DMRG", true]], "dmrg_print_corr (dmrg)": [[1704, "term-DMRG_PRINT_CORR-DMRG", true]], "dmrg_scf_active_space (dmrg)": [[1704, "term-DMRG_SCF_ACTIVE_SPACE-DMRG", true]], "dmrg_scf_diis_thr (dmrg)": [[1704, "term-DMRG_SCF_DIIS_THR-DMRG", true]], "dmrg_scf_grad_thr (dmrg)": [[1704, "term-DMRG_SCF_GRAD_THR-DMRG", true]], "dmrg_scf_max_iter (dmrg)": [[1704, "term-DMRG_SCF_MAX_ITER-DMRG", true]], "dmrg_scf_state_avg (dmrg)": [[1704, "term-DMRG_SCF_STATE_AVG-DMRG", true]], "dmrg_sweep_dvdson_rtol (dmrg)": [[1704, "term-DMRG_SWEEP_DVDSON_RTOL-DMRG", true]], "dmrg_sweep_energy_conv (dmrg)": [[1704, "term-DMRG_SWEEP_ENERGY_CONV-DMRG", true]], "dmrg_sweep_max_sweeps (dmrg)": [[1704, "term-DMRG_SWEEP_MAX_SWEEPS-DMRG", true]], "dmrg_sweep_noise_prefac (dmrg)": [[1704, "term-DMRG_SWEEP_NOISE_PREFAC-DMRG", true]], "dmrg_sweep_states (dmrg)": [[1704, "term-DMRG_SWEEP_STATES-DMRG", true]], "dmrg_unitary_write (dmrg)": [[1704, "term-DMRG_UNITARY_WRITE-DMRG", true]], "dnrm2() (in module psi4.core)": [[39, "psi4.core.DNRM2", false]], "do_ccd_disp (sapt)": [[1704, "term-DO_CCD_DISP-SAPT", true]], "do_cubes() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.do_cubes", false]], "do_diis (dfocc)": [[1704, "term-DO_DIIS-DFOCC", true]], "do_diis (occ)": [[1704, "term-DO_DIIS-OCC", true]], "do_disp_exch_sinf (sapt)": [[1704, "term-DO_DISP_EXCH_SINF-SAPT", true]], "do_incfock_iter() (psi4.core.compositejk method)": [[18, "psi4.core.CompositeJK.do_incfock_iter", false]], "do_incfock_iter() (psi4.core.directjk method)": [[66, "psi4.core.DirectJK.do_incfock_iter", false]], "do_ind30_exch_sinf (sapt)": [[1704, "term-DO_IND30_EXCH_SINF-SAPT", true]], "do_ind_exch_sinf (sapt)": [[1704, "term-DO_IND_EXCH_SINF-SAPT", true]], "do_level_shift (dfocc)": [[1704, "term-DO_LEVEL_SHIFT-DFOCC", true]], "do_level_shift (occ)": [[1704, "term-DO_LEVEL_SHIFT-OCC", true]], "do_mbpt_disp (sapt)": [[1704, "term-DO_MBPT_DISP-SAPT", true]], "do_scs (dfocc)": [[1704, "term-DO_SCS-DFOCC", true]], "do_scs (occ)": [[1704, "term-DO_SCS-OCC", true]], "do_sos (dfocc)": [[1704, "term-DO_SOS-DFOCC", true]], "do_sos (occ)": [[1704, "term-DO_SOS-OCC", true]], "do_third_order (sapt)": [[1704, "term-DO_THIRD_ORDER-SAPT", true]], "docc (globals)": [[1704, "term-DOCC-GLOBALS", true]], "docc (mcscf)": [[1704, "term-DOCC-MCSCF", true]], "doccpi() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.doccpi", false]], "docs_table_link() (in module psi4.driver)": [[292, "psi4.driver.docs_table_link", false]], "docs_table_link() (in module psi4.driver.p4util)": [[343, "psi4.driver.p4util.docs_table_link", false]], "doi_basis_tolerance (dlpno)": [[1704, "term-DOI_BASIS_TOLERANCE-DLPNO", true]], "doi_pruning_scheme (dlpno)": [[1704, "term-DOI_PRUNING_SCHEME-DLPNO", true]], "doi_radial_points (dlpno)": [[1704, "term-DOI_RADIAL_POINTS-DLPNO", true]], "doi_spherical_points (dlpno)": [[1704, "term-DOI_SPHERICAL_POINTS-DLPNO", true]], "domain (psi4.driver.p4util.lineshape attribute)": [[324, "psi4.driver.p4util.Lineshape.domain", false]], "dot() (psi4.core.vector3 method)": [[149, "psi4.core.Vector3.dot", false]], "double-hybrid correction energy": [[1776, "psivar-DOUBLE-HYBRID-CORRECTION-ENERGY", false]], "doublet() (in module psi4.core)": [[182, "psi4.core.doublet", false]], "doublet() (psi4.core.matrix static method)": [[100, "psi4.core.Matrix.doublet", false]], "dpd_id() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.DPD_ID", false]], "dpdbuf4 (class in psi4.core)": [[183, "psi4.core.dpdbuf4", false]], "dpdfile2 (class in psi4.core)": [[184, "psi4.core.dpdfile2", false]], "dpotrf() (in module psi4.core)": [[40, "psi4.core.DPOTRF", false]], "dpotri() (in module psi4.core)": [[41, "psi4.core.DPOTRI", false]], "dpotrs() (in module psi4.core)": [[42, "psi4.core.DPOTRS", false]], "driver (psi4.driver.atomiccomputer attribute)": [[265, "psi4.driver.AtomicComputer.driver", false]], "driver (psi4.driver.driver_cbs.compositecomputer attribute)": [[1740, "psi4.driver.driver_cbs.CompositeComputer.driver", false]], "driver (psi4.driver.driver_findif.finitedifferencecomputer attribute)": [[1772, "psi4.driver.driver_findif.FiniteDifferenceComputer.driver", false]], "driver (psi4.driver.driver_nbody.manybodycomputer attribute)": [[1794, "psi4.driver.driver_nbody.ManyBodyComputer.driver", false]], "drop_duplicates() (in module psi4.driver.p4util)": [[344, "psi4.driver.p4util.drop_duplicates", false]], "drot() (in module psi4.core)": [[43, "psi4.core.DROT", false]], "dsbmv() (in module psi4.core)": [[44, "psi4.core.DSBMV", false]], "dscal() (in module psi4.core)": [[45, "psi4.core.DSCAL", false]], "dswap() (in module psi4.core)": [[46, "psi4.core.DSWAP", false]], "dsyev() (in module psi4.core)": [[47, "psi4.core.DSYEV", false]], "dsymm() (in module psi4.core)": [[48, "psi4.core.DSYMM", false]], "dsymv() (in module psi4.core)": [[49, "psi4.core.DSYMV", false]], "dsyr() (in module psi4.core)": [[50, "psi4.core.DSYR", false]], "dsyr2() (in module psi4.core)": [[51, "psi4.core.DSYR2", false]], "dsyr2k() (in module psi4.core)": [[52, "psi4.core.DSYR2K", false]], "dsyrk() (in module psi4.core)": [[53, "psi4.core.DSYRK", false]], "dsysv() (in module psi4.core)": [[54, "psi4.core.DSYSV", false]], "dtbmv() (in module psi4.core)": [[55, "psi4.core.DTBMV", false]], "dtbsv() (in module psi4.core)": [[56, "psi4.core.DTBSV", false]], "dtrmm() (in module psi4.core)": [[57, "psi4.core.DTRMM", false]], "dtrmv() (in module psi4.core)": [[58, "psi4.core.DTRMV", false]], "dtrsm() (in module psi4.core)": [[59, "psi4.core.DTRSM", false]], "dtrsv() (in module psi4.core)": [[60, "psi4.core.DTRSV", false]], "dum() (psi4.core.mospace static method)": [[98, "psi4.core.MOSpace.dum", false]], "dummy_einsums() (in module psi4.core)": [[185, "psi4.core.dummy_einsums", false]], "dummy_integratorxx() (in module psi4.core)": [[186, "psi4.core.dummy_integratorxx", false]], "dynamic_level (optking)": [[1704, "term-DYNAMIC_LEVEL-OPTKING", true]], "dynamic_variable_bind() (in module psi4.driver)": [[293, "psi4.driver.dynamic_variable_bind", false]], "e() (psi4.core.symmetryoperation method)": [[139, "psi4.core.SymmetryOperation.E", false]], "e3_scale (dfocc)": [[1704, "term-E3_SCALE-DFOCC", true]], "e3_scale (occ)": [[1704, "term-E3_SCALE-OCC", true]], "e_conv (psi4.driver.scfconvergenceerror attribute)": [[276, "psi4.driver.SCFConvergenceError.e_conv", false]], "e_convergence (ccenergy)": [[1704, "term-E_CONVERGENCE-CCENERGY", true]], "e_convergence (cceom)": [[1704, "term-E_CONVERGENCE-CCEOM", true]], "e_convergence (dct)": [[1704, "term-E_CONVERGENCE-DCT", true]], "e_convergence (detci)": [[1704, "term-E_CONVERGENCE-DETCI", true]], "e_convergence (dfocc)": [[1704, "term-E_CONVERGENCE-DFOCC", true]], "e_convergence (dlpno)": [[1704, "term-E_CONVERGENCE-DLPNO", true]], "e_convergence (fnocc)": [[1704, "term-E_CONVERGENCE-FNOCC", true]], "e_convergence (mcscf)": [[1704, "term-E_CONVERGENCE-MCSCF", true]], "e_convergence (mrcc)": [[1704, "term-E_CONVERGENCE-MRCC", true]], "e_convergence (occ)": [[1704, "term-E_CONVERGENCE-OCC", true]], "e_convergence (psimrcc)": [[1704, "term-E_CONVERGENCE-PSIMRCC", true]], "e_convergence (scf)": [[1704, "term-E_CONVERGENCE-SCF", true]], "ea_poles (occ)": [[1704, "term-EA_POLES-OCC", true]], "ecp_shell() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.ecp_shell", false]], "ecp_shell_on_center() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.ecp_shell_on_center", false]], "ecpint": [[1765, "index-0", false]], "efp": [[1782, "index-0", false], [1782, "index-1", false], [1782, "index-4", false], [1782, "index-5", false]], "efp disp energy": [[1776, "psivar-EFP-DISP-ENERGY", false]], "efp elst energy": [[1776, "psivar-EFP-ELST-ENERGY", false]], "efp exch energy": [[1776, "psivar-EFP-EXCH-ENERGY", false]], "efp ind energy": [[1776, "psivar-EFP-IND-ENERGY", false]], "efp torque": [[1776, "psivar-EFP-TORQUE", false]], "efp total energy": [[1776, "psivar-EFP-TOTAL-ENERGY", false]], "efp_disp (efp)": [[1704, "term-EFP_DISP-EFP", true]], "efp_disp_damping (efp)": [[1704, "term-EFP_DISP_DAMPING-EFP", true]], "efp_elst (efp)": [[1704, "term-EFP_ELST-EFP", true]], "efp_elst_damping (efp)": [[1704, "term-EFP_ELST_DAMPING-EFP", true]], "efp_exch (efp)": [[1704, "term-EFP_EXCH-EFP", true]], "efp_ind (efp)": [[1704, "term-EFP_IND-EFP", true]], "efp_ind_damping (efp)": [[1704, "term-EFP_IND_DAMPING-EFP", true]], "efp_qm_elst (efp)": [[1704, "term-EFP_QM_ELST-EFP", true]], "efp_qm_ind (efp)": [[1704, "term-EFP_QM_IND-EFP", true]], "efzc() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.efzc", false]], "ekt_ea (occ)": [[1704, "term-EKT_EA-OCC", true]], "ekt_ip (dfocc)": [[1704, "term-EKT_IP-DFOCC", true]], "ekt_ip (occ)": [[1704, "term-EKT_IP-OCC", true]], "electric_field() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.electric_field", false]], "electric_field() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.electric_field", false]], "electric_field_value() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.electric_field_value", false]], "electricfieldint (class in psi4.core)": [[71, "psi4.core.ElectricFieldInt", false]], "electrostatic() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.electrostatic", false]], "electrostatic_potential_value() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.electrostatic_potential_value", false]], "electrostaticint (class in psi4.core)": [[72, "psi4.core.ElectrostaticInt", false]], "elevation (psi4.driver.p4util.inpsight attribute)": [[323, "psi4.driver.p4util.InPsight.elevation", false]], "elst() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.elst", false]], "embedding_charges (psi4.driver.driver_nbody.manybodycomputer attribute)": [[1794, "psi4.driver.driver_nbody.ManyBodyComputer.embedding_charges", false]], "empiricaldispersion (class in psi4.driver)": [[267, "psi4.driver.EmpiricalDispersion", false]], "empiricaldispersion (class in psi4.driver.procrouting.empirical_dispersion)": [[1759, "psi4.driver.procrouting.empirical_dispersion.EmpiricalDispersion", false]], "end() (psi4.core.slice method)": [[137, "psi4.core.Slice.end", false]], "energies_from_fcidump() (in module psi4.driver)": [[294, "psi4.driver.energies_from_fcidump", false]], "energies_from_fcidump() (in module psi4.driver.p4util)": [[345, "psi4.driver.p4util.energies_from_fcidump", false]], "energy()": [[1766, "index-0", false]], "energy() (in module psi4.driver)": [[295, "psi4.driver.energy", false]], "energy() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.energy", false]], "energy_level_shift (dct)": [[1704, "term-ENERGY_LEVEL_SHIFT-DCT", true]], "engine (psi4.driver.empiricaldispersion attribute)": [[267, "psi4.driver.EmpiricalDispersion.engine", false]], "engine (psi4.driver.procrouting.empirical_dispersion.empiricaldispersion attribute)": [[1759, "psi4.driver.procrouting.empirical_dispersion.EmpiricalDispersion.engine", false]], "ensure_bt_convergence (optking)": [[1704, "term-ENSURE_BT_CONVERGENCE-OPTKING", true]], "enthalpy": [[1776, "psivar-ENTHALPY", false]], "enthalpy correction": [[1776, "psivar-ENTHALPY-CORRECTION", false]], "environment variable": [[2, "index-0", false], [2, "index-1", false], [106, "index-0", false], [106, "index-1", false], [194, "index-0", false], [245, "index-0", false], [661, "index-0", false], [1206, "index-0", false], [1224, "index-0", false], [1240, "index-0", false], [1704, "index-0", false], [1704, "index-1", false], [1730, "index-4", false], [1730, "index-5", false], [1735, "envvar-BRIANQC_ENABLE", false], [1735, "envvar-BRIANQC_INSTALL_PATH", false], [1735, "envvar-BRIANQC_SDK_INSTALL", false], [1735, "index-1", false], [1735, "index-2", false], [1735, "index-3", false], [1735, "index-4", false], [1738, "envvar-CRAYPE_LINK_TYPE", false], [1738, "envvar-CRAY_ADD_RPATH", false], [1738, "envvar-MATH_ROOT", false], [1738, "envvar-MKL_ROOT", false], [1738, "index-1", false], [1738, "index-10", false], [1738, "index-11", false], [1738, "index-12", false], [1738, "index-13", false], [1738, "index-14", false], [1738, "index-15", false], [1738, "index-16", false], [1738, "index-17", false], [1738, "index-18", false], [1738, "index-19", false], [1738, "index-2", false], [1738, "index-20", false], [1738, "index-21", false], [1738, "index-22", false], [1738, "index-23", false], [1738, "index-24", false], [1738, "index-25", false], [1738, "index-26", false], [1738, "index-27", false], [1738, "index-3", false], [1738, "index-4", false], [1738, "index-5", false], [1738, "index-6", false], [1738, "index-7", false], [1738, "index-8", false], [1738, "index-9", false], [1743, "index-1", false], [1743, "index-2", false], [1743, "index-3", false], [1743, "index-4", false], [1743, "index-5", false], [1743, "index-6", false], [1743, "index-7", false], [1743, "index-8", false], [1743, "index-9", false], [1748, "index-0", false], [1748, "index-1", false], [1748, "index-2", false], [1748, "index-3", false], [1748, "index-4", false], [1748, "index-5", false], [1748, "index-6", false], [1748, "index-7", false], [1748, "index-8", false], [1750, "envvar-MONTAGE", false], [1750, "envvar-VMDPATH", false], [1750, "index-1", false], [1750, "index-2", false], [1752, "index-1", false], [1752, "index-2", false], [1756, "index-2", false], [1756, "index-3", false], [1759, "index-1", false], [1759, "index-2", false], [1767, "envvar-CONDA_PREFIX", false], [1767, "envvar-HOST", false], [1767, "envvar-MKL_NUM_THREADS", false], [1767, "envvar-OMP_NESTED", false], [1767, "envvar-OMP_NUM_THREADS", false], [1767, "envvar-PATH", false], [1767, "envvar-PSIDATADIR", false], [1767, "envvar-PSIPATH", false], [1767, "envvar-PSI_SCRATCH", false], [1767, "envvar-PYTHONPATH", false], [1767, "index-1", false], [1767, "index-10", false], [1767, "index-11", false], [1767, "index-12", false], [1767, "index-13", false], [1767, "index-14", false], [1767, "index-15", false], [1767, "index-16", false], [1767, "index-17", false], [1767, "index-18", false], [1767, "index-19", false], [1767, "index-2", false], [1767, "index-20", false], [1767, "index-21", false], [1767, "index-22", false], [1767, "index-23", false], [1767, "index-24", false], [1767, "index-3", false], [1767, "index-5", false], [1767, "index-7", false], [1767, "index-8", false], [1774, "index-1", false], [1774, "index-2", false], [1774, "index-3", false], [1782, "index-2", false], [1782, "index-3", false], [1792, "index-1", false], [1806, "index-1", false], [1807, "index-1", false], [1807, "index-2", false], [1808, "index-0", false], [1808, "index-1", false], [1827, "index-2", false], [1827, "index-3", false], [1835, "index-1", false]], "eom_guess (cceom)": [[1704, "term-EOM_GUESS-CCEOM", true]], "eom_reference (cceom)": [[1704, "term-EOM_REFERENCE-CCEOM", true]], "eom_reference (cchbar)": [[1704, "term-EOM_REFERENCE-CCHBAR", true]], "ep2_convergence (dfep2)": [[1704, "term-EP2_CONVERGENCE-DFEP2", true]], "ep2_maxiter (dfep2)": [[1704, "term-EP2_MAXITER-DFEP2", true]], "ep2_num_ea (dfep2)": [[1704, "term-EP2_NUM_EA-DFEP2", true]], "ep2_num_ip (dfep2)": [[1704, "term-EP2_NUM_IP-DFEP2", true]], "ep2_orbitals (dfep2)": [[1704, "term-EP2_ORBITALS-DFEP2", true]], "ep_ea_poles (occ)": [[1704, "term-EP_EA_POLES-OCC", true]], "ep_ip_poles (occ)": [[1704, "term-EP_IP_POLES-OCC", true]], "ep_maxiter (occ)": [[1704, "term-EP_MAXITER-OCC", true]], "epsilon_a() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.epsilon_a", false]], "epsilon_a_subset() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.epsilon_a_subset", false]], "epsilon_b() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.epsilon_b", false]], "epsilon_b_subset() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.epsilon_b_subset", false]], "erd_coef() (psi4.core.gaussianshell method)": [[81, "psi4.core.GaussianShell.erd_coef", false]], "erf_complement_eri() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.erf_complement_eri", false]], "erf_eri() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.erf_eri", false]], "eri (class in psi4.core)": [[69, "psi4.core.ERI", false]], "eri() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.eri", false]], "esp at center n": [[1776, "psivar-ESP-AT-CENTER-n", false]], "esp_at_nuclei() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.esp_at_nuclei", false]], "esppropcalc (class in psi4.core)": [[70, "psi4.core.ESPPropCalc", false]], "evals() (psi4.core.orbitalspace method)": [[115, "psi4.core.OrbitalSpace.evals", false]], "ex_allow (detci)": [[1704, "term-EX_ALLOW-DETCI", true]], "ex_level (detci)": [[1704, "term-EX_LEVEL-DETCI", true]], "exch() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.exch", false]], "exch_scale_alpha (sapt)": [[1704, "term-EXCH_SCALE_ALPHA-SAPT", true]], "excitation_range (cceom)": [[1704, "term-EXCITATION_RANGE-CCEOM", true]], "exists() (psi4.core.io method)": [[86, "psi4.core.IO.exists", false]], "exp() (psi4.core.gaussianshell method)": [[81, "psi4.core.GaussianShell.exp", false]], "expand_cbs_methods() (in module psi4.driver.task_planner)": [[1768, "psi4.driver.task_planner.expand_cbs_methods", false]], "expand_psivars() (in module psi4.driver.p4util)": [[346, "psi4.driver.p4util.expand_psivars", false]], "explicit_hamiltonian (cphf)": [[1704, "term-EXPLICIT_HAMILTONIAN-CPHF", true]], "exponent() (psi4.core.fittedslatercorrelationfactor method)": [[77, "psi4.core.FittedSlaterCorrelationFactor.exponent", false]], "ext_force_bend (optking)": [[1704, "term-EXT_FORCE_BEND-OPTKING", true]], "ext_force_cartesian (optking)": [[1704, "term-EXT_FORCE_CARTESIAN-OPTKING", true]], "ext_force_dihedral (optking)": [[1704, "term-EXT_FORCE_DIHEDRAL-OPTKING", true]], "ext_force_distance (optking)": [[1704, "term-EXT_FORCE_DISTANCE-OPTKING", true]], "ext_force_oofp (optking)": [[1704, "term-EXT_FORCE_OOFP-OPTKING", true]], "extend() (psi4.core.bsvec method)": [[5, "psi4.core.BSVec.extend", false]], "extern (scf)": [[1704, "term-EXTERN-SCF", true]], "external_pot() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.external_pot", false]], "external_potential_symmetry (globals)": [[1704, "term-EXTERNAL_POTENTIAL_SYMMETRY-GLOBALS", true]], "externalpotential (class in psi4.core)": [[73, "psi4.core.ExternalPotential", false]], "extract_subsets() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.extract_subsets", false]], "extrapolate() (psi4.driver.p4util.diis method)": [[321, "psi4.driver.p4util.DIIS.extrapolate", false]], "extrapolation": [[1740, "index-3", false]], "extrapolation schemes": [[1740, "index-3", false]], "exvals() (psi4.core.oeprop method)": [[111, "psi4.core.OEProp.Exvals", false]], "eyvals() (psi4.core.oeprop method)": [[111, "psi4.core.OEProp.Eyvals", false]], "ezvals() (psi4.core.oeprop method)": [[111, "psi4.core.OEProp.Ezvals", false]], "f12() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.f12", false]], "f12_cgtg() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.f12_cgtg", false]], "f12_double_commutator() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.f12_double_commutator", false]], "f12_squared() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.f12_squared", false]], "f12g12() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.f12g12", false]], "f_cut (dlpno)": [[1704, "term-F_CUT-DLPNO", true]], "fa() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.Fa", false]], "fa_subset() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.Fa_subset", false]], "factory() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.factory", false]], "fail_on_maxiter (scf)": [[1704, "term-FAIL_ON_MAXITER-SCF", true]], "failure (psi4.core.psireturntype attribute)": [[126, "psi4.core.PsiReturnType.Failure", false]], "favg (mcscf)": [[1704, "term-FAVG-MCSCF", true]], "favg_ccsd_t (psimrcc)": [[1704, "term-FAVG_CCSD_T-PSIMRCC", true]], "favg_start (mcscf)": [[1704, "term-FAVG_START-MCSCF", true]], "fb() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.Fb", false]], "fb_subset() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.Fb_subset", false]], "fcharge() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.fcharge", false]], "fchk": [[1769, "index-0", false]], "fchk() (in module psi4.driver)": [[296, "psi4.driver.fchk", false]], "fchkwriter (class in psi4.core)": [[74, "psi4.core.FCHKWriter", false]], "fci (detci)": [[1704, "term-FCI-DETCI", true]], "fci correlation energy": [[1776, "psivar-FCI-CORRELATION-ENERGY", false]], "fci total energy": [[1776, "psivar-FCI-TOTAL-ENERGY", false]], "fci_strings (detci)": [[1704, "term-FCI_STRINGS-DETCI", true]], "fcidump() (in module psi4.driver)": [[297, "psi4.driver.fcidump", false]], "fcidump() (in module psi4.driver.p4util)": [[347, "psi4.driver.p4util.fcidump", false]], "fcidump_from_file() (in module psi4.driver)": [[298, "psi4.driver.fcidump_from_file", false]], "fcidump_from_file() (in module psi4.driver.p4util)": [[348, "psi4.driver.p4util.fcidump_from_file", false]], "fcidump_tei_helper() (in module psi4.core)": [[187, "psi4.core.fcidump_tei_helper", false]], "fctl dispersion correction energy": [[1776, "psivar-fctl-DISPERSION-CORRECTION-ENERGY", false]], "fctldash (psi4.driver.empiricaldispersion attribute)": [[267, "psi4.driver.EmpiricalDispersion.fctldash", false]], "fctldash (psi4.driver.procrouting.empirical_dispersion.empiricaldispersion attribute)": [[1759, "psi4.driver.procrouting.empirical_dispersion.EmpiricalDispersion.fctldash", false]], "fd_project (findif)": [[1704, "term-FD_PROJECT-FINDIF", true]], "fdds_dispersion (class in psi4.core)": [[75, "psi4.core.FDDS_Dispersion", false]], "fdisp() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.fdisp", false]], "felst() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.felst", false]], "fexch() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.fexch", false]], "fill() (psi4.core.dimension method)": [[64, "psi4.core.Dimension.fill", false]], "filter_guess (detci)": [[1704, "term-FILTER_GUESS-DETCI", true]], "filter_guess_det1 (detci)": [[1704, "term-FILTER_GUESS_DET1-DETCI", true]], "filter_guess_det2 (detci)": [[1704, "term-FILTER_GUESS_DET2-DETCI", true]], "filter_guess_sign (detci)": [[1704, "term-FILTER_GUESS_SIGN-DETCI", true]], "filter_nonvib() (in module psi4.driver.qcdb.vib)": [[384, "psi4.driver.qcdb.vib.filter_nonvib", false]], "filter_omega_to_real() (in module psi4.driver.qcdb.vib)": [[385, "psi4.driver.qcdb.vib.filter_omega_to_real", false]], "filter_zero_det (detci)": [[1704, "term-FILTER_ZERO_DET-DETCI", true]], "finalize() (in module psi4.core)": [[188, "psi4.core.finalize", false]], "finalize() (psi4.core.hf method)": [[84, "psi4.core.HF.finalize", false]], "finalize() (psi4.core.jk method)": [[92, "psi4.core.JK.finalize", false]], "finalize() (psi4.core.vbase method)": [[147, "psi4.core.VBase.finalize", false]], "finalize_energy() (psi4.core.hf method)": [[84, "psi4.core.HF.finalize_energy", false]], "find() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.find", false]], "find_approximate_string_matches() (in module psi4.driver)": [[299, "psi4.driver.find_approximate_string_matches", false]], "find_approximate_string_matches() (in module psi4.driver.p4util)": [[349, "psi4.driver.p4util.find_approximate_string_matches", false]], "find_highest_point_group() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.find_highest_point_group", false]], "find_occupation() (psi4.core.hf method)": [[84, "psi4.core.HF.find_occupation", false]], "find_point_group() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.find_point_group", false]], "findif number": [[1776, "psivar-FINDIF-NUMBER", false]], "findifrec (psi4.driver.driver_findif.finitedifferencecomputer attribute)": [[1772, "psi4.driver.driver_findif.FiniteDifferenceComputer.findifrec", false]], "first() (psi4.core.aoshellcombinationsiterator method)": [[3, "psi4.core.AOShellCombinationsIterator.first", false]], "fisapt": [[1770, "index-0", false]], "fisapt (class in psi4.core)": [[76, "psi4.core.FISAPT", false]], "fisapt_charge_completeness (fisapt)": [[1704, "term-FISAPT_CHARGE_COMPLETENESS-FISAPT", true]], "fisapt_cube_densmat (fisapt)": [[1704, "term-FISAPT_CUBE_DENSMAT-FISAPT", true]], "fisapt_cube_linkibos (fisapt)": [[1704, "term-FISAPT_CUBE_LINKIBOS-FISAPT", true]], "fisapt_cube_linkihos (fisapt)": [[1704, "term-FISAPT_CUBE_LINKIHOS-FISAPT", true]], "fisapt_do_fsapt (fisapt)": [[1704, "term-FISAPT_DO_FSAPT-FISAPT", true]], "fisapt_do_fsapt_disp (fisapt)": [[1704, "term-FISAPT_DO_FSAPT_DISP-FISAPT", true]], "fisapt_do_plot (fisapt)": [[1704, "term-FISAPT_DO_PLOT-FISAPT", true]], "fisapt_exch_parperp (fisapt)": [[1704, "term-FISAPT_EXCH_PARPERP-FISAPT", true]], "fisapt_fsapt_exch_scale (fisapt)": [[1704, "term-FISAPT_FSAPT_EXCH_SCALE-FISAPT", true]], "fisapt_fsapt_filepath (fisapt)": [[1704, "term-FISAPT_FSAPT_FILEPATH-FISAPT", true]], "fisapt_fsapt_ind_response (fisapt)": [[1704, "term-FISAPT_FSAPT_IND_RESPONSE-FISAPT", true]], "fisapt_fsapt_ind_scale (fisapt)": [[1704, "term-FISAPT_FSAPT_IND_SCALE-FISAPT", true]], "fisapt_fssapt_filepath (fisapt)": [[1704, "term-FISAPT_FSSAPT_FILEPATH-FISAPT", true]], "fisapt_link_assignment (fisapt)": [[1704, "term-FISAPT_LINK_ASSIGNMENT-FISAPT", true]], "fisapt_link_ortho (fisapt)": [[1704, "term-FISAPT_LINK_ORTHO-FISAPT", true]], "fisapt_link_selection (fisapt)": [[1704, "term-FISAPT_LINK_SELECTION-FISAPT", true]], "fisapt_manual_links (fisapt)": [[1704, "term-FISAPT_MANUAL_LINKS-FISAPT", true]], "fisapt_mem_safety_factor (fisapt)": [[1704, "term-FISAPT_MEM_SAFETY_FACTOR-FISAPT", true]], "fisapt_plot_filepath (fisapt)": [[1704, "term-FISAPT_PLOT_FILEPATH-FISAPT", true]], "fittedslatercorrelationfactor (class in psi4.core)": [[77, "psi4.core.FittedSlaterCorrelationFactor", false]], "fittingmetric (class in psi4.core)": [[78, "psi4.core.FittingMetric", false]], "fix_com() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.fix_com", false]], "fix_orientation() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.fix_orientation", false]], "flabel() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.flabel", false]], "flexible_g_convergence (optking)": [[1704, "term-FLEXIBLE_G_CONVERGENCE-OPTKING", true]], "flocalize() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.flocalize", false]], "flush_outfile() (in module psi4.core)": [[189, "psi4.core.flush_outfile", false]], "fmass() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.fmass", false]], "fno-cc": [[1771, "index-0", false]], "fno-ccsd(t)": [[1771, "index-1", false]], "fno-mp4": [[1771, "index-1", false]], "fno-qcisd(t)": [[1771, "index-1", false]], "fnocc": [[1771, "index-2", false], [1771, "index-3", false]], "fnocc() (in module psi4.core)": [[190, "psi4.core.fnocc", false]], "follow_root (detci)": [[1704, "term-FOLLOW_ROOT-DETCI", true]], "follow_root (mcscf)": [[1704, "term-FOLLOW_ROOT-MCSCF", true]], "follow_root (psimrcc)": [[1704, "term-FOLLOW_ROOT-PSIMRCC", true]], "follow_step_increment (scf)": [[1704, "term-FOLLOW_STEP_INCREMENT-SCF", true]], "follow_step_scale (scf)": [[1704, "term-FOLLOW_STEP_SCALE-SCF", true]], "follow_vector (detci)": [[1704, "term-FOLLOW_VECTOR-DETCI", true]], "force_occpi() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.force_occpi", false]], "force_restart (ccenergy)": [[1704, "term-FORCE_RESTART-CCENERGY", true]], "force_twocon (mcscf)": [[1704, "term-FORCE_TWOCON-MCSCF", true]], "form_aux_matrices() (psi4.core.fdds_dispersion method)": [[75, "psi4.core.FDDS_Dispersion.form_aux_matrices", false]], "form_c() (psi4.core.hf method)": [[84, "psi4.core.HF.form_C", false]], "form_cholesky_inverse() (psi4.core.fittingmetric method)": [[78, "psi4.core.FittingMetric.form_cholesky_inverse", false]], "form_d() (psi4.core.hf method)": [[84, "psi4.core.HF.form_D", false]], "form_eig_inverse() (psi4.core.fittingmetric method)": [[78, "psi4.core.FittingMetric.form_eig_inverse", false]], "form_f() (psi4.core.hf method)": [[84, "psi4.core.HF.form_F", false]], "form_fdsmsdf() (psi4.core.hf method)": [[84, "psi4.core.HF.form_FDSmSDF", false]], "form_fitting_metric() (psi4.core.fittingmetric method)": [[78, "psi4.core.FittingMetric.form_fitting_metric", false]], "form_full_inverse() (psi4.core.fittingmetric method)": [[78, "psi4.core.FittingMetric.form_full_inverse", false]], "form_g() (psi4.core.hf method)": [[84, "psi4.core.HF.form_G", false]], "form_h() (psi4.core.hf method)": [[84, "psi4.core.HF.form_H", false]], "form_initial_c() (psi4.core.hf method)": [[84, "psi4.core.HF.form_initial_C", false]], "form_initial_f() (psi4.core.hf method)": [[84, "psi4.core.HF.form_initial_F", false]], "form_opdm() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.form_opdm", false]], "form_qr_inverse() (psi4.core.fittingmetric method)": [[78, "psi4.core.FittingMetric.form_QR_inverse", false]], "form_rotation_matrix() (psi4.core.somcscf method)": [[133, "psi4.core.SOMCSCF.form_rotation_matrix", false]], "form_shalf() (psi4.core.hf method)": [[84, "psi4.core.HF.form_Shalf", false]], "form_symmetry_information() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.form_symmetry_information", false]], "form_tpdm() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.form_tpdm", false]], "form_unc_amplitude() (psi4.core.fdds_dispersion method)": [[75, "psi4.core.FDDS_Dispersion.form_unc_amplitude", false]], "form_v() (psi4.core.hf method)": [[84, "psi4.core.HF.form_V", false]], "format_molecule_for_input() (in module psi4.driver.p4util)": [[350, "psi4.driver.p4util.format_molecule_for_input", false]], "format_molecule_for_mol() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.format_molecule_for_mol", false]], "format_options_for_input() (in module psi4.driver.p4util)": [[351, "psi4.driver.p4util.format_options_for_input", false]], "frac_diis (scf)": [[1704, "term-FRAC_DIIS-SCF", true]], "frac_load (scf)": [[1704, "term-FRAC_LOAD-SCF", true]], "frac_nuke() (in module psi4.driver.frac)": [[1768, "psi4.driver.frac.frac_nuke", false]], "frac_occ (scf)": [[1704, "term-FRAC_OCC-SCF", true]], "frac_performed_ (psi4.core.hf attribute)": [[84, "psi4.core.HF.frac_performed_", false]], "frac_renormalize (scf)": [[1704, "term-FRAC_RENORMALIZE-SCF", true]], "frac_renormalize() (psi4.core.hf method)": [[84, "psi4.core.HF.frac_renormalize", false]], "frac_start (scf)": [[1704, "term-FRAC_START-SCF", true]], "frac_traverse() (in module psi4.driver.frac)": [[1768, "psi4.driver.frac.frac_traverse", false]], "frac_val (scf)": [[1704, "term-FRAC_VAL-SCF", true]], "frag_mode (optking)": [[1704, "term-FRAG_MODE-OPTKING", true]], "frag_ref_atoms (optking)": [[1704, "term-FRAG_REF_ATOMS-OPTKING", true]], "fragmenttype (class in psi4.core)": [[79, "psi4.core.FragmentType", false]], "free_atom_volumes() (in module psi4.driver.p4util)": [[352, "psi4.driver.p4util.free_atom_volumes", false]], "freeze_all_dihedrals (optking)": [[1704, "term-FREEZE_ALL_DIHEDRALS-OPTKING", true]], "freeze_core (globals)": [[1704, "term-FREEZE_CORE-GLOBALS", true]], "freeze_core (sapt)": [[1704, "term-FREEZE_CORE-SAPT", true]], "freeze_core() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.freeze_core", false]], "freeze_core_policy (globals)": [[1704, "term-FREEZE_CORE_POLICY-GLOBALS", true]], "freeze_interfrag (optking)": [[1704, "term-FREEZE_INTERFRAG-OPTKING", true]], "freeze_intrafrag (optking)": [[1704, "term-FREEZE_INTRAFRAG-OPTKING", true]], "freq()": [[1772, "index-0", false]], "freq() (in module psi4.driver)": [[300, "psi4.driver.freq", false]], "frequencies()": [[1772, "index-0", false]], "frequencies() (in module psi4.driver)": [[301, "psi4.driver.frequencies", false]], "frequencies() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.frequencies", false]], "frequency()": [[1772, "index-0", false]], "frequency() (in module psi4.driver)": [[302, "psi4.driver.frequency", false]], "frequency();": [[1772, "index-0", false]], "from_array() (psi4.core.matrix class method)": [[100, "psi4.core.Matrix.from_array", false]], "from_array() (psi4.core.vector class method)": [[148, "psi4.core.Vector.from_array", false]], "from_arrays() (psi4.core.molecule class method)": [[106, "psi4.core.Molecule.from_arrays", false]], "from_dict() (psi4.core.molecule static method)": [[106, "psi4.core.Molecule.from_dict", false]], "from_file() (psi4.core.wavefunction static method)": [[150, "psi4.core.Wavefunction.from_file", false]], "from_list() (psi4.core.dimension class method)": [[64, "psi4.core.Dimension.from_list", false]], "from_list() (psi4.core.matrix class method)": [[100, "psi4.core.Matrix.from_list", false]], "from_list() (psi4.core.vector class method)": [[148, "psi4.core.Vector.from_list", false]], "from_schema() (psi4.core.molecule class method)": [[106, "psi4.core.Molecule.from_schema", false]], "from_serial() (psi4.core.matrix class method)": [[100, "psi4.core.Matrix.from_serial", false]], "from_serial() (psi4.core.vector class method)": [[148, "psi4.core.Vector.from_serial", false]], "from_string() (psi4.core.molecule class method)": [[106, "psi4.core.Molecule.from_string", false]], "frozen natural orbital coupled cluster": [[1771, "index-0", false]], "frozen natural orbitals": [[1771, "index-1", false]], "frozen_bend (optking)": [[1704, "term-FROZEN_BEND-OPTKING", true]], "frozen_cartesian (optking)": [[1704, "term-FROZEN_CARTESIAN-OPTKING", true]], "frozen_dihedral (optking)": [[1704, "term-FROZEN_DIHEDRAL-OPTKING", true]], "frozen_distance (optking)": [[1704, "term-FROZEN_DISTANCE-OPTKING", true]], "frozen_docc (globals)": [[1704, "term-FROZEN_DOCC-GLOBALS", true]], "frozen_oofp (optking)": [[1704, "term-FROZEN_OOFP-OPTKING", true]], "frozen_uocc (globals)": [[1704, "term-FROZEN_UOCC-GLOBALS", true]], "frzcpi() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.frzcpi", false]], "frzvpi() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.frzvpi", false]], "fsymbol() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.fsymbol", false]], "ftrue_atomic_number() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.ftrue_atomic_number", false]], "full (psi4.core.savetype attribute)": [[135, "psi4.core.SaveType.Full", false]], "full_geometry() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.full_geometry", false]], "full_hess_every (optking)": [[1704, "term-FULL_HESS_EVERY-OPTKING", true]], "full_matrix (cceom)": [[1704, "term-FULL_MATRIX-CCEOM", true]], "full_name() (psi4.core.pointgroup method)": [[120, "psi4.core.PointGroup.full_name", false]], "full_pg_n() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.full_pg_n", false]], "function call": [[1772, "index-0", false], [1800, "index-0", false]], "function_index (psi4.core.gaussianshell attribute)": [[81, "psi4.core.GaussianShell.function_index", false]], "function_to_center() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.function_to_center", false]], "function_to_shell() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.function_to_shell", false]], "functional (class in psi4.core)": [[80, "psi4.core.Functional", false]], "functional() (psi4.core.hf method)": [[84, "psi4.core.HF.functional", false]], "functional() (psi4.core.vbase method)": [[147, "psi4.core.VBase.functional", false]], "functionals": [[1784, "index-0", false]], "functions_local_to_global() (psi4.core.blockopoints method)": [[9, "psi4.core.BlockOPoints.functions_local_to_global", false]], "fx() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.fx", false]], "fy() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.fy", false]], "fz() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.fZ", false], [106, "psi4.core.Molecule.fz", false]], "fzc() (psi4.core.mospace static method)": [[98, "psi4.core.MOSpace.fzc", false]], "fzv() (psi4.core.mospace static method)": [[98, "psi4.core.MOSpace.fzv", false]], "g_convergence (optking)": [[1704, "term-G_CONVERGENCE-OPTKING", true]], "gamma (psi4.driver.p4util.lineshape attribute)": [[324, "psi4.driver.p4util.Lineshape.gamma", false]], "gamma() (psi4.core.charactertable method)": [[17, "psi4.core.CharacterTable.gamma", false]], "gau2grid": [[1773, "index-0", false]], "gauge (adc)": [[1704, "term-GAUGE-ADC", true]], "gauge (ccdensity)": [[1704, "term-GAUGE-CCDENSITY", true]], "gauge (ccresponse)": [[1704, "term-GAUGE-CCRESPONSE", true]], "gaussian (class in psi4.driver.p4util)": [[322, "psi4.driver.p4util.Gaussian", false]], "gaussian formatted checkpoint": [[1769, "index-0", false]], "gaussianshell (class in psi4.core)": [[81, "psi4.core.GaussianShell", false]], "gaussiantype (class in psi4.core)": [[82, "psi4.core.GaussianType", false]], "gcp": [[1774, "index-0", false]], "gdma": [[1775, "index-0", false]], "gdma() (in module psi4.driver)": [[303, "psi4.driver.gdma", false]], "gdma_limit (gdma)": [[1704, "term-GDMA_LIMIT-GDMA", true]], "gdma_multipole_units (gdma)": [[1704, "term-GDMA_MULTIPOLE_UNITS-GDMA", true]], "gdma_origin (gdma)": [[1704, "term-GDMA_ORIGIN-GDMA", true]], "gdma_radius (gdma)": [[1704, "term-GDMA_RADIUS-GDMA", true]], "gdma_switch (gdma)": [[1704, "term-GDMA_SWITCH-GDMA", true]], "gemm() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.gemm", false]], "genbas() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.genbas", false]], "general": [[1832, "index-2", false]], "general_invert() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.general_invert", false]], "geom_maxiter (optking)": [[1704, "term-GEOM_MAXITER-OPTKING", true]], "geometry optimization": [[1800, "index-0", false], [1802, "index-1", false], [1802, "index-2", false], [1802, "index-3", false], [1802, "index-4", false]], "geometry optimization, optimization": [[1802, "index-0", false]], "geometry() (in module psi4.driver)": [[304, "psi4.driver.geometry", false]], "geometry() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.geometry", false]], "geometryunits (class in psi4.core)": [[83, "psi4.core.GeometryUnits", false]], "get() (psi4.core.intvector method)": [[88, "psi4.core.IntVector.get", false]], "get() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.get", false]], "get() (psi4.core.vector method)": [[148, "psi4.core.Vector.get", false]], "get_active_molecule() (in module psi4.core)": [[191, "psi4.core.get_active_molecule", false]], "get_algorithm() (psi4.core.fittingmetric method)": [[78, "psi4.core.FittingMetric.get_algorithm", false]], "get_amplitudes() (psi4.core.ccwavefunction method)": [[11, "psi4.core.CCWavefunction.get_amplitudes", false]], "get_ao_core() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.get_AO_core", false]], "get_ao_size() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.get_AO_size", false]], "get_array() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.get_array", false]], "get_array_variable() (in module psi4.core)": [[192, "psi4.core.get_array_variable", false]], "get_array_variables() (in module psi4.core)": [[193, "psi4.core.get_array_variables", false]], "get_basisset() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.get_basisset", false]], "get_block() (psi4.core.intvector method)": [[88, "psi4.core.IntVector.get_block", false]], "get_block() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.get_block", false]], "get_block() (psi4.core.vbase method)": [[147, "psi4.core.VBase.get_block", false]], "get_block() (psi4.core.vector method)": [[148, "psi4.core.Vector.get_block", false]], "get_bool() (psi4.core.options method)": [[114, "psi4.core.Options.get_bool", false]], "get_cosx_grid() (psi4.core.compositejk method)": [[18, "psi4.core.CompositeJK.get_COSX_grid", false]], "get_current_module() (psi4.core.options method)": [[114, "psi4.core.Options.get_current_module", false]], "get_datadir() (in module psi4.core)": [[194, "psi4.core.get_datadir", false]], "get_default_namespace() (psi4.core.io static method)": [[86, "psi4.core.IO.get_default_namespace", false]], "get_default_path() (psi4.core.iomanager method)": [[87, "psi4.core.IOManager.get_default_path", false]], "get_density() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.get_density", false]], "get_dimension() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.get_dimension", false]], "get_dipole_field_strength() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.get_dipole_field_strength", false]], "get_double() (psi4.core.options method)": [[114, "psi4.core.Options.get_double", false]], "get_dpd_id() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.get_dpd_id", false]], "get_energies() (psi4.core.hf method)": [[84, "psi4.core.HF.get_energies", false]], "get_file_path() (psi4.core.iomanager method)": [[87, "psi4.core.IOManager.get_file_path", false]], "get_fragment_charges() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.get_fragment_charges", false]], "get_fragment_multiplicities() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.get_fragment_multiplicities", false]], "get_fragment_types() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.get_fragment_types", false]], "get_fragments() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.get_fragments", false]], "get_frozen_core_energy() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.get_frozen_core_energy", false]], "get_full_point_group() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.get_full_point_group", false]], "get_full_point_group_with_n() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.get_full_point_group_with_n", false]], "get_global_option() (in module psi4.core)": [[195, "psi4.core.get_global_option", false]], "get_global_option_list() (in module psi4.core)": [[196, "psi4.core.get_global_option_list", false]], "get_int() (psi4.core.options method)": [[114, "psi4.core.Options.get_int", false]], "get_int_vector() (psi4.core.options method)": [[114, "psi4.core.Options.get_int_vector", false]], "get_keep_dpd_so_ints() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.get_keep_dpd_so_ints", false]], "get_keep_ht_ints() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.get_keep_ht_ints", false]], "get_keep_iwl_so_ints() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.get_keep_iwl_so_ints", false]], "get_local_option() (in module psi4.core)": [[197, "psi4.core.get_local_option", false]], "get_memory() (in module psi4.core)": [[198, "psi4.core.get_memory", false]], "get_memory() (in module psi4.driver)": [[305, "psi4.driver.get_memory", false]], "get_memory() (in module psi4.driver.p4util)": [[353, "psi4.driver.p4util.get_memory", false]], "get_memory() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.get_memory", false]], "get_memory() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.get_memory", false]], "get_method() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.get_method", false]], "get_metric() (psi4.core.fittingmetric method)": [[78, "psi4.core.FittingMetric.get_metric", false]], "get_mix_data() (psi4.core.libxcfunctional method)": [[96, "psi4.core.LibXCFunctional.get_mix_data", false]], "get_mo_core() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.get_MO_core", false]], "get_np_xyzw() (psi4.core.vbase method)": [[147, "psi4.core.VBase.get_np_xyzw", false]], "get_num_threads() (in module psi4.core)": [[199, "psi4.core.get_num_threads", false]], "get_omega() (psi4.core.jk method)": [[92, "psi4.core.JK.get_omega", false]], "get_omega_alpha() (psi4.core.jk method)": [[92, "psi4.core.JK.get_omega_alpha", false]], "get_omega_beta() (psi4.core.jk method)": [[92, "psi4.core.JK.get_omega_beta", false]], "get_opdm() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.get_opdm", false]], "get_option() (in module psi4.core)": [[200, "psi4.core.get_option", false]], "get_options() (in module psi4.core)": [[201, "psi4.core.get_options", false]], "get_orbitals() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.get_orbitals", false]], "get_output_file() (in module psi4.core)": [[202, "psi4.core.get_output_file", false]], "get_pivots() (psi4.core.fittingmetric method)": [[78, "psi4.core.FittingMetric.get_pivots", false]], "get_print() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.get_print", false]], "get_print() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.get_print", false]], "get_psi_results() (psi4.driver.driver_cbs.compositecomputer method)": [[1740, "psi4.driver.driver_cbs.CompositeComputer.get_psi_results", false]], "get_psi_results() (psi4.driver.driver_findif.finitedifferencecomputer method)": [[1772, "psi4.driver.driver_findif.FiniteDifferenceComputer.get_psi_results", false]], "get_psi_results() (psi4.driver.driver_nbody.manybodycomputer method)": [[1794, "psi4.driver.driver_nbody.ManyBodyComputer.get_psi_results", false]], "get_psifile() (in module psi4.driver.p4util)": [[354, "psi4.driver.p4util.get_psifile", false]], "get_psio() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.get_psio", false]], "get_results() (psi4.driver.atomiccomputer method)": [[265, "psi4.driver.AtomicComputer.get_results", false]], "get_results() (psi4.driver.driver_cbs.compositecomputer method)": [[1740, "psi4.driver.driver_cbs.CompositeComputer.get_results", false]], "get_results() (psi4.driver.driver_findif.finitedifferencecomputer method)": [[1772, "psi4.driver.driver_findif.FiniteDifferenceComputer.get_results", false]], "get_results() (psi4.driver.driver_nbody.manybodycomputer method)": [[1794, "psi4.driver.driver_nbody.ManyBodyComputer.get_results", false]], "get_reverse_pivots() (psi4.core.fittingmetric method)": [[78, "psi4.core.FittingMetric.get_reverse_pivots", false]], "get_schwarz_cutoff() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.get_schwarz_cutoff", false]], "get_scratch_filename() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.get_scratch_filename", false]], "get_snlink_max_am() (psi4.core.compositejk method)": [[18, "psi4.core.CompositeJK.get_snLinK_max_am", false]], "get_space_size() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.get_space_size", false]], "get_str() (psi4.core.options method)": [[114, "psi4.core.Options.get_str", false]], "get_tei_already_presorted() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.get_tei_already_presorted", false]], "get_tensor() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.get_tensor", false]], "get_tensor_pqq() (psi4.core.fdds_dispersion method)": [[75, "psi4.core.FDDS_Dispersion.get_tensor_pqQ", false]], "get_tensor_shape() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.get_tensor_shape", false]], "get_tensor_size() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.get_tensor_size", false]], "get_tpdm() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.get_tpdm", false]], "get_variable() (in module psi4.core)": [[203, "psi4.core.get_variable", false]], "get_variable() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.get_variable", false]], "get_variable() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.get_variable", false]], "get_variables() (in module psi4.core)": [[204, "psi4.core.get_variables", false]], "get_wcombine() (psi4.core.jk method)": [[92, "psi4.core.JK.get_wcombine", false]], "get_writer_file_prefix() (in module psi4.core)": [[205, "psi4.core.get_writer_file_prefix", false]], "get_x1() (psi4.core.ls_thc_computer method)": [[94, "psi4.core.LS_THC_Computer.get_x1", false]], "get_x2() (psi4.core.ls_thc_computer method)": [[94, "psi4.core.LS_THC_Computer.get_x2", false]], "get_x3() (psi4.core.ls_thc_computer method)": [[94, "psi4.core.LS_THC_Computer.get_x3", false]], "get_x4() (psi4.core.ls_thc_computer method)": [[94, "psi4.core.LS_THC_Computer.get_x4", false]], "get_z() (psi4.core.ls_thc_computer method)": [[94, "psi4.core.LS_THC_Computer.get_Z", false]], "getattr_ignorecase() (in module psi4.driver.p4util)": [[355, "psi4.driver.p4util.getattr_ignorecase", false]], "getcharges() (psi4.core.externalpotential method)": [[73, "psi4.core.ExternalPotential.getCharges", false]], "getpid() (psi4.core.io method)": [[86, "psi4.core.IO.getpid", false]], "ghost": [[1833, "index-3", false]], "ghost (psi4.core.fragmenttype attribute)": [[79, "psi4.core.FragmentType.Ghost", false]], "ghost atoms": [[1833, "index-3", false]], "gibbs free energy": [[1776, "psivar-GIBBS-FREE-ENERGY", false]], "gibbs free energy correction": [[1776, "psivar-GIBBS-FREE-ENERGY-CORRECTION", false]], "git_version() (in module psi4.core)": [[206, "psi4.core.git_version", false]], "grac_alpha() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.grac_alpha", false]], "grac_beta() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.grac_beta", false]], "grac_shift() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.grac_shift", false]], "gradient": [[1800, "index-0", false]], "gradient() (in module psi4.driver)": [[306, "psi4.driver.gradient", false]], "gradient() (psi4.core.somcscf method)": [[133, "psi4.core.SOMCSCF.gradient", false]], "gradient() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.gradient", false]], "gradient_on_charges() (psi4.core.externalpotential method)": [[73, "psi4.core.ExternalPotential.gradient_on_charges", false]], "gradient_rms() (psi4.core.somcscf method)": [[133, "psi4.core.SOMCSCF.gradient_rms", false]], "gradient_write (findif)": [[1704, "term-GRADIENT_WRITE-FINDIF", true]], "grid electrons alpha": [[1776, "psivar-GRID-ELECTRONS-ALPHA", false]], "grid electrons beta": [[1776, "psivar-GRID-ELECTRONS-BETA", false]], "grid electrons total": [[1776, "psivar-GRID-ELECTRONS-TOTAL", false]], "grid() (psi4.core.vbase method)": [[147, "psi4.core.VBase.grid", false]], "group() (psi4.core.correlationtable method)": [[20, "psi4.core.CorrelationTable.group", false]], "guess (scf)": [[1704, "term-GUESS-SCF", true]], "guess() (psi4.core.hf method)": [[84, "psi4.core.HF.guess", false]], "guess_ca() (psi4.core.hf method)": [[84, "psi4.core.HF.guess_Ca", false]], "guess_cb() (psi4.core.hf method)": [[84, "psi4.core.HF.guess_Cb", false]], "guess_mix (scf)": [[1704, "term-GUESS_MIX-SCF", true]], "guess_persist (scf)": [[1704, "term-GUESS_PERSIST-SCF", true]], "guess_r_convergence (dct)": [[1704, "term-GUESS_R_CONVERGENCE-DCT", true]], "guess_vector (detci)": [[1704, "term-GUESS_VECTOR-DETCI", true]], "h() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.H", false]], "h0_block_coupling (detci)": [[1704, "term-H0_BLOCK_COUPLING-DETCI", true]], "h0_block_coupling_size (detci)": [[1704, "term-H0_BLOCK_COUPLING_SIZE-DETCI", true]], "h0_blocksize (detci)": [[1704, "term-H0_BLOCKSIZE-DETCI", true]], "h0_guess_size (detci)": [[1704, "term-H0_GUESS_SIZE-DETCI", true]], "h_approx_diag() (psi4.core.somcscf method)": [[133, "psi4.core.SOMCSCF.H_approx_diag", false]], "h_bond_connect (optking)": [[1704, "term-H_BOND_CONNECT-OPTKING", true]], "h_guess_every (optking)": [[1704, "term-H_GUESS_EVERY-OPTKING", true]], "h_update_den_tol (optking)": [[1704, "term-H_UPDATE_DEN_TOL-OPTKING", true]], "hamiltonian() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.hamiltonian", false]], "hamiltonian_solver() (in module psi4.driver.p4util)": [[356, "psi4.driver.p4util.hamiltonian_solver", false]], "harmonic vibrational analysis, vibrational analysis, thermochemical analysis": [[1843, "index-0", false]], "harmonic_analysis() (in module psi4.driver.qcdb.vib)": [[386, "psi4.driver.qcdb.vib.harmonic_analysis", false]], "hartree--fock": [[1838, "index-0", false]], "has_array_variable() (in module psi4.core)": [[207, "psi4.core.has_array_variable", false]], "has_array_variable() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.has_array_variable", false]], "has_ecp() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.has_ECP", false]], "has_global_option_changed() (in module psi4.core)": [[208, "psi4.core.has_global_option_changed", false]], "has_local_option_changed() (in module psi4.core)": [[209, "psi4.core.has_local_option_changed", false]], "has_option_changed() (in module psi4.core)": [[210, "psi4.core.has_option_changed", false]], "has_potential_variable() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.has_potential_variable", false]], "has_puream() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.has_puream", false]], "has_scalar_variable() (in module psi4.core)": [[211, "psi4.core.has_scalar_variable", false]], "has_scalar_variable() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.has_scalar_variable", false]], "has_variable() (in module psi4.core)": [[212, "psi4.core.has_variable", false]], "has_variable() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.has_variable", false]], "has_zmatrix() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.has_zmatrix", false]], "hd_avg (detci)": [[1704, "term-HD_AVG-DETCI", true]], "hd_otf (detci)": [[1704, "term-HD_OTF-DETCI", true]], "hd_vector() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.Hd_vector", false]], "heff4 (psimrcc)": [[1704, "term-HEFF4-PSIMRCC", true]], "heff_print (psimrcc)": [[1704, "term-HEFF_PRINT-PSIMRCC", true]], "height (psi4.driver.p4util.inpsight attribute)": [[323, "psi4.driver.p4util.InPsight.height", false]], "hermitivitize() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.hermitivitize", false]], "hermitize() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.hermitize", false]], "hess_type (dfocc)": [[1704, "term-HESS_TYPE-DFOCC", true]], "hess_update (optking)": [[1704, "term-HESS_UPDATE-OPTKING", true]], "hess_update_limit (optking)": [[1704, "term-HESS_UPDATE_LIMIT-OPTKING", true]], "hess_update_limit_max (optking)": [[1704, "term-HESS_UPDATE_LIMIT_MAX-OPTKING", true]], "hess_update_limit_scale (optking)": [[1704, "term-HESS_UPDATE_LIMIT_SCALE-OPTKING", true]], "hess_update_use_last (optking)": [[1704, "term-HESS_UPDATE_USE_LAST-OPTKING", true]], "hessian": [[1772, "index-0", false]], "hessian() (in module psi4.driver)": [[307, "psi4.driver.hessian", false]], "hessian() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.hessian", false]], "hessian_symmetrize() (in module psi4.driver.qcdb.vib)": [[387, "psi4.driver.qcdb.vib.hessian_symmetrize", false]], "hessian_write (findif)": [[1704, "term-HESSIAN_WRITE-FINDIF", true]], "hf": [[1838, "index-0", false]], "hf (class in psi4.core)": [[84, "psi4.core.HF", false]], "hf dipole gradient": [[1776, "psivar-HF-DIPOLE-GRADIENT", false]], "hf kinetic energy": [[1776, "psivar-HF-KINETIC-ENERGY", false]], "hf potential energy": [[1776, "psivar-HF-POTENTIAL-ENERGY", false]], "hf total energy": [[1776, "psivar-HF-TOTAL-ENERGY", false]], "hf total gradient": [[1776, "psivar-HF-TOTAL-GRADIENT", false]], "hf total hessian": [[1776, "psivar-HF-TOTAL-HESSIAN", false]], "hf virial ratio": [[1776, "psivar-HF-VIRIAL-RATIO", false]], "higher-order": [[1837, "index-3", false]], "hold_met() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.hold_met", false]], "hold_options_state() (in module psi4.driver.p4util)": [[357, "psi4.driver.p4util.hold_options_state", false]], "host": [[1738, "index-21", false], [1738, "index-23", false], [1767, "envvar-HOST", false]], "i() (psi4.core.symmetryoperation method)": [[139, "psi4.core.SymmetryOperation.i", false]], "icore (detci)": [[1704, "term-ICORE-DETCI", true]], "id() (psi4.core.orbitalspace method)": [[115, "psi4.core.OrbitalSpace.id", false]], "idamax() (in module psi4.core)": [[85, "psi4.core.IDAMAX", false]], "identity() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.identity", false]], "idfmo() (psi4.core.dftensor method)": [[30, "psi4.core.DFTensor.Idfmo", false]], "imo() (psi4.core.dftensor method)": [[30, "psi4.core.DFTensor.Imo", false]], "import_ignorecase() (in module psi4.driver.p4util)": [[358, "psi4.driver.p4util.import_ignorecase", false]], "incfock (scf)": [[1704, "term-INCFOCK-SCF", true]], "incfock_convergence (scf)": [[1704, "term-INCFOCK_CONVERGENCE-SCF", true]], "incfock_full_fock_every (scf)": [[1704, "term-INCFOCK_FULL_FOCK_EVERY-SCF", true]], "ind() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.ind", false]], "induced_convergence (pe)": [[1704, "term-INDUCED_CONVERGENCE-PE", true]], "induction_operator() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.induction_operator", false]], "inertia_tensor() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.inertia_tensor", false]], "init() (psi4.core.dimension method)": [[64, "psi4.core.Dimension.init", false]], "init() (psi4.core.intvector method)": [[88, "psi4.core.IntVector.init", false]], "init() (psi4.core.vector method)": [[148, "psi4.core.Vector.init", false]], "init_io_files() (psi4.core.civector method)": [[12, "psi4.core.CIVector.init_io_files", false]], "initialize() (in module psi4.core)": [[213, "psi4.core.initialize", false]], "initialize() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.initialize", false]], "initialize() (psi4.core.hf method)": [[84, "psi4.core.HF.initialize", false]], "initialize() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.initialize", false]], "initialize() (psi4.core.jk method)": [[92, "psi4.core.JK.initialize", false]], "initialize() (psi4.core.vbase method)": [[147, "psi4.core.VBase.initialize", false]], "initialize_gtfock_jk() (psi4.core.hf method)": [[84, "psi4.core.HF.initialize_gtfock_jk", false]], "initialize_jk() (psi4.core.hf method)": [[84, "psi4.core.HF.initialize_jk", false]], "initialized_diis_manager_ (psi4.core.hf attribute)": [[84, "psi4.core.HF.initialized_diis_manager_", false]], "inpsight (class in psi4.driver.p4util)": [[323, "psi4.driver.p4util.InPsight", false]], "input_units_to_au() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.input_units_to_au", false]], "insert() (psi4.core.bsvec method)": [[5, "psi4.core.BSVec.insert", false]], "installing": [[1738, "index-0", false]], "intcos_generate_exit (optking)": [[1704, "term-INTCOS_GENERATE_EXIT-OPTKING", true]], "integral() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.integral", false]], "integral() (psi4.core.orbitalspace method)": [[115, "psi4.core.OrbitalSpace.integral", false]], "integral_cutoff (dfocc)": [[1704, "term-INTEGRAL_CUTOFF-DFOCC", true]], "integral_package (globals)": [[1704, "term-INTEGRAL_PACKAGE-GLOBALS", true]], "integralfactory (class in psi4.core)": [[89, "psi4.core.IntegralFactory", false]], "integrals": [[1783, "index-0", false], [1839, "index-0", false]], "integrals() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.integrals", false]], "integrals_erf() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.integrals_erf", false]], "integrals_erfc() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.integrals_erfc", false]], "integraltransform (class in psi4.core)": [[90, "psi4.core.IntegralTransform", false]], "interfrag_collinear_tol (optking)": [[1704, "term-INTERFRAG_COLLINEAR_TOL-OPTKING", true]], "interfrag_coords (optking)": [[1704, "term-INTERFRAG_COORDS-OPTKING", true]], "interfrag_dist_inv (optking)": [[1704, "term-INTERFRAG_DIST_INV-OPTKING", true]], "interfrag_hess (optking)": [[1704, "term-INTERFRAG_HESS-OPTKING", true]], "interfrag_mode (optking)": [[1704, "term-INTERFRAG_MODE-OPTKING", true]], "interfrag_step_limit (optking)": [[1704, "term-INTERFRAG_STEP_LIMIT-OPTKING", true]], "interfragment_connect (optking)": [[1704, "term-INTERFRAGMENT_CONNECT-OPTKING", true]], "internal_rotations (mcscf)": [[1704, "term-INTERNAL_ROTATIONS-MCSCF", true]], "intrafrag_hess (optking)": [[1704, "term-INTRAFRAG_HESS-OPTKING", true]], "intrafrag_step_limit (optking)": [[1704, "term-INTRAFRAG_STEP_LIMIT-OPTKING", true]], "intrafrag_step_limit_max (optking)": [[1704, "term-INTRAFRAG_STEP_LIMIT_MAX-OPTKING", true]], "intrafrag_step_limit_min (optking)": [[1704, "term-INTRAFRAG_STEP_LIMIT_MIN-OPTKING", true]], "ints_tolerance (ccdensity)": [[1704, "term-INTS_TOLERANCE-CCDENSITY", true]], "ints_tolerance (dct)": [[1704, "term-INTS_TOLERANCE-DCT", true]], "ints_tolerance (dfmp2)": [[1704, "term-INTS_TOLERANCE-DFMP2", true]], "ints_tolerance (fisapt)": [[1704, "term-INTS_TOLERANCE-FISAPT", true]], "ints_tolerance (mrcc)": [[1704, "term-INTS_TOLERANCE-MRCC", true]], "ints_tolerance (sapt)": [[1704, "term-INTS_TOLERANCE-SAPT", true]], "ints_tolerance (scf)": [[1704, "term-INTS_TOLERANCE-SCF", true]], "intvector (class in psi4.core)": [[88, "psi4.core.IntVector", false]], "invert() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.invert", false]], "io (class in psi4.core)": [[86, "psi4.core.IO", false]], "iomanager (class in psi4.core)": [[87, "psi4.core.IOManager", false]], "iota() (psi4.core.intvector static method)": [[88, "psi4.core.IntVector.iota", false]], "ip_fitting() (in module psi4.driver.frac)": [[1768, "psi4.driver.frac.ip_fitting", false]], "ip_poles (occ)": [[1704, "term-IP_POLES-OCC", true]], "ipi_broker() (in module psi4.driver)": [[308, "psi4.driver.ipi_broker", false]], "ipibroker (class in psi4.driver.ipi_broker)": [[1768, "psi4.driver.ipi_broker.IPIBroker", false]], "irc": [[1802, "index-2", false]], "irc_direction (optking)": [[1704, "term-IRC_DIRECTION-OPTKING", true]], "irc_points (optking)": [[1704, "term-IRC_POINTS-OPTKING", true]], "irc_step_size (optking)": [[1704, "term-IRC_STEP_SIZE-OPTKING", true]], "irreduciblerepresentation (class in psi4.core)": [[91, "psi4.core.IrreducibleRepresentation", false]], "irrep() (psi4.core.cdsalc method)": [[15, "psi4.core.CdSalc.irrep", false]], "irrep_index() (psi4.core.cdsalc method)": [[15, "psi4.core.CdSalc.irrep_index", false]], "irrep_labels() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.irrep_labels", false]], "is_c_hybrid() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.is_c_hybrid", false]], "is_c_lrc() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.is_c_lrc", false]], "is_c_scs_hybrid() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.is_c_scs_hybrid", false]], "is_cartesian() (psi4.core.gaussianshell method)": [[81, "psi4.core.GaussianShell.is_cartesian", false]], "is_done() (psi4.core.aoshellcombinationsiterator method)": [[3, "psi4.core.AOShellCombinationsIterator.is_done", false]], "is_gga() (psi4.core.functional method)": [[80, "psi4.core.Functional.is_gga", false]], "is_gga() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.is_gga", false]], "is_inverted() (psi4.core.fittingmetric method)": [[78, "psi4.core.FittingMetric.is_inverted", false]], "is_libxc_func() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.is_libxc_func", false]], "is_lrc() (psi4.core.functional method)": [[80, "psi4.core.Functional.is_lrc", false]], "is_meta() (psi4.core.functional method)": [[80, "psi4.core.Functional.is_meta", false]], "is_meta() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.is_meta", false]], "is_poisson() (psi4.core.fittingmetric method)": [[78, "psi4.core.FittingMetric.is_poisson", false]], "is_pure() (psi4.core.gaussianshell method)": [[81, "psi4.core.GaussianShell.is_pure", false]], "is_variable() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.is_variable", false]], "is_x_hybrid() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.is_x_hybrid", false]], "is_x_lrc() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.is_x_lrc", false]], "isa": [[1799, "index-1", false]], "isotope": [[1833, "index-4", false]], "isotopes": [[1833, "index-4", false]], "isotropic_pol (pe)": [[1704, "term-ISOTROPIC_POL-PE", true]], "istop (detci)": [[1704, "term-ISTOP-DETCI", true]], "iteration (psi4.driver.convergenceerror attribute)": [[266, "psi4.driver.ConvergenceError.iteration", false]], "iteration (psi4.driver.optimizationconvergenceerror attribute)": [[270, "psi4.driver.OptimizationConvergenceError.iteration", false]], "iteration (psi4.driver.scfconvergenceerror attribute)": [[276, "psi4.driver.SCFConvergenceError.iteration", false]], "iteration (psi4.driver.tdscfconvergenceerror attribute)": [[277, "psi4.driver.TDSCFConvergenceError.iteration", false]], "iteration_ (psi4.core.hf attribute)": [[84, "psi4.core.HF.iteration_", false]], "iteration_energies (psi4.core.hf attribute)": [[84, "psi4.core.HF.iteration_energies", false]], "iterations() (psi4.core.hf method)": [[84, "psi4.core.HF.iterations", false]], "j() (psi4.core.jk method)": [[92, "psi4.core.JK.J", false]], "jk (class in psi4.core)": [[92, "psi4.core.JK", false]], "jk() (psi4.core.hf method)": [[84, "psi4.core.HF.jk", false]], "jobtype (cclambda)": [[1704, "term-JOBTYPE-CCLAMBDA", true]], "k() (psi4.core.jk method)": [[92, "psi4.core.JK.K", false]], "keywords": [[1740, "index-0", false], [1752, "index-0", false], [1761, "index-0", false], [1766, "index-0", false], [1772, "index-0", false], [1794, "index-1", false], [1800, "index-0", false], [1826, "index-0", false], [1832, "index-2", false], [1833, "index-2", false]], "keywords (psi4.driver.atomiccomputer attribute)": [[265, "psi4.driver.AtomicComputer.keywords", false]], "keywords (psi4.driver.driver_cbs.compositecomputer attribute)": [[1740, "psi4.driver.driver_cbs.CompositeComputer.keywords", false]], "keywords (psi4.driver.driver_nbody.manybodycomputer attribute)": [[1794, "psi4.driver.driver_nbody.ManyBodyComputer.keywords", false]], "kind (adc)": [[1704, "term-KIND-ADC", true]], "kinetic() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.kinetic", false]], "kinetic_grad() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.kinetic_grad", false]], "kineticint (class in psi4.core)": [[93, "psi4.core.KineticInt", false]], "kwargs_lower() (in module psi4.driver.p4util)": [[359, "psi4.driver.p4util.kwargs_lower", false]], "l (psi4.core.localizer attribute)": [[97, "psi4.core.Localizer.L", false]], "label() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.label", false]], "label() (psi4.core.mospace method)": [[98, "psi4.core.MOSpace.label", false]], "lagrangian() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.lagrangian", false]], "laplacedenominator (class in psi4.core)": [[95, "psi4.core.LaplaceDenominator", false]], "lcc2 (+lmp2) total energy": [[1776, "psivar-LCC2-LMP2-TOTAL-ENERGY", false]], "lccd correlation energy": [[1776, "psivar-LCCD-CORRELATION-ENERGY", false]], "lccd doubles energy": [[1776, "psivar-LCCD-DOUBLES-ENERGY", false]], "lccd opposite-spin correlation energy": [[1776, "psivar-LCCD-OPPOSITE-SPIN-CORRELATION-ENERGY", false]], "lccd same-spin correlation energy": [[1776, "psivar-LCCD-SAME-SPIN-CORRELATION-ENERGY", false]], "lccd singles energy": [[1776, "psivar-LCCD-SINGLES-ENERGY", false]], "lccd total energy": [[1776, "psivar-LCCD-TOTAL-ENERGY", false]], "lccsd": [[1771, "index-1", false]], "lccsd (+lmp2) total energy": [[1776, "psivar-LCCSD-LMP2-TOTAL-ENERGY", false]], "lccsd correlation energy": [[1776, "psivar-LCCSD-CORRELATION-ENERGY", false]], "lccsd doubles energy": [[1776, "psivar-LCCSD-DOUBLES-ENERGY", false]], "lccsd opposite-spin correlation energy": [[1776, "psivar-LCCSD-OPPOSITE-SPIN-CORRELATION-ENERGY", false]], "lccsd same-spin correlation energy": [[1776, "psivar-LCCSD-SAME-SPIN-CORRELATION-ENERGY", false]], "lccsd singles energy": [[1776, "psivar-LCCSD-SINGLES-ENERGY", false]], "lccsd total energy": [[1776, "psivar-LCCSD-TOTAL-ENERGY", false]], "left-right cc2 eigenvector overlap": [[1776, "psivar-LEFT-RIGHT-CC2-EIGENVECTOR-OVERLAP", false]], "left-right cc3 eigenvector overlap": [[1776, "psivar-LEFT-RIGHT-CC3-EIGENVECTOR-OVERLAP", false]], "left-right ccsd eigenvector overlap": [[1776, "psivar-LEFT-RIGHT-CCSD-EIGENVECTOR-OVERLAP", false]], "left-right ccsd(t) eigenvector overlap": [[1776, "psivar-LEFT-RIGHT-CCSD-T-EIGENVECTOR-OVERLAP", false]], "level_shift (dfocc)": [[1704, "term-LEVEL_SHIFT-DFOCC", true]], "level_shift (mcscf)": [[1704, "term-LEVEL_SHIFT-MCSCF", true]], "level_shift (occ)": [[1704, "term-LEVEL_SHIFT-OCC", true]], "level_shift (scf)": [[1704, "term-LEVEL_SHIFT-SCF", true]], "level_shift_cutoff (scf)": [[1704, "term-LEVEL_SHIFT_CUTOFF-SCF", true]], "levenshtein() (in module psi4.driver)": [[309, "psi4.driver.levenshtein", false]], "levenshtein() (in module psi4.driver.p4util)": [[360, "psi4.driver.p4util.levenshtein", false]], "libecpint": [[1765, "index-0", false]], "libefp": [[1782, "index-0", false]], "libint": [[1783, "index-0", false]], "libint2_configuration() (in module psi4.driver)": [[310, "psi4.driver.libint2_configuration", false]], "libint2_configuration() (in module psi4.driver.p4util)": [[361, "psi4.driver.p4util.libint2_configuration", false]], "libint2_print_out() (in module psi4.driver)": [[311, "psi4.driver.libint2_print_out", false]], "libint2_print_out() (in module psi4.driver.p4util)": [[362, "psi4.driver.p4util.libint2_print_out", false]], "libint2_solid_harmonics_ordering() (in module psi4.core)": [[214, "psi4.core.libint2_solid_harmonics_ordering", false]], "library fragments": [[1782, "index-1", false], [1782, "index-5", false]], "libxc": [[1784, "index-0", false]], "libxcfunctional (class in psi4.core)": [[96, "psi4.core.LibXCFunctional", false]], "license": [[1781, "index-2", false]], "light (psi4.driver.p4util.inpsight attribute)": [[323, "psi4.driver.p4util.InPsight.light", false]], "light_color (psi4.driver.p4util.inpsight attribute)": [[323, "psi4.driver.p4util.InPsight.light_color", false]], "linear (ccresponse)": [[1704, "term-LINEAR-CCRESPONSE", true]], "lineq_solver (dfocc)": [[1704, "term-LINEQ_SOLVER-DFOCC", true]], "lineshape (class in psi4.driver.p4util)": [[324, "psi4.driver.p4util.Lineshape", false]], "lineshape() (psi4.driver.p4util.gaussian method)": [[322, "psi4.driver.p4util.Gaussian.lineshape", false]], "lineshape() (psi4.driver.p4util.lineshape method)": [[324, "psi4.driver.p4util.Lineshape.lineshape", false]], "lineshape() (psi4.driver.p4util.lorentzian method)": [[325, "psi4.driver.p4util.Lorentzian.lineshape", false]], "link_ints_tolerance (scf)": [[1704, "term-LINK_INTS_TOLERANCE-SCF", true]], "literal_cfour (globals)": [[1704, "term-LITERAL_CFOUR-GLOBALS", true]], "load() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.load", false]], "load() (psi4.core.vector method)": [[148, "psi4.core.Vector.load", false]], "load_mpqc() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.load_mpqc", false]], "local (ccenergy)": [[1704, "term-LOCAL-CCENERGY", true]], "local (cceom)": [[1704, "term-LOCAL-CCEOM", true]], "local (cclambda)": [[1704, "term-LOCAL-CCLAMBDA", true]], "local (ccresponse)": [[1704, "term-LOCAL-CCRESPONSE", true]], "local_convergence (dlpno)": [[1704, "term-LOCAL_CONVERGENCE-DLPNO", true]], "local_convergence (fisapt)": [[1704, "term-LOCAL_CONVERGENCE-FISAPT", true]], "local_convergence (scf)": [[1704, "term-LOCAL_CONVERGENCE-SCF", true]], "local_cphf_cutoff (ccenergy)": [[1704, "term-LOCAL_CPHF_CUTOFF-CCENERGY", true]], "local_cphf_cutoff (cclambda)": [[1704, "term-LOCAL_CPHF_CUTOFF-CCLAMBDA", true]], "local_cphf_cutoff (ccresponse)": [[1704, "term-LOCAL_CPHF_CUTOFF-CCRESPONSE", true]], "local_cutoff (ccenergy)": [[1704, "term-LOCAL_CUTOFF-CCENERGY", true]], "local_cutoff (cceom)": [[1704, "term-LOCAL_CUTOFF-CCEOM", true]], "local_cutoff (cclambda)": [[1704, "term-LOCAL_CUTOFF-CCLAMBDA", true]], "local_cutoff (ccresponse)": [[1704, "term-LOCAL_CUTOFF-CCRESPONSE", true]], "local_do_singles (cceom)": [[1704, "term-LOCAL_DO_SINGLES-CCEOM", true]], "local_filter_singles (cceom)": [[1704, "term-LOCAL_FILTER_SINGLES-CCEOM", true]], "local_filter_singles (cclambda)": [[1704, "term-LOCAL_FILTER_SINGLES-CCLAMBDA", true]], "local_filter_singles (ccresponse)": [[1704, "term-LOCAL_FILTER_SINGLES-CCRESPONSE", true]], "local_ibo_condition (fisapt)": [[1704, "term-LOCAL_IBO_CONDITION-FISAPT", true]], "local_ibo_power (fisapt)": [[1704, "term-LOCAL_IBO_POWER-FISAPT", true]], "local_ibo_stars (fisapt)": [[1704, "term-LOCAL_IBO_STARS-FISAPT", true]], "local_ibo_stars_completeness (fisapt)": [[1704, "term-LOCAL_IBO_STARS_COMPLETENESS-FISAPT", true]], "local_ibo_use_stars (fisapt)": [[1704, "term-LOCAL_IBO_USE_STARS-FISAPT", true]], "local_maxiter (dlpno)": [[1704, "term-LOCAL_MAXITER-DLPNO", true]], "local_maxiter (fisapt)": [[1704, "term-LOCAL_MAXITER-FISAPT", true]], "local_maxiter (scf)": [[1704, "term-LOCAL_MAXITER-SCF", true]], "local_method (ccenergy)": [[1704, "term-LOCAL_METHOD-CCENERGY", true]], "local_method (cceom)": [[1704, "term-LOCAL_METHOD-CCEOM", true]], "local_method (cclambda)": [[1704, "term-LOCAL_METHOD-CCLAMBDA", true]], "local_method (ccresponse)": [[1704, "term-LOCAL_METHOD-CCRESPONSE", true]], "local_pairdef (ccenergy)": [[1704, "term-LOCAL_PAIRDEF-CCENERGY", true]], "local_pairdef (cclambda)": [[1704, "term-LOCAL_PAIRDEF-CCLAMBDA", true]], "local_pairdef (ccresponse)": [[1704, "term-LOCAL_PAIRDEF-CCRESPONSE", true]], "local_preconditioner (cceom)": [[1704, "term-LOCAL_PRECONDITIONER-CCEOM", true]], "local_use_ghosts (fisapt)": [[1704, "term-LOCAL_USE_GHOSTS-FISAPT", true]], "local_weakp (ccenergy)": [[1704, "term-LOCAL_WEAKP-CCENERGY", true]], "local_weakp (cceom)": [[1704, "term-LOCAL_WEAKP-CCEOM", true]], "local_weakp (cclambda)": [[1704, "term-LOCAL_WEAKP-CCLAMBDA", true]], "local_weakp (ccresponse)": [[1704, "term-LOCAL_WEAKP-CCRESPONSE", true]], "localize() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.localize", false]], "localize() (psi4.core.localizer method)": [[97, "psi4.core.Localizer.localize", false]], "localizer (class in psi4.core)": [[97, "psi4.core.Localizer", false]], "location (psi4.driver.p4util.inpsight attribute)": [[323, "psi4.driver.p4util.InPsight.location", false]], "lock_singlet (psimrcc)": [[1704, "term-LOCK_SINGLET-PSIMRCC", true]], "look_at (psi4.driver.p4util.inpsight attribute)": [[323, "psi4.driver.p4util.InPsight.look_at", false]], "lorentzian (class in psi4.driver.p4util)": [[325, "psi4.driver.p4util.Lorentzian", false]], "lowdin charges": [[1776, "psivar-LOWDIN-CHARGES", false]], "lowertriangle (psi4.core.savetype attribute)": [[135, "psi4.core.SaveType.LowerTriangle", false]], "ls_thc_basis_tolerance (globals)": [[1704, "term-LS_THC_BASIS_TOLERANCE-GLOBALS", true]], "ls_thc_computer (class in psi4.core)": [[94, "psi4.core.LS_THC_Computer", false]], "ls_thc_df (globals)": [[1704, "term-LS_THC_DF-GLOBALS", true]], "ls_thc_pruning_scheme (globals)": [[1704, "term-LS_THC_PRUNING_SCHEME-GLOBALS", true]], "ls_thc_radial_points (globals)": [[1704, "term-LS_THC_RADIAL_POINTS-GLOBALS", true]], "ls_thc_s_epsilon (globals)": [[1704, "term-LS_THC_S_EPSILON-GLOBALS", true]], "ls_thc_spherical_points (globals)": [[1704, "term-LS_THC_SPHERICAL_POINTS-GLOBALS", true]], "ls_thc_weights_tolerance (globals)": [[1704, "term-LS_THC_WEIGHTS_TOLERANCE-GLOBALS", true]], "lsda_cutoff() (psi4.core.functional method)": [[80, "psi4.core.Functional.lsda_cutoff", false]], "lse (detci)": [[1704, "term-LSE-DETCI", true]], "lse_collapse (detci)": [[1704, "term-LSE_COLLAPSE-DETCI", true]], "lse_tolerance (detci)": [[1704, "term-LSE_TOLERANCE-DETCI", true]], "madmp2_sleep (dfmp2)": [[1704, "term-MADMP2_SLEEP-DFMP2", true]], "make_filename() (psi4.core.basisset static method)": [[8, "psi4.core.BasisSet.make_filename", false]], "managedmethoderror": [[268, "psi4.driver.ManagedMethodError", false]], "mark_file_for_retention() (psi4.core.iomanager method)": [[87, "psi4.core.IOManager.mark_file_for_retention", false]], "mass() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.mass", false]], "mass_number() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.mass_number", false]], "mat2arr() (in module psi4.driver.p4util)": [[363, "psi4.driver.p4util.mat2arr", false]], "mat_num_column_print (globals)": [[1704, "term-MAT_NUM_COLUMN_PRINT-GLOBALS", true]], "math_root": [[1738, "envvar-MATH_ROOT", false]], "matrices() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.matrices", false]], "matrix (class in psi4.core)": [[100, "psi4.core.Matrix", false]], "matrix() (psi4.core.cdsalclist method)": [[16, "psi4.core.CdSalcList.matrix", false]], "matrix() (psi4.core.symmetryoperation method)": [[139, "psi4.core.SymmetryOperation.matrix", false]], "matrix_irrep() (psi4.core.cdsalclist method)": [[16, "psi4.core.CdSalcList.matrix_irrep", false]], "matrixfactory (class in psi4.core)": [[101, "psi4.core.MatrixFactory", false]], "max() (psi4.core.dimension method)": [[64, "psi4.core.Dimension.max", false]], "max_am() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.max_am", false]], "max_attempts (scf)": [[1704, "term-MAX_ATTEMPTS-SCF", true]], "max_ccd_diisvecs (sapt)": [[1704, "term-MAX_CCD_DIISVECS-SAPT", true]], "max_disp_g_convergence (optking)": [[1704, "term-MAX_DISP_G_CONVERGENCE-OPTKING", true]], "max_energy_g_convergence (optking)": [[1704, "term-MAX_ENERGY_G_CONVERGENCE-OPTKING", true]], "max_force_g_convergence (optking)": [[1704, "term-MAX_FORCE_G_CONVERGENCE-OPTKING", true]], "max_function_per_shell() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.max_function_per_shell", false]], "max_functions() (psi4.core.basisfunctions method)": [[7, "psi4.core.BasisFunctions.max_functions", false]], "max_functions() (psi4.core.moleculargrid method)": [[105, "psi4.core.MolecularGrid.max_functions", false]], "max_mem_buf (scf)": [[1704, "term-MAX_MEM_BUF-SCF", true]], "max_mograd_convergence (dfocc)": [[1704, "term-MAX_MOGRAD_CONVERGENCE-DFOCC", true]], "max_mograd_convergence (occ)": [[1704, "term-MAX_MOGRAD_CONVERGENCE-OCC", true]], "max_nbody (psi4.driver.driver_nbody.manybodycomputer attribute)": [[1794, "psi4.driver.driver_nbody.ManyBodyComputer.max_nbody", false]], "max_nprimitive() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.max_nprimitive", false]], "max_num_vecs (adc)": [[1704, "term-MAX_NUM_VECS-ADC", true]], "max_num_vecs (detci)": [[1704, "term-MAX_NUM_VECS-DETCI", true]], "max_points() (psi4.core.basisfunctions method)": [[7, "psi4.core.BasisFunctions.max_points", false]], "max_points() (psi4.core.moleculargrid method)": [[105, "psi4.core.MolecularGrid.max_points", false]], "max_points() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.max_points", false]], "max_radial_moment (globals)": [[1704, "term-MAX_RADIAL_MOMENT-GLOBALS", true]], "maximum() (psi4.driver.p4util.gaussian method)": [[322, "psi4.driver.p4util.Gaussian.maximum", false]], "maximum() (psi4.driver.p4util.lineshape method)": [[324, "psi4.driver.p4util.Lineshape.maximum", false]], "maximum() (psi4.driver.p4util.lorentzian method)": [[325, "psi4.driver.p4util.Lorentzian.maximum", false]], "maxiter (adc)": [[1704, "term-MAXITER-ADC", true]], "maxiter (ccenergy)": [[1704, "term-MAXITER-CCENERGY", true]], "maxiter (cceom)": [[1704, "term-MAXITER-CCEOM", true]], "maxiter (cclambda)": [[1704, "term-MAXITER-CCLAMBDA", true]], "maxiter (ccresponse)": [[1704, "term-MAXITER-CCRESPONSE", true]], "maxiter (dct)": [[1704, "term-MAXITER-DCT", true]], "maxiter (fisapt)": [[1704, "term-MAXITER-FISAPT", true]], "maxiter (fnocc)": [[1704, "term-MAXITER-FNOCC", true]], "maxiter (mcscf)": [[1704, "term-MAXITER-MCSCF", true]], "maxiter (pe)": [[1704, "term-MAXITER-PE", true]], "maxiter (psimrcc)": [[1704, "term-MAXITER-PSIMRCC", true]], "maxiter (sapt)": [[1704, "term-MAXITER-SAPT", true]], "maxiter (scf)": [[1704, "term-MAXITER-SCF", true]], "maxr() (psi4.core.basisextents method)": [[6, "psi4.core.BasisExtents.maxR", false]], "mayer indices": [[1776, "psivar-MAYER-INDICES", false]], "mbis": [[1799, "index-1", false]], "mbis charges": [[1776, "psivar-MBIS-CHARGES", false]], "mbis dipoles": [[1776, "psivar-MBIS-DIPOLES", false]], "mbis free atom n volume": [[1776, "psivar-MBIS-FREE-ATOM-n-VOLUME", false]], "mbis octupoles": [[1776, "psivar-MBIS-OCTUPOLES", false]], "mbis quadrupoles": [[1776, "psivar-MBIS-QUADRUPOLES", false]], "mbis radial moments <r^3>": [[1776, "psivar-MBIS-RADIAL-MOMENTS-R-3", false]], "mbis valence widths": [[1776, "psivar-MBIS-VALENCE-WIDTHS", false]], "mbis volume ratios": [[1776, "psivar-MBIS-VOLUME-RATIOS", false]], "mbis_d_convergence (globals)": [[1704, "term-MBIS_D_CONVERGENCE-GLOBALS", true]], "mbis_maxiter (globals)": [[1704, "term-MBIS_MAXITER-GLOBALS", true]], "mbis_pruning_scheme (globals)": [[1704, "term-MBIS_PRUNING_SCHEME-GLOBALS", true]], "mbis_radial_points (globals)": [[1704, "term-MBIS_RADIAL_POINTS-GLOBALS", true]], "mbis_spherical_points (globals)": [[1704, "term-MBIS_SPHERICAL_POINTS-GLOBALS", true]], "mcscf": [[1789, "index-0", false], [1789, "index-1", false]], "mcscf total energy": [[1776, "psivar-MCSCF-TOTAL-ENERGY", false]], "mcscf() (in module psi4.core)": [[215, "psi4.core.mcscf", false]], "mcscf_algorithm (detci)": [[1704, "term-MCSCF_ALGORITHM-DETCI", true]], "mcscf_ci_cleanup (detci)": [[1704, "term-MCSCF_CI_CLEANUP-DETCI", true]], "mcscf_diis_error_type (detci)": [[1704, "term-MCSCF_DIIS_ERROR_TYPE-DETCI", true]], "mcscf_diis_freq (detci)": [[1704, "term-MCSCF_DIIS_FREQ-DETCI", true]], "mcscf_diis_max_vecs (detci)": [[1704, "term-MCSCF_DIIS_MAX_VECS-DETCI", true]], "mcscf_diis_start (detci)": [[1704, "term-MCSCF_DIIS_START-DETCI", true]], "mcscf_dpd_cleanup (detci)": [[1704, "term-MCSCF_DPD_CLEANUP-DETCI", true]], "mcscf_e_convergence (detci)": [[1704, "term-MCSCF_E_CONVERGENCE-DETCI", true]], "mcscf_guess (detci)": [[1704, "term-MCSCF_GUESS-DETCI", true]], "mcscf_max_rot (detci)": [[1704, "term-MCSCF_MAX_ROT-DETCI", true]], "mcscf_maxiter (detci)": [[1704, "term-MCSCF_MAXITER-DETCI", true]], "mcscf_object() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.mcscf_object", false]], "mcscf_r_convergence (detci)": [[1704, "term-MCSCF_R_CONVERGENCE-DETCI", true]], "mcscf_rotate (detci)": [[1704, "term-MCSCF_ROTATE-DETCI", true]], "mcscf_so_start_e (detci)": [[1704, "term-MCSCF_SO_START_E-DETCI", true]], "mcscf_so_start_grad (detci)": [[1704, "term-MCSCF_SO_START_GRAD-DETCI", true]], "mcscf_type (detci)": [[1704, "term-MCSCF_TYPE-DETCI", true]], "mdi_run() (in module psi4.driver)": [[312, "psi4.driver.mdi_run", false]], "memdfjk (class in psi4.core)": [[102, "psi4.core.MemDFJK", false]], "memory": [[1832, "index-1", false]], "memory_estimate() (psi4.core.jk method)": [[92, "psi4.core.JK.memory_estimate", false]], "message (psi4.driver.convergenceerror attribute)": [[266, "psi4.driver.ConvergenceError.message", false]], "message (psi4.driver.managedmethoderror attribute)": [[268, "psi4.driver.ManagedMethodError.message", false]], "message (psi4.driver.missingmethoderror attribute)": [[269, "psi4.driver.MissingMethodError.message", false]], "message (psi4.driver.optimizationconvergenceerror attribute)": [[270, "psi4.driver.OptimizationConvergenceError.message", false]], "message (psi4.driver.scfconvergenceerror attribute)": [[276, "psi4.driver.SCFConvergenceError.message", false]], "message (psi4.driver.tdscfconvergenceerror attribute)": [[277, "psi4.driver.TDSCFConvergenceError.message", false]], "message (psi4.driver.testcomparisonerror attribute)": [[278, "psi4.driver.TestComparisonError.message", false]], "message (psi4.driver.validationerror attribute)": [[280, "psi4.driver.ValidationError.message", false]], "message_box() (in module psi4.driver)": [[313, "psi4.driver.message_box", false]], "message_box() (in module psi4.driver.p4util)": [[364, "psi4.driver.p4util.message_box", false]], "meta_cutoff() (psi4.core.functional method)": [[80, "psi4.core.Functional.meta_cutoff", false]], "metadata (psi4.driver.driver_cbs.compositecomputer attribute)": [[1740, "psi4.driver.driver_cbs.CompositeComputer.metadata", false]], "metameta (psi4.driver.driver_cbs.compositecomputer attribute)": [[1740, "psi4.driver.driver_cbs.CompositeComputer.metameta", false]], "metameta (psi4.driver.driver_findif.finitedifferencecomputer attribute)": [[1772, "psi4.driver.driver_findif.FiniteDifferenceComputer.metameta", false]], "method (psi4.driver.atomiccomputer attribute)": [[265, "psi4.driver.AtomicComputer.method", false]], "method (psi4.driver.driver_cbs.compositecomputer attribute)": [[1740, "psi4.driver.driver_cbs.CompositeComputer.method", false]], "method (psi4.driver.driver_findif.finitedifferencecomputer attribute)": [[1772, "psi4.driver.driver_findif.FiniteDifferenceComputer.method", false]], "method (psi4.driver.driver_nbody.manybodycomputer attribute)": [[1794, "psi4.driver.driver_nbody.ManyBodyComputer.method", false]], "method alias": [[1834, "index-0", false]], "metric() (psi4.core.fdds_dispersion method)": [[75, "psi4.core.FDDS_Dispersion.metric", false]], "metric_inv() (psi4.core.fdds_dispersion method)": [[75, "psi4.core.FDDS_Dispersion.metric_inv", false]], "min_ccd_diisvecs (sapt)": [[1704, "term-MIN_CCD_DIISVECS-SAPT", true]], "minao_basis (fisapt)": [[1704, "term-MINAO_BASIS-FISAPT", true]], "minima": [[1802, "index-1", false]], "mintshelper (class in psi4.core)": [[103, "psi4.core.MintsHelper", false]], "mintshelper() (psi4.core.cuhf method)": [[14, "psi4.core.CUHF.mintshelper", false]], "mintshelper() (psi4.core.rhf method)": [[128, "psi4.core.RHF.mintshelper", false]], "mintshelper() (psi4.core.rohf method)": [[130, "psi4.core.ROHF.mintshelper", false]], "mintshelper() (psi4.core.uhf method)": [[145, "psi4.core.UHF.mintshelper", false]], "mintshelper() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.mintshelper", false]], "missingmethoderror": [[269, "psi4.driver.MissingMethodError", false]], "mixed (detci)": [[1704, "term-MIXED-DETCI", true]], "mixed4 (detci)": [[1704, "term-MIXED4-DETCI", true]], "mk-mrcc": [[1829, "index-0", false]], "mkl_num_threads": [[1767, "envvar-MKL_NUM_THREADS", false], [1767, "index-8", false]], "mkl_root": [[1738, "envvar-MKL_ROOT", false]], "mo_diis_num_vecs (dfocc)": [[1704, "term-MO_DIIS_NUM_VECS-DFOCC", true]], "mo_elec_dip_deriv1() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.mo_elec_dip_deriv1", false]], "mo_erf_eri() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.mo_erf_eri", false]], "mo_eri() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.mo_eri", false]], "mo_extents() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.mo_extents", false]], "mo_f12() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.mo_f12", false]], "mo_f12_double_commutator() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.mo_f12_double_commutator", false]], "mo_f12_squared() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.mo_f12_squared", false]], "mo_f12g12() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.mo_f12g12", false]], "mo_maxiter (dfocc)": [[1704, "term-MO_MAXITER-DFOCC", true]], "mo_maxiter (occ)": [[1704, "term-MO_MAXITER-OCC", true]], "mo_oei_deriv1() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.mo_oei_deriv1", false]], "mo_oei_deriv2() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.mo_oei_deriv2", false]], "mo_overlap_half_deriv1() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.mo_overlap_half_deriv1", false]], "mo_read (mcscf)": [[1704, "term-MO_READ-MCSCF", true]], "mo_read (occ)": [[1704, "term-MO_READ-OCC", true]], "mo_spin_eri() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.mo_spin_eri", false]], "mo_step_max (dfocc)": [[1704, "term-MO_STEP_MAX-DFOCC", true]], "mo_step_max (occ)": [[1704, "term-MO_STEP_MAX-OCC", true]], "mo_tei_deriv1() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.mo_tei_deriv1", false]], "mo_tei_deriv2() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.mo_tei_deriv2", false]], "mo_transform() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.mo_transform", false]], "mo_write (occ)": [[1704, "term-MO_WRITE-OCC", true]], "module": [[1772, "module-psi4.driver.qcdb.vib", false], [1827, "module-psi4.core", false], [1827, "module-psi4.driver", false], [1827, "module-psi4.driver.p4util", false]], "module (cphf)": [[1704, "term-MODULE-CPHF", true]], "module() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.module", false]], "mofa() (psi4.core.rohf method)": [[130, "psi4.core.ROHF.moFa", false]], "mofb() (psi4.core.rohf method)": [[130, "psi4.core.ROHF.moFb", false]], "mofeff() (psi4.core.rohf method)": [[130, "psi4.core.ROHF.moFeff", false]], "mograd_damping (occ)": [[1704, "term-MOGRAD_DAMPING-OCC", true]], "molden": [[1791, "index-0", false]], "molden() (in module psi4.driver)": [[314, "psi4.driver.molden", false]], "molden_with_virtual (globals)": [[1704, "term-MOLDEN_WITH_VIRTUAL-GLOBALS", true]], "molden_write (dfocc)": [[1704, "term-MOLDEN_WRITE-DFOCC", true]], "molden_write (scf)": [[1704, "term-MOLDEN_WRITE-SCF", true]], "moldenwriter (class in psi4.core)": [[104, "psi4.core.MoldenWriter", false]], "molecular_charge() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.molecular_charge", false]], "moleculargrid (class in psi4.core)": [[105, "psi4.core.MolecularGrid", false]], "molecule": [[1782, "index-4", false], [1833, "index-0", false], [1833, "index-1", false], [1833, "index-2", false], [1833, "index-3", false], [1833, "index-4", false], [1833, "index-5", false], [1833, "index-7", false]], "molecule (class in psi4.core)": [[106, "psi4.core.Molecule", false]], "molecule (class in psi4.driver.qcdb)": [[1768, "psi4.driver.qcdb.Molecule", false]], "molecule (psi4.driver.atomiccomputer attribute)": [[265, "psi4.driver.AtomicComputer.molecule", false]], "molecule (psi4.driver.driver_cbs.compositecomputer attribute)": [[1740, "psi4.driver.driver_cbs.CompositeComputer.molecule", false]], "molecule (psi4.driver.driver_findif.finitedifferencecomputer attribute)": [[1772, "psi4.driver.driver_findif.FiniteDifferenceComputer.molecule", false]], "molecule (psi4.driver.driver_nbody.manybodycomputer attribute)": [[1794, "psi4.driver.driver_nbody.ManyBodyComputer.molecule", false]], "molecule specification": [[1782, "index-4", false]], "molecule() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.molecule", false]], "molecule() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.molecule", false]], "molecule() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.molecule", false]], "molecule_get_attr() (in module psi4.driver)": [[315, "psi4.driver.molecule_get_attr", false]], "molecule_set_attr() (in module psi4.driver)": [[316, "psi4.driver.molecule_set_attr", false]], "mom": [[1838, "index-2", false]], "mom_excited_ (psi4.core.hf attribute)": [[84, "psi4.core.HF.MOM_excited_", false]], "mom_occ (scf)": [[1704, "term-MOM_OCC-SCF", true]], "mom_performed_ (psi4.core.hf attribute)": [[84, "psi4.core.HF.MOM_performed_", false]], "mom_start (scf)": [[1704, "term-MOM_START-SCF", true]], "mom_vir (scf)": [[1704, "term-MOM_VIR-SCF", true]], "montage": [[1750, "envvar-MONTAGE", false], [1750, "index-2", false]], "mospace (class in psi4.core)": [[98, "psi4.core.MOSpace", false]], "move_atom() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.move_atom", false]], "move_to_com() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.move_to_com", false]], "mowriter (class in psi4.core)": [[99, "psi4.core.MOWriter", false]], "mp2": [[1756, "index-0", false]], "mp2 alpha-alpha pair energies": [[1776, "psivar-MP2-ALPHA-ALPHA-PAIR-ENERGIES", false]], "mp2 alpha-beta pair energies": [[1776, "psivar-MP2-ALPHA-BETA-PAIR-ENERGIES", false]], "mp2 correlation energy": [[1776, "psivar-MP2-CORRELATION-ENERGY", false]], "mp2 dipole gradient": [[1776, "psivar-MP2-DIPOLE-GRADIENT", false]], "mp2 doubles energy": [[1776, "psivar-MP2-DOUBLES-ENERGY", false]], "mp2 opposite-spin correlation energy": [[1776, "psivar-MP2-OPPOSITE-SPIN-CORRELATION-ENERGY", false]], "mp2 same-spin correlation energy": [[1776, "psivar-MP2-SAME-SPIN-CORRELATION-ENERGY", false]], "mp2 singles energy": [[1776, "psivar-MP2-SINGLES-ENERGY", false]], "mp2 singlet pair energies": [[1776, "psivar-MP2-SINGLET-PAIR-ENERGIES", false]], "mp2 total energy": [[1776, "psivar-MP2-TOTAL-ENERGY", false]], "mp2 total gradient": [[1776, "psivar-MP2-TOTAL-GRADIENT", false]], "mp2 total hessian": [[1776, "psivar-MP2-TOTAL-HESSIAN", false]], "mp2 triplet pair energies": [[1776, "psivar-MP2-TRIPLET-PAIR-ENERGIES", false]], "mp2-ccsd total energy": [[1776, "psivar-MP2-CCSD-TOTAL-ENERGY", false]], "mp2.5 correlation energy": [[1776, "psivar-MP2.5-CORRELATION-ENERGY", false]], "mp2.5 doubles energy": [[1776, "psivar-MP2.5-DOUBLES-ENERGY", false]], "mp2.5 opposite-spin correlation energy": [[1776, "psivar-MP2.5-OPPOSITE-SPIN-CORRELATION-ENERGY", false]], "mp2.5 same-spin correlation energy": [[1776, "psivar-MP2.5-SAME-SPIN-CORRELATION-ENERGY", false]], "mp2.5 singles energy": [[1776, "psivar-MP2.5-SINGLES-ENERGY", false]], "mp2.5 total energy": [[1776, "psivar-MP2.5-TOTAL-ENERGY", false]], "mp2_amp_type (dfocc)": [[1704, "term-MP2_AMP_TYPE-DFOCC", true]], "mp2_amps_print (ccenergy)": [[1704, "term-MP2_AMPS_PRINT-CCENERGY", true]], "mp2_ccsd_method (psimrcc)": [[1704, "term-MP2_CCSD_METHOD-PSIMRCC", true]], "mp2_guess (psimrcc)": [[1704, "term-MP2_GUESS-PSIMRCC", true]], "mp2_os_scale (ccenergy)": [[1704, "term-MP2_OS_SCALE-CCENERGY", true]], "mp2_os_scale (dfmp2)": [[1704, "term-MP2_OS_SCALE-DFMP2", true]], "mp2_os_scale (dfocc)": [[1704, "term-MP2_OS_SCALE-DFOCC", true]], "mp2_os_scale (occ)": [[1704, "term-MP2_OS_SCALE-OCC", true]], "mp2_scale_os (fnocc)": [[1704, "term-MP2_SCALE_OS-FNOCC", true]], "mp2_scale_ss (fnocc)": [[1704, "term-MP2_SCALE_SS-FNOCC", true]], "mp2_sos_scale (dfocc)": [[1704, "term-MP2_SOS_SCALE-DFOCC", true]], "mp2_sos_scale (occ)": [[1704, "term-MP2_SOS_SCALE-OCC", true]], "mp2_sos_scale2 (dfocc)": [[1704, "term-MP2_SOS_SCALE2-DFOCC", true]], "mp2_sos_scale2 (occ)": [[1704, "term-MP2_SOS_SCALE2-OCC", true]], "mp2_ss_scale (ccenergy)": [[1704, "term-MP2_SS_SCALE-CCENERGY", true]], "mp2_ss_scale (dfmp2)": [[1704, "term-MP2_SS_SCALE-DFMP2", true]], "mp2_ss_scale (dfocc)": [[1704, "term-MP2_SS_SCALE-DFOCC", true]], "mp2_ss_scale (occ)": [[1704, "term-MP2_SS_SCALE-OCC", true]], "mp2_type (globals)": [[1704, "term-MP2_TYPE-GLOBALS", true]], "mp3 correlation energy": [[1776, "psivar-MP3-CORRELATION-ENERGY", false]], "mp3 doubles energy": [[1776, "psivar-MP3-DOUBLES-ENERGY", false]], "mp3 opposite-spin correlation energy": [[1776, "psivar-MP3-OPPOSITE-SPIN-CORRELATION-ENERGY", false]], "mp3 same-spin correlation energy": [[1776, "psivar-MP3-SAME-SPIN-CORRELATION-ENERGY", false]], "mp3 singles energy": [[1776, "psivar-MP3-SINGLES-ENERGY", false]], "mp3 total energy": [[1776, "psivar-MP3-TOTAL-ENERGY", false]], "mp4": [[1771, "index-1", false]], "mp4 correlation energy": [[1776, "psivar-MP4-CORRELATION-ENERGY", false]], "mp4 total energy": [[1776, "psivar-MP4-TOTAL-ENERGY", false]], "mp4(sdq) correlation energy": [[1776, "psivar-MP4-SDQ-CORRELATION-ENERGY", false]], "mp4(sdq) total energy": [[1776, "psivar-MP4-SDQ-TOTAL-ENERGY", false]], "mp4(sdtq) correlation energy": [[1776, "psivar-MP4-SDTQ-CORRELATION-ENERGY", false]], "mp4(sdtq) total energy": [[1776, "psivar-MP4-SDTQ-TOTAL-ENERGY", false]], "mp4(t) correction energy": [[1776, "psivar-MP4-T-CORRECTION-ENERGY", false]], "mp_type (globals)": [[1704, "term-MP_TYPE-GLOBALS", true]], "mpn (detci)": [[1704, "term-MPN-DETCI", true]], "mpn correlation energy": [[1776, "psivar-MPn-CORRELATION-ENERGY", false]], "mpn total energy": [[1776, "psivar-MPn-TOTAL-ENERGY", false]], "mpn_order_save (detci)": [[1704, "term-MPN_ORDER_SAVE-DETCI", true]], "mpn_schmidt (detci)": [[1704, "term-MPN_SCHMIDT-DETCI", true]], "mpn_wigner (detci)": [[1704, "term-MPN_WIGNER-DETCI", true]], "mrcc": [[1792, "index-0", false]], "mrcc total energy": [[1776, "psivar-MRCC-TOTAL-ENERGY", false]], "mrcc_generate_input() (in module psi4.core)": [[216, "psi4.core.mrcc_generate_input", false]], "mrcc_level (mrcc)": [[1704, "term-MRCC_LEVEL-MRCC", true]], "mrcc_load_densities() (in module psi4.core)": [[217, "psi4.core.mrcc_load_densities", false]], "mrcc_method (mrcc)": [[1704, "term-MRCC_METHOD-MRCC", true]], "mrcc_num_doublet_roots (mrcc)": [[1704, "term-MRCC_NUM_DOUBLET_ROOTS-MRCC", true]], "mrcc_num_singlet_roots (mrcc)": [[1704, "term-MRCC_NUM_SINGLET_ROOTS-MRCC", true]], "mrcc_num_triplet_roots (mrcc)": [[1704, "term-MRCC_NUM_TRIPLET_ROOTS-MRCC", true]], "mrcc_omp_num_threads (mrcc)": [[1704, "term-MRCC_OMP_NUM_THREADS-MRCC", true]], "mrcc_restart (mrcc)": [[1704, "term-MRCC_RESTART-MRCC", true]], "mrpt total energy": [[1776, "psivar-MRPT-TOTAL-ENERGY", false]], "ms0 (detci)": [[1704, "term-MS0-DETCI", true]], "mtd 128-pole": [[1776, "psivar-mtd-128-POLE", false]], "mtd 32-pole": [[1776, "psivar-mtd-32-POLE", false]], "mtd 64-pole": [[1776, "psivar-mtd-64-POLE", false]], "mtd dipole": [[1776, "psivar-mtd-DIPOLE", false]], "mtd hexadecapole": [[1776, "psivar-mtd-HEXADECAPOLE", false]], "mtd octupole": [[1776, "psivar-mtd-OCTUPOLE", false]], "mtd quadrupole": [[1776, "psivar-mtd-QUADRUPOLE", false]], "mulliken charges": [[1776, "psivar-MULLIKEN-CHARGES", false]], "multi-configurational self-consistent-field": [[1789, "index-2", false]], "multiple fragments": [[1833, "index-7", false]], "multiple in input file": [[1833, "index-1", false]], "multiple within molecule": [[1730, "index-1", false]], "multiplicity": [[1833, "index-2", false]], "multiplicity() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.multiplicity", false]], "multipole_grad() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.multipole_grad", false]], "multipoleint (class in psi4.core)": [[107, "psi4.core.MultipoleInt", false]], "multipolesymmetry (class in psi4.core)": [[108, "psi4.core.MultipoleSymmetry", false]], "multireference": [[1829, "index-0", false]], "n() (psi4.core.correlationtable method)": [[20, "psi4.core.CorrelationTable.n", false]], "n() (psi4.core.dimension method)": [[64, "psi4.core.Dimension.n", false]], "n_ecp_core() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.n_ecp_core", false]], "n_ecp_shell_on_center() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.n_ecp_shell_on_center", false]], "n_frozen_core() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.n_frozen_core", false]], "nablaint (class in psi4.core)": [[109, "psi4.core.NablaInt", false]], "nallatom() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.nallatom", false]], "nalpha() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.nalpha", false]], "nalphapi() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.nalphapi", false]], "name (psi4.core.derivcalctype attribute)": [[62, "psi4.core.DerivCalcType.name", false]], "name (psi4.core.diagonalizeorder attribute)": [[63, "psi4.core.DiagonalizeOrder.name", false]], "name (psi4.core.dimension attribute)": [[64, "psi4.core.Dimension.name", false]], "name (psi4.core.fragmenttype attribute)": [[79, "psi4.core.FragmentType.name", false]], "name (psi4.core.gaussiantype attribute)": [[82, "psi4.core.GaussianType.name", false]], "name (psi4.core.geometryunits attribute)": [[83, "psi4.core.GeometryUnits.name", false]], "name (psi4.core.intvector attribute)": [[88, "psi4.core.IntVector.name", false]], "name (psi4.core.matrix attribute)": [[100, "psi4.core.Matrix.name", false]], "name (psi4.core.primitivetype attribute)": [[122, "psi4.core.PrimitiveType.name", false]], "name (psi4.core.psireturntype attribute)": [[126, "psi4.core.PsiReturnType.name", false]], "name (psi4.core.savetype attribute)": [[135, "psi4.core.SaveType.name", false]], "name (psi4.core.vector attribute)": [[148, "psi4.core.Vector.name", false]], "name() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.name", false]], "name() (psi4.core.dispersion method)": [[68, "psi4.core.Dispersion.name", false]], "name() (psi4.core.functional method)": [[80, "psi4.core.Functional.name", false]], "name() (psi4.core.jk method)": [[92, "psi4.core.JK.name", false]], "name() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.name", false]], "name() (psi4.core.orbitalspace method)": [[115, "psi4.core.OrbitalSpace.name", false]], "name() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.name", false]], "name() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.name", false]], "nao() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.nao", false]], "nat_orbs (detci)": [[1704, "term-NAT_ORBS-DETCI", true]], "nat_orbs (dfocc)": [[1704, "term-NAT_ORBS-DFOCC", true]], "nat_orbs (fnocc)": [[1704, "term-NAT_ORBS-FNOCC", true]], "nat_orbs (occ)": [[1704, "term-NAT_ORBS-OCC", true]], "nat_orbs_t2 (sapt)": [[1704, "term-NAT_ORBS_T2-SAPT", true]], "nat_orbs_t3 (sapt)": [[1704, "term-NAT_ORBS_T3-SAPT", true]], "nat_orbs_v4 (sapt)": [[1704, "term-NAT_ORBS_V4-SAPT", true]], "natom() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.natom", false]], "naux (cc)": [[1776, "psivar-NAUX-CC", false]], "naux (scf)": [[1776, "psivar-NAUX-SCF", false]], "nbeta() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.nbeta", false]], "nbetapi() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.nbetapi", false]], "nbf() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.nbf", false]], "nbf() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.nbf", false]], "nblocks() (psi4.core.vbase method)": [[147, "psi4.core.VBase.nblocks", false]], "nbodies_per_mc_level (psi4.driver.driver_nbody.manybodycomputer attribute)": [[1794, "psi4.driver.driver_nbody.ManyBodyComputer.nbodies_per_mc_level", false]], "nbody (i, j, ..., k)@(a, b, ..., c) total energy": [[1776, "psivar-NBODY-i-j-...-k-a-b-...-c-TOTAL-ENERGY", false]], "nbody number": [[1776, "psivar-NBODY-NUMBER", false]], "nbody() (in module psi4.driver.driver_nbody)": [[1794, "psi4.driver.driver_nbody.nbody", false]], "ncartesian (psi4.core.gaussianshell attribute)": [[81, "psi4.core.GaussianShell.ncartesian", false]], "ncd() (psi4.core.cdsalclist method)": [[16, "psi4.core.CdSalcList.ncd", false]], "ncenter (psi4.core.gaussianshell attribute)": [[81, "psi4.core.GaussianShell.ncenter", false]], "ndet() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.ndet", false]], "needs_grac() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.needs_grac", false]], "needs_vv10() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.needs_vv10", false]], "needs_xc() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.needs_xc", false]], "new_civector() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.new_civector", false]], "new_triples (ccenergy)": [[1704, "term-NEW_TRIPLES-CCENERGY", true]], "new_triples (cceom)": [[1704, "term-NEW_TRIPLES-CCEOM", true]], "new_vector() (psi4.driver.p4util.solverengine method)": [[329, "psi4.driver.p4util.SolverEngine.new_vector", false]], "next() (psi4.core.aoshellcombinationsiterator method)": [[3, "psi4.core.AOShellCombinationsIterator.next", false]], "nfragments (psi4.driver.driver_nbody.manybodycomputer attribute)": [[1794, "psi4.driver.driver_nbody.ManyBodyComputer.nfragments", false]], "nfragments() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.nfragments", false]], "nfrzc() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.nfrzc", false]], "nfunction (psi4.core.gaussianshell attribute)": [[81, "psi4.core.GaussianShell.nfunction", false]], "ngamma() (psi4.core.correlationtable method)": [[20, "psi4.core.CorrelationTable.ngamma", false]], "nil() (psi4.core.mospace static method)": [[98, "psi4.core.MOSpace.nil", false]], "nirrep() (psi4.core.cdsalclist method)": [[16, "psi4.core.CdSalcList.nirrep", false]], "nirrep() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.nirrep", false]], "nirrep() (psi4.core.intvector method)": [[88, "psi4.core.IntVector.nirrep", false]], "nirrep() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.nirrep", false]], "nirrep() (psi4.core.orbitalspace method)": [[115, "psi4.core.OrbitalSpace.nirrep", false]], "nirrep() (psi4.core.vector method)": [[148, "psi4.core.Vector.nirrep", false]], "nirrep() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.nirrep", false]], "nl_dispersion_parameters (scf)": [[1704, "term-NL_DISPERSION_PARAMETERS-SCF", true]], "nmo() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.nmo", false]], "nmopi() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.nmopi", false]], "no_dfile (detci)": [[1704, "term-NO_DFILE-DETCI", true]], "no_occupations() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.no_occupations", false]], "no_reorient": [[1833, "index-2", false]], "no_singles (psimrcc)": [[1704, "term-NO_SINGLES-PSIMRCC", true]], "nocp (psi4.driver.driver_nbody.bsseenum attribute)": [[1794, "psi4.driver.driver_nbody.BsseEnum.nocp", false]], "norm() (psi4.core.civector method)": [[12, "psi4.core.CIVector.norm", false]], "norm() (psi4.core.vector3 method)": [[149, "psi4.core.Vector3.norm", false]], "normal_modes_write (findif)": [[1704, "term-NORMAL_MODES_WRITE-FINDIF", true]], "normalize() (psi4.core.vector3 method)": [[149, "psi4.core.Vector3.normalize", false]], "normalized (psi4.core.primitivetype attribute)": [[122, "psi4.core.PrimitiveType.Normalized", false]], "np (psi4.core.civector attribute)": [[12, "psi4.core.CIVector.np", false]], "np (psi4.core.matrix attribute)": [[100, "psi4.core.Matrix.np", false]], "np (psi4.core.vector attribute)": [[148, "psi4.core.Vector.np", false]], "np_read() (psi4.core.matrix class method)": [[100, "psi4.core.Matrix.np_read", false]], "np_read() (psi4.core.vector class method)": [[148, "psi4.core.Vector.np_read", false]], "np_write() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.np_write", false]], "np_write() (psi4.core.vector method)": [[148, "psi4.core.Vector.np_write", false]], "nph (psi4.core.matrix attribute)": [[100, "psi4.core.Matrix.nph", false]], "nph (psi4.core.vector attribute)": [[148, "psi4.core.Vector.nph", false]], "npoints() (psi4.core.blockopoints method)": [[9, "psi4.core.BlockOPoints.npoints", false]], "npoints() (psi4.core.moleculargrid method)": [[105, "psi4.core.MolecularGrid.npoints", false]], "nprimitive (psi4.core.gaussianshell attribute)": [[81, "psi4.core.GaussianShell.nprimitive", false]], "nprimitive() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.nprimitive", false]], "nshell() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.nshell", false]], "nshell_on_center() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.nshell_on_center", false]], "nso() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.nso", false]], "nsopi() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.nsopi", false]], "nuclear repulsion energy": [[1776, "psivar-NUCLEAR-REPULSION-ENERGY", false]], "nuclear() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.nuclear", false]], "nuclear_dipole() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.nuclear_dipole", false]], "nuclear_repulsion_energy() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.nuclear_repulsion_energy", false]], "nuclear_repulsion_energy_deriv1() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.nuclear_repulsion_energy_deriv1", false]], "nuclear_repulsion_energy_deriv2() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.nuclear_repulsion_energy_deriv2", false]], "num_amps_print (ccenergy)": [[1704, "term-NUM_AMPS_PRINT-CCENERGY", true]], "num_amps_print (cceom)": [[1704, "term-NUM_AMPS_PRINT-CCEOM", true]], "num_amps_print (cclambda)": [[1704, "term-NUM_AMPS_PRINT-CCLAMBDA", true]], "num_amps_print (ccresponse)": [[1704, "term-NUM_AMPS_PRINT-CCRESPONSE", true]], "num_amps_print (detci)": [[1704, "term-NUM_AMPS_PRINT-DETCI", true]], "num_core_orbitals (adc)": [[1704, "term-NUM_CORE_ORBITALS-ADC", true]], "num_dets_print (detci)": [[1704, "term-NUM_DETS_PRINT-DETCI", true]], "num_frozen_docc (globals)": [[1704, "term-NUM_FROZEN_DOCC-GLOBALS", true]], "num_frozen_uocc (globals)": [[1704, "term-NUM_FROZEN_UOCC-GLOBALS", true]], "num_guesses (adc)": [[1704, "term-NUM_GUESSES-ADC", true]], "num_init_vecs (detci)": [[1704, "term-NUM_INIT_VECS-DETCI", true]], "num_roots (detci)": [[1704, "term-NUM_ROOTS-DETCI", true]], "numint_grid() (psi4.core.numinthelper method)": [[110, "psi4.core.NumIntHelper.numint_grid", false]], "numinthelper (class in psi4.core)": [[110, "psi4.core.NumIntHelper", false]], "numpy": [[1797, "index-0", false]], "occ() (in module psi4.core)": [[218, "psi4.core.occ", false]], "occ() (psi4.core.mospace static method)": [[98, "psi4.core.MOSpace.occ", false]], "occ_orbs_print (dfocc)": [[1704, "term-OCC_ORBS_PRINT-DFOCC", true]], "occ_orbs_print (occ)": [[1704, "term-OCC_ORBS_PRINT-OCC", true]], "occ_percentage (fnocc)": [[1704, "term-OCC_PERCENTAGE-FNOCC", true]], "occ_tolerance (fnocc)": [[1704, "term-OCC_TOLERANCE-FNOCC", true]], "occ_tolerance (sapt)": [[1704, "term-OCC_TOLERANCE-SAPT", true]], "occupation_a() (psi4.core.hf method)": [[84, "psi4.core.HF.occupation_a", false]], "occupation_b() (psi4.core.hf method)": [[84, "psi4.core.HF.occupation_b", false]], "ocepa(0) correlation energy": [[1776, "psivar-OCEPA-0-CORRELATION-ENERGY", false]], "ocepa(0) total energy": [[1776, "psivar-OCEPA-0-TOTAL-ENERGY", false]], "odc_guess (dct)": [[1704, "term-ODC_GUESS-DCT", true]], "oeprop": [[1799, "index-0", false]], "oeprop (class in psi4.core)": [[111, "psi4.core.OEProp", false]], "oeprop (dfocc)": [[1704, "term-OEPROP-DFOCC", true]], "oeprop (occ)": [[1704, "term-OEPROP-OCC", true]], "oeprop() (in module psi4.driver)": [[317, "psi4.driver.oeprop", false]], "oeprop() (in module psi4.driver.p4util)": [[365, "psi4.driver.p4util.oeprop", false]], "offdiagonal_ccsd_t (psimrcc)": [[1704, "term-OFFDIAGONAL_CCSD_T-PSIMRCC", true]], "olccd": [[1798, "index-1", false], [1798, "index-5", false]], "olccd correlation energy": [[1776, "psivar-OLCCD-CORRELATION-ENERGY", false]], "olccd doubles energy": [[1776, "psivar-OLCCD-DOUBLES-ENERGY", false]], "olccd opposite-spin correlation energy": [[1776, "psivar-OLCCD-OPPOSITE-SPIN-CORRELATION-ENERGY", false]], "olccd reference correction energy": [[1776, "psivar-OLCCD-REFERENCE-CORRECTION-ENERGY", false]], "olccd same-spin correlation energy": [[1776, "psivar-OLCCD-SAME-SPIN-CORRELATION-ENERGY", false]], "olccd singles energy": [[1776, "psivar-OLCCD-SINGLES-ENERGY", false]], "olccd total energy": [[1776, "psivar-OLCCD-TOTAL-ENERGY", false]], "omega (ccresponse)": [[1704, "term-OMEGA-CCRESPONSE", true]], "omega() (psi4.core.functional method)": [[80, "psi4.core.Functional.omega", false]], "omega_erf (mints)": [[1704, "term-OMEGA_ERF-MINTS", true]], "omp2": [[1798, "index-1", false], [1798, "index-2", false]], "omp2 correlation energy": [[1776, "psivar-OMP2-CORRELATION-ENERGY", false]], "omp2 doubles energy": [[1776, "psivar-OMP2-DOUBLES-ENERGY", false]], "omp2 opposite-spin correlation energy": [[1776, "psivar-OMP2-OPPOSITE-SPIN-CORRELATION-ENERGY", false]], "omp2 reference correction energy": [[1776, "psivar-OMP2-REFERENCE-CORRECTION-ENERGY", false]], "omp2 same-spin correlation energy": [[1776, "psivar-OMP2-SAME-SPIN-CORRELATION-ENERGY", false]], "omp2 total energy": [[1776, "psivar-OMP2-TOTAL-ENERGY", false]], "omp2.5": [[1798, "index-4", false]], "omp2.5 correlation energy": [[1776, "psivar-OMP2.5-CORRELATION-ENERGY", false]], "omp2.5 doubles energy": [[1776, "psivar-OMP2.5-DOUBLES-ENERGY", false]], "omp2.5 opposite-spin correlation energy": [[1776, "psivar-OMP2.5-OPPOSITE-SPIN-CORRELATION-ENERGY", false]], "omp2.5 reference correction energy": [[1776, "psivar-OMP2.5-REFERENCE-CORRECTION-ENERGY", false]], "omp2.5 same-spin correlation energy": [[1776, "psivar-OMP2.5-SAME-SPIN-CORRELATION-ENERGY", false]], "omp2.5 total energy": [[1776, "psivar-OMP2.5-TOTAL-ENERGY", false]], "omp3": [[1798, "index-1", false], [1798, "index-3", false]], "omp3 correlation energy": [[1776, "psivar-OMP3-CORRELATION-ENERGY", false]], "omp3 doubles energy": [[1776, "psivar-OMP3-DOUBLES-ENERGY", false]], "omp3 opposite-spin correlation energy": [[1776, "psivar-OMP3-OPPOSITE-SPIN-CORRELATION-ENERGY", false]], "omp3 reference correction energy": [[1776, "psivar-OMP3-REFERENCE-CORRECTION-ENERGY", false]], "omp3 same-spin correlation energy": [[1776, "psivar-OMP3-SAME-SPIN-CORRELATION-ENERGY", false]], "omp3 total energy": [[1776, "psivar-OMP3-TOTAL-ENERGY", false]], "omp_nested": [[1756, "index-2", false], [1756, "index-3", false], [1767, "envvar-OMP_NESTED", false]], "omp_num_threads": [[661, "index-0", false], [1206, "index-0", false], [1224, "index-0", false], [1240, "index-0", false], [1704, "index-0", false], [1704, "index-1", false], [1743, "index-9", false], [1767, "envvar-OMP_NUM_THREADS", false], [1767, "index-14", false], [1767, "index-7", false]], "one-electron energy": [[1776, "psivar-ONE-ELECTRON-ENERGY", false]], "one_electron_integrals() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.one_electron_integrals", false]], "onebodyaoint (class in psi4.core)": [[112, "psi4.core.OneBodyAOInt", false]], "onebodysoint (class in psi4.core)": [[113, "psi4.core.OneBodySOInt", false]], "onel_hx() (psi4.core.hf method)": [[84, "psi4.core.HF.onel_Hx", false]], "onepdm (dfmp2)": [[1704, "term-ONEPDM-DFMP2", true]], "onepot_grid_read (scf)": [[1704, "term-ONEPOT_GRID_READ-SCF", true]], "oo_scale (dfocc)": [[1704, "term-OO_SCALE-DFOCC", true]], "opdm (dct)": [[1704, "term-OPDM-DCT", true]], "opdm (detci)": [[1704, "term-OPDM-DETCI", true]], "opdm() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.opdm", false]], "opdm_only (ccdensity)": [[1704, "term-OPDM_ONLY-CCDENSITY", true]], "opdm_relax (ccdensity)": [[1704, "term-OPDM_RELAX-CCDENSITY", true]], "opdm_relax (dfmp2)": [[1704, "term-OPDM_RELAX-DFMP2", true]], "open() (psi4.core.io method)": [[86, "psi4.core.IO.open", false]], "open_check() (psi4.core.io method)": [[86, "psi4.core.IO.open_check", false]], "operate() (psi4.core.symmetryoperation method)": [[139, "psi4.core.SymmetryOperation.operate", false]], "opt()": [[1800, "index-0", false]], "opt() (in module psi4.driver)": [[318, "psi4.driver.opt", false]], "opt_coordinates (optking)": [[1704, "term-OPT_COORDINATES-OPTKING", true]], "opt_method (dfocc)": [[1704, "term-OPT_METHOD-DFOCC", true]], "opt_method (occ)": [[1704, "term-OPT_METHOD-OCC", true]], "opt_restart (optking)": [[1704, "term-OPT_RESTART-OPTKING", true]], "opt_type (optking)": [[1704, "term-OPT_TYPE-OPTKING", true]], "optimization iterations": [[1776, "psivar-OPTIMIZATION-ITERATIONS", false]], "optimizationconvergenceerror": [[270, "psi4.driver.OptimizationConvergenceError", false]], "optimize()": [[1800, "index-0", false]], "optimize() (in module psi4.driver)": [[319, "psi4.driver.optimize", false]], "optimize_geometric() (in module psi4.driver)": [[320, "psi4.driver.optimize_geometric", false]], "option_exists_in_module() (in module psi4.core)": [[219, "psi4.core.option_exists_in_module", false]], "options (class in psi4.core)": [[114, "psi4.core.Options", false]], "options() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.options", false]], "options_to_python() (in module psi4.core)": [[220, "psi4.core.options_to_python", false]], "optionsstate (class in psi4.driver.p4util)": [[327, "psi4.driver.p4util.OptionsState", false]], "optionsstatecm() (in module psi4.driver.p4util)": [[328, "psi4.driver.p4util.OptionsStateCM", false]], "optionstate (class in psi4.driver.p4util)": [[326, "psi4.driver.p4util.OptionState", false]], "orb_opt (dfocc)": [[1704, "term-ORB_OPT-DFOCC", true]], "orb_opt (occ)": [[1704, "term-ORB_OPT-OCC", true]], "orb_resp_solver (dfocc)": [[1704, "term-ORB_RESP_SOLVER-DFOCC", true]], "orb_resp_solver (occ)": [[1704, "term-ORB_RESP_SOLVER-OCC", true]], "orbital-optimized methods": [[1798, "index-1", false]], "orbital-optimized methods, olccd": [[1798, "index-0", false]], "orbital-optimized methods, omp2": [[1798, "index-0", false]], "orbital-optimized methods, omp2.5": [[1798, "index-0", false]], "orbital-optimized methods, omp3": [[1798, "index-0", false]], "orbital_level_shift (dct)": [[1704, "term-ORBITAL_LEVEL_SHIFT-DCT", true]], "orbital_values() (psi4.core.pointfunctions method)": [[119, "psi4.core.PointFunctions.orbital_values", false]], "orbitals_write (scf)": [[1704, "term-ORBITALS_WRITE-SCF", true]], "orbitalspace (class in psi4.core)": [[115, "psi4.core.OrbitalSpace", false]], "order() (psi4.core.charactertable method)": [[17, "psi4.core.CharacterTable.order", false]], "order() (psi4.core.pointgroup method)": [[120, "psi4.core.PointGroup.order", false]], "ordered_params (psi4.driver.empiricaldispersion attribute)": [[267, "psi4.driver.EmpiricalDispersion.ordered_params", false]], "ordered_params (psi4.driver.procrouting.empirical_dispersion.empiricaldispersion attribute)": [[1759, "psi4.driver.procrouting.empirical_dispersion.EmpiricalDispersion.ordered_params", false]], "oremp": [[1798, "index-6", false]], "oremp2 correlation energy": [[1776, "psivar-OREMP2-CORRELATION-ENERGY", false]], "oremp2 doubles energy": [[1776, "psivar-OREMP2-DOUBLES-ENERGY", false]], "oremp2 opposite-spin correlation energy": [[1776, "psivar-OREMP2-OPPOSITE-SPIN-CORRELATION-ENERGY", false]], "oremp2 reference correction energy": [[1776, "psivar-OREMP2-REFERENCE-CORRECTION-ENERGY", false]], "oremp2 same-spin correlation energy": [[1776, "psivar-OREMP2-SAME-SPIN-CORRELATION-ENERGY", false]], "oremp2 singles energy": [[1776, "psivar-OREMP2-SINGLES-ENERGY", false]], "oremp2 total energy": [[1776, "psivar-OREMP2-TOTAL-ENERGY", false]], "orientation() (psi4.core.moleculargrid method)": [[105, "psi4.core.MolecularGrid.orientation", false]], "orientation_fixed() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.orientation_fixed", false]], "origin (psi4.core.onebodyaoint attribute)": [[112, "psi4.core.OneBodyAOInt.origin", false]], "original_coef() (psi4.core.gaussianshell method)": [[81, "psi4.core.GaussianShell.original_coef", false]], "orth_type (dfocc)": [[1704, "term-ORTH_TYPE-DFOCC", true]], "orth_type (occ)": [[1704, "term-ORTH_TYPE-OCC", true]], "os_scale (occ)": [[1704, "term-OS_SCALE-OCC", true]], "outfile_name() (in module psi4.core)": [[221, "psi4.core.outfile_name", false]], "output": [[1740, "index-2", false], [1752, "index-3", false], [1802, "index-4", false], [1837, "index-5", false], [1843, "index-1", false]], "overlap() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.overlap", false]], "overlap_3c() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.overlap_3c", false]], "overlap_check (cceom)": [[1704, "term-OVERLAP_CHECK-CCEOM", true]], "overlap_grad() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.overlap_grad", false]], "overlapint (class in psi4.core)": [[116, "psi4.core.OverlapInt", false]], "owner_group (psi4.driver.atomiccomputer attribute)": [[265, "psi4.driver.AtomicComputer.owner_group", false]], "p (psi4.core.aoshellcombinationsiterator attribute)": [[3, "psi4.core.AOShellCombinationsIterator.p", false]], "p (thermo)": [[1704, "term-P-THERMO", true]], "pair_energies_print (ccenergy)": [[1704, "term-PAIR_ENERGIES_PRINT-CCENERGY", true]], "parallel (scf)": [[1704, "term-PARALLEL-SCF", true]], "parallel operation": [[1767, "index-6", false]], "parent_atom() (psi4.core.blockopoints method)": [[9, "psi4.core.BlockOPoints.parent_atom", false]], "parent_symmetry (globals)": [[1704, "term-PARENT_SYMMETRY-GLOBALS", true]], "parsingerror": [[271, "psi4.driver.ParsingError", false]], "partial_cholesky_factorize() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.partial_cholesky_factorize", false]], "partition() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.partition", false]], "pasturerequirederror": [[272, "psi4.driver.PastureRequiredError", false]], "path": [[2, "index-1", false], [106, "index-0", false], [1738, "index-1", false], [1738, "index-10", false], [1738, "index-11", false], [1738, "index-12", false], [1738, "index-13", false], [1738, "index-14", false], [1738, "index-15", false], [1738, "index-16", false], [1738, "index-17", false], [1738, "index-18", false], [1738, "index-19", false], [1738, "index-24", false], [1738, "index-25", false], [1738, "index-26", false], [1738, "index-5", false], [1738, "index-7", false], [1743, "index-1", false], [1743, "index-3", false], [1743, "index-5", false], [1743, "index-7", false], [1748, "index-0", false], [1748, "index-3", false], [1748, "index-5", false], [1748, "index-6", false], [1748, "index-7", false], [1759, "index-1", false], [1767, "envvar-PATH", false], [1767, "index-17", false], [1767, "index-18", false], [1774, "index-1", false], [1774, "index-2", false], [1792, "index-1", false]], "pbs queueing system": [[1767, "index-9", false]], "pcg_beta_type (dfocc)": [[1704, "term-PCG_BETA_TYPE-DFOCC", true]], "pcg_beta_type (occ)": [[1704, "term-PCG_BETA_TYPE-OCC", true]], "pcg_convergence (dfocc)": [[1704, "term-PCG_CONVERGENCE-DFOCC", true]], "pcg_convergence (occ)": [[1704, "term-PCG_CONVERGENCE-OCC", true]], "pcg_maxiter (dfocc)": [[1704, "term-PCG_MAXITER-DFOCC", true]], "pcg_maxiter (occ)": [[1704, "term-PCG_MAXITER-OCC", true]], "pcm": [[1754, "index-0", false], [1803, "index-0", false], [1803, "index-1", false]], "pcm (globals)": [[1704, "term-PCM-GLOBALS", true]], "pcm polarization energy": [[1776, "psivar-PCM-POLARIZATION-ENERGY", false]], "pcm_cc_type (pcm)": [[1704, "term-PCM_CC_TYPE-PCM", true]], "pcm_enabled() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.PCM_enabled", false]], "pcm_helper() (in module psi4.driver)": [[379, "psi4.driver.pcm_helper", false]], "pcm_helper() (in module psi4.driver.p4util)": [[366, "psi4.driver.p4util.pcm_helper", false]], "pcm_scf_type (pcm)": [[1704, "term-PCM_SCF_TYPE-PCM", true]], "pcmsolver": [[1803, "index-0", false]], "pcmsolver_parsed_fname (pcm)": [[1704, "term-PCMSOLVER_PARSED_FNAME-PCM", true]], "pe": [[1749, "index-0", false], [1749, "index-1", false]], "pe (globals)": [[1704, "term-PE-GLOBALS", true]], "pe energy": [[1776, "psivar-PE-ENERGY", false]], "pe_ecp (pe)": [[1704, "term-PE_ECP-PE", true]], "pep1": [[1804, "index-0", false]], "perturb_cbs (psimrcc)": [[1704, "term-PERTURB_CBS-PSIMRCC", true]], "perturb_cbs_coupling (psimrcc)": [[1704, "term-PERTURB_CBS_COUPLING-PSIMRCC", true]], "perturb_dipole (scf)": [[1704, "term-PERTURB_DIPOLE-SCF", true]], "perturb_grad() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.perturb_grad", false]], "perturb_h (scf)": [[1704, "term-PERTURB_H-SCF", true]], "perturb_magnitude (detci)": [[1704, "term-PERTURB_MAGNITUDE-DETCI", true]], "perturb_magnitude (scf)": [[1704, "term-PERTURB_MAGNITUDE-SCF", true]], "perturb_with (scf)": [[1704, "term-PERTURB_WITH-SCF", true]], "petite_list() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.petite_list", false]], "petite_list() (psi4.core.sobasisset method)": [[132, "psi4.core.SOBasisSet.petite_list", false]], "petite_list1() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.petite_list1", false]], "petitelist (class in psi4.core)": [[118, "psi4.core.PetiteList", false]], "phi_points (scf)": [[1704, "term-PHI_POINTS-SCF", true]], "physconst": [[1706, "index-0", false]], "physical constants": [[1832, "index-0", false]], "pitzer_to_ci_order_onel() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.pitzer_to_ci_order_onel", false]], "pitzer_to_ci_order_twoel() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.pitzer_to_ci_order_twoel", false]], "pk_all_nonsym (scf)": [[1704, "term-PK_ALL_NONSYM-SCF", true]], "pk_max_buckets (scf)": [[1704, "term-PK_MAX_BUCKETS-SCF", true]], "plan() (psi4.driver.atomiccomputer method)": [[265, "psi4.driver.AtomicComputer.plan", false]], "plan() (psi4.driver.driver_cbs.compositecomputer method)": [[1740, "psi4.driver.driver_cbs.CompositeComputer.plan", false]], "plan() (psi4.driver.driver_findif.finitedifferencecomputer method)": [[1772, "psi4.driver.driver_findif.FiniteDifferenceComputer.plan", false]], "plan() (psi4.driver.driver_nbody.manybodycomputer method)": [[1794, "psi4.driver.driver_nbody.ManyBodyComputer.plan", false]], "plan() (psi4.driver.task_base.basecomputer method)": [[1768, "psi4.driver.task_base.BaseComputer.plan", false]], "play() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.play", false]], "plugin": [[1807, "index-0", false]], "plugin() (in module psi4.core)": [[222, "psi4.core.plugin", false]], "plugin_close() (in module psi4.core)": [[223, "psi4.core.plugin_close", false]], "plugin_close_all() (in module psi4.core)": [[224, "psi4.core.plugin_close_all", false]], "plugin_load() (in module psi4.core)": [[225, "psi4.core.plugin_load", false]], "plump_qcvar() (in module psi4.driver.p4util)": [[367, "psi4.driver.p4util.plump_qcvar", false]], "pmlocalizer (class in psi4.core)": [[117, "psi4.core.PMLocalizer", false]], "pno_convergence (dlpno)": [[1704, "term-PNO_CONVERGENCE-DLPNO", true]], "point_group() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.point_group", false]], "point_values() (psi4.core.pointfunctions method)": [[119, "psi4.core.PointFunctions.point_values", false]], "pointfunctions (class in psi4.core)": [[119, "psi4.core.PointFunctions", false]], "pointgroup (class in psi4.core)": [[120, "psi4.core.PointGroup", false]], "points (findif)": [[1704, "term-POINTS-FINDIF", true]], "pop() (psi4.core.bsvec method)": [[5, "psi4.core.BSVec.pop", false]], "populateextern() (psi4.driver.qmmmbohr method)": [[275, "psi4.driver.QMMMbohr.populateExtern", false]], "position_camera() (psi4.driver.p4util.inpsight method)": [[323, "psi4.driver.p4util.InPsight.position_camera", false]], "potential_grad() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.potential_grad", false]], "potential_integral() (psi4.core.numinthelper method)": [[110, "psi4.core.NumIntHelper.potential_integral", false]], "potential_variable() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.potential_variable", false]], "potential_variables() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.potential_variables", false]], "potentialint (class in psi4.core)": [[121, "psi4.core.PotentialInt", false]], "potfile (pe)": [[1704, "term-POTFILE-PE", true]], "power() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.power", false]], "ppl_type (dfocc)": [[1704, "term-PPL_TYPE-DFOCC", true]], "precondition() (psi4.driver.p4util.solverengine method)": [[329, "psi4.driver.p4util.SolverEngine.precondition", false]], "preconditioner (detci)": [[1704, "term-PRECONDITIONER-DETCI", true]], "prefactor_ecd() (in module psi4.driver.p4util)": [[368, "psi4.driver.p4util.prefactor_ecd", false]], "prefactor_opa() (in module psi4.driver.p4util)": [[369, "psi4.driver.p4util.prefactor_opa", false]], "prepare_options_for_module() (in module psi4.core)": [[226, "psi4.core.prepare_options_for_module", false]], "prepare_options_for_modules() (in module psi4.driver.p4util)": [[370, "psi4.driver.p4util.prepare_options_for_modules", false]], "prepare_options_for_set_options() (in module psi4.driver.p4util)": [[371, "psi4.driver.p4util.prepare_options_for_set_options", false]], "prepare_results() (psi4.driver.driver_nbody.manybodycomputer method)": [[1794, "psi4.driver.driver_nbody.ManyBodyComputer.prepare_results", false]], "prerequisites": [[1738, "index-0", false]], "presort_so_tei() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.presort_so_tei", false]], "primitivetype (class in psi4.core)": [[122, "psi4.core.PrimitiveType", false]], "print (cphf)": [[1704, "term-PRINT-CPHF", true]], "print (efp)": [[1704, "term-PRINT-EFP", true]], "print (globals)": [[1704, "term-PRINT-GLOBALS", true]], "print (sapt)": [[1704, "term-PRINT-SAPT", true]], "print() (psi4.core.moleculargrid method)": [[105, "psi4.core.MolecularGrid.print", false]], "print() (psi4.core.petitelist method)": [[118, "psi4.core.PetiteList.print", false]], "print_atom_vector() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.print_atom_vector", false]], "print_basis (scf)": [[1704, "term-PRINT_BASIS-SCF", true]], "print_bond_angles() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.print_bond_angles", false]], "print_cluster() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.print_cluster", false]], "print_density_threshold() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.print_density_threshold", false]], "print_detail() (psi4.core.functional method)": [[80, "psi4.core.Functional.print_detail", false]], "print_detail() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.print_detail", false]], "print_detail_out() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.print_detail_out", false]], "print_distances() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.print_distances", false]], "print_dpd_lookup() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.print_dpd_lookup", false]], "print_energies() (psi4.core.hf method)": [[84, "psi4.core.HF.print_energies", false]], "print_energy() (psi4.core.dispersion method)": [[68, "psi4.core.Dispersion.print_energy", false]], "print_global_options() (in module psi4.core)": [[227, "psi4.core.print_global_options", false]], "print_global_options() (psi4.core.options method)": [[114, "psi4.core.Options.print_global_options", false]], "print_gradient() (psi4.core.dispersion method)": [[68, "psi4.core.Dispersion.print_gradient", false]], "print_header() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.print_header", false]], "print_header() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.print_header", false]], "print_header() (psi4.core.hf method)": [[84, "psi4.core.HF.print_header", false]], "print_header() (psi4.core.jk method)": [[92, "psi4.core.JK.print_header", false]], "print_header() (psi4.core.vbase method)": [[147, "psi4.core.VBase.print_header", false]], "print_hessian() (psi4.core.dispersion method)": [[68, "psi4.core.Dispersion.print_hessian", false]], "print_in_input_format() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.print_in_input_format", false]], "print_module_options() (psi4.core.options method)": [[114, "psi4.core.Options.print_module_options", false]], "print_molden_vibs() (in module psi4.driver.qcdb.vib)": [[388, "psi4.driver.qcdb.vib.print_molden_vibs", false]], "print_mos (scf)": [[1704, "term-PRINT_MOS-SCF", true]], "print_noons (globals)": [[1704, "term-PRINT_NOONS-GLOBALS", true]], "print_opt_params (optking)": [[1704, "term-PRINT_OPT_PARAMS-OPTKING", true]], "print_options() (in module psi4.core)": [[228, "psi4.core.print_options", false]], "print_orbitals() (psi4.core.hf method)": [[84, "psi4.core.HF.print_orbitals", false]], "print_out() (in module psi4.core)": [[229, "psi4.core.print_out", false]], "print_out() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.print_out", false]], "print_out() (psi4.core.blockopoints method)": [[9, "psi4.core.BlockOPoints.print_out", false]], "print_out() (psi4.core.cdsalc method)": [[15, "psi4.core.CdSalc.print_out", false]], "print_out() (psi4.core.cdsalclist method)": [[16, "psi4.core.CdSalcList.print_out", false]], "print_out() (psi4.core.dimension method)": [[64, "psi4.core.Dimension.print_out", false]], "print_out() (psi4.core.dispersion method)": [[68, "psi4.core.Dispersion.print_out", false]], "print_out() (psi4.core.externalpotential method)": [[73, "psi4.core.ExternalPotential.print_out", false]], "print_out() (psi4.core.functional method)": [[80, "psi4.core.Functional.print_out", false]], "print_out() (psi4.core.intvector method)": [[88, "psi4.core.IntVector.print_out", false]], "print_out() (psi4.core.iomanager method)": [[87, "psi4.core.IOManager.print_out", false]], "print_out() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.print_out", false]], "print_out() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.print_out", false]], "print_out() (psi4.core.orbitalspace method)": [[115, "psi4.core.OrbitalSpace.print_out", false]], "print_out() (psi4.core.pointfunctions method)": [[119, "psi4.core.PointFunctions.print_out", false]], "print_out() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.print_out", false]], "print_out() (psi4.core.vector method)": [[148, "psi4.core.Vector.print_out", false]], "print_out() (psi4.driver.empiricaldispersion method)": [[267, "psi4.driver.EmpiricalDispersion.print_out", false]], "print_out_in_angstrom() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.print_out_in_angstrom", false]], "print_out_in_bohr() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.print_out_in_bohr", false]], "print_out_of_planes() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.print_out_of_planes", false]], "print_preiterations() (psi4.core.hf method)": [[84, "psi4.core.HF.print_preiterations", false]], "print_rotational_constants() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.print_rotational_constants", false]], "print_stability_analysis() (psi4.core.hf method)": [[84, "psi4.core.HF.print_stability_analysis", false]], "print_tensor_pqq() (psi4.core.fdds_dispersion method)": [[75, "psi4.core.FDDS_Dispersion.print_tensor_pqQ", false]], "print_trailer() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.print_trailer", false]], "print_trajectory_xyz_file (optking)": [[1704, "term-PRINT_TRAJECTORY_XYZ_FILE-OPTKING", true]], "print_variables() (in module psi4.core)": [[230, "psi4.core.print_variables", false]], "print_vector() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.print_vector", false]], "print_vibs() (in module psi4.driver.qcdb.vib)": [[389, "psi4.driver.qcdb.vib.print_vibs", false]], "priority (psi4.driver.atomiccomputer attribute)": [[265, "psi4.driver.AtomicComputer.priority", false]], "process_grid (scf)": [[1704, "term-PROCESS_GRID-SCF", true]], "process_input() (in module psi4.driver)": [[380, "psi4.driver.process_input", false]], "process_input() (in module psi4.driver.inputparser)": [[1768, "psi4.driver.inputparser.process_input", false]], "project_densities() (psi4.core.fdds_dispersion method)": [[75, "psi4.core.FDDS_Dispersion.project_densities", false]], "prop (class in psi4.core)": [[123, "psi4.core.Prop", false]], "prop()": [[1826, "index-0", false]], "prop() (in module psi4.driver)": [[381, "psi4.driver.prop", false]], "prop_all (ccdensity)": [[1704, "term-PROP_ALL-CCDENSITY", true]], "prop_all (cclambda)": [[1704, "term-PROP_ALL-CCLAMBDA", true]], "prop_root (ccdensity)": [[1704, "term-PROP_ROOT-CCDENSITY", true]], "prop_root (cceom)": [[1704, "term-PROP_ROOT-CCEOM", true]], "prop_root (cclambda)": [[1704, "term-PROP_ROOT-CCLAMBDA", true]], "prop_sym (ccdensity)": [[1704, "term-PROP_SYM-CCDENSITY", true]], "prop_sym (cceom)": [[1704, "term-PROP_SYM-CCEOM", true]], "prop_sym (cclambda)": [[1704, "term-PROP_SYM-CCLAMBDA", true]], "properties (globals)": [[1704, "term-PROPERTIES-GLOBALS", true]], "properties()": [[1826, "index-0", false]], "properties() (in module psi4.driver)": [[382, "psi4.driver.properties", false]], "properties() (psi4.core.vbase method)": [[147, "psi4.core.VBase.properties", false]], "properties_origin (globals)": [[1704, "term-PROPERTIES_ORIGIN-GLOBALS", true]], "property (ccenergy)": [[1704, "term-PROPERTY-CCENERGY", true]], "property (ccresponse)": [[1704, "term-PROPERTY-CCRESPONSE", true]], "protocols (psi4.driver.atomiccomputer attribute)": [[265, "psi4.driver.AtomicComputer.protocols", false]], "protointvector (class in psi4.core)": [[124, "psi4.core.ProtoIntVector", false]], "protovector (class in psi4.core)": [[125, "psi4.core.ProtoVector", false]], "provenance() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.provenance", false]], "provenance_stamp() (in module psi4.driver.p4util)": [[372, "psi4.driver.p4util.provenance_stamp", false]], "pseudoinverse() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.pseudoinverse", false]], "psi4 command line option": [[1767, "cmdoption-psi4-V", false], [1767, "cmdoption-psi4-a", false], [1767, "cmdoption-psi4-h", false], [1767, "cmdoption-psi4-i", false], [1767, "cmdoption-psi4-inplace", false], [1767, "cmdoption-psi4-k", false], [1767, "cmdoption-psi4-l", false], [1767, "cmdoption-psi4-loglevel", false], [1767, "cmdoption-psi4-m", false], [1767, "cmdoption-psi4-memory", false], [1767, "cmdoption-psi4-module", false], [1767, "cmdoption-psi4-n", false], [1767, "cmdoption-psi4-o", false], [1767, "cmdoption-psi4-psiapi-path", false], [1767, "cmdoption-psi4-qcschema", false], [1767, "cmdoption-psi4-s", false], [1767, "cmdoption-psi4-t", false], [1767, "cmdoption-psi4-v", false]], "psi4.core": [[1827, "module-psi4.core", false]], "psi4.driver": [[1827, "module-psi4.driver", false]], "psi4.driver.p4util": [[1827, "module-psi4.driver.p4util", false]], "psi4.driver.qcdb.vib": [[1772, "module-psi4.driver.qcdb.vib", false]], "psi4fockci": [[1805, "index-0", false]], "psi4rc": [[1767, "index-4", false]], "psi_scratch": [[1738, "index-27", false], [1748, "index-1", false], [1748, "index-2", false], [1748, "index-4", false], [1748, "index-8", false], [1767, "envvar-PSI_SCRATCH", false], [1767, "index-1", false], [1767, "index-12", false], [1767, "index-15", false], [1767, "index-19", false], [1767, "index-2", false], [1767, "index-3", false], [1767, "index-5", false]], "psi_top_srcdir() (in module psi4.core)": [[231, "psi4.core.psi_top_srcdir", false]], "psiclean() (psi4.core.iomanager method)": [[87, "psi4.core.IOManager.psiclean", false]], "psidatadir": [[194, "index-0", false], [245, "index-0", false], [1738, "index-3", false], [1738, "index-8", false], [1738, "index-9", false], [1767, "envvar-PSIDATADIR", false], [1767, "index-10", false], [1767, "index-13", false], [1767, "index-8", false], [1827, "index-2", false], [1827, "index-3", false]], "psiexception": [[273, "psi4.driver.PsiException", false]], "psimrcc() (in module psi4.core)": [[232, "psi4.core.psimrcc", false]], "psio_entry (class in psi4.core)": [[233, "psi4.core.psio_entry", false]], "psioh": [[1708, "index-0", false]], "psipath": [[106, "index-1", false], [1730, "index-4", false], [1730, "index-5", false], [1743, "index-2", false], [1743, "index-4", false], [1743, "index-6", false], [1743, "index-8", false], [1767, "envvar-PSIPATH", false], [1767, "index-11", false], [1767, "index-16", false], [1767, "index-20", false], [1767, "index-21", false], [1767, "index-22", false], [1767, "index-23", false], [1774, "index-3", false], [1782, "index-2", false], [1782, "index-3", false], [1808, "index-1", false], [1835, "index-1", false]], "psirc": [[1767, "index-4", false]], "psireturntype (class in psi4.core)": [[126, "psi4.core.PsiReturnType", false]], "pt_energy (psimrcc)": [[1704, "term-PT_ENERGY-PSIMRCC", true]], "pubchem": [[1833, "index-5", false]], "pure (psi4.core.gaussiantype attribute)": [[82, "psi4.core.GaussianType.Pure", false]], "puream (globals)": [[1704, "term-PUREAM-GLOBALS", true]], "push_back_external_potential() (psi4.core.hf method)": [[84, "psi4.core.HF.push_back_external_potential", false]], "pythonpath": [[2, "index-0", false], [1738, "index-2", false], [1738, "index-4", false], [1738, "index-6", false], [1752, "index-1", false], [1752, "index-2", false], [1759, "index-2", false], [1767, "envvar-PYTHONPATH", false], [1767, "index-24", false], [1806, "index-1", false], [1807, "index-1", false], [1807, "index-2", false], [1808, "index-0", false]], "q (psi4.core.aoshellcombinationsiterator attribute)": [[3, "psi4.core.AOShellCombinationsIterator.q", false]], "qc_coupling (dct)": [[1704, "term-QC_COUPLING-DCT", true]], "qc_module (globals)": [[1704, "term-QC_MODULE-GLOBALS", true]], "qc_type (dct)": [[1704, "term-QC_TYPE-DCT", true]], "qchf (dfocc)": [[1704, "term-QCHF-DFOCC", true]], "qchf (scf)": [[1704, "term-QCHF-SCF", true]], "qcisd correlation energy": [[1776, "psivar-QCISD-CORRELATION-ENERGY", false]], "qcisd doubles energy": [[1776, "psivar-QCISD-DOUBLES-ENERGY", false]], "qcisd opposite-spin correlation energy": [[1776, "psivar-QCISD-OPPOSITE-SPIN-CORRELATION-ENERGY", false]], "qcisd same-spin correlation energy": [[1776, "psivar-QCISD-SAME-SPIN-CORRELATION-ENERGY", false]], "qcisd singles energy": [[1776, "psivar-QCISD-SINGLES-ENERGY", false]], "qcisd total energy": [[1776, "psivar-QCISD-TOTAL-ENERGY", false]], "qcisd(t)": [[1771, "index-1", false]], "qcisd(t) correction energy": [[1776, "psivar-QCISD-T-CORRECTION-ENERGY", false]], "qcisd(t) correlation energy": [[1776, "psivar-QCISD-T-CORRELATION-ENERGY", false]], "qcisd(t) total energy": [[1776, "psivar-QCISD-T-TOTAL-ENERGY", false]], "qmefp (efp)": [[1704, "term-QMEFP-EFP", true]], "qmmm (class in psi4.driver)": [[274, "psi4.driver.QMMM", false]], "qmmmbohr (class in psi4.driver)": [[275, "psi4.driver.QMMMbohr", false]], "qmo() (psi4.core.dftensor method)": [[30, "psi4.core.DFTensor.Qmo", false]], "qoo() (psi4.core.dftensor method)": [[30, "psi4.core.DFTensor.Qoo", false]], "qov() (psi4.core.dftensor method)": [[30, "psi4.core.DFTensor.Qov", false]], "qso() (psi4.core.dftensor method)": [[30, "psi4.core.DFTensor.Qso", false]], "quadrature_values() (psi4.core.vbase method)": [[147, "psi4.core.VBase.quadrature_values", false]], "quadrupoleint (class in psi4.core)": [[127, "psi4.core.QuadrupoleInt", false]], "query_libxc() (psi4.core.libxcfunctional method)": [[96, "psi4.core.LibXCFunctional.query_libxc", false]], "quiet (psi4.driver.driver_nbody.manybodycomputer attribute)": [[1794, "psi4.driver.driver_nbody.ManyBodyComputer.quiet", false]], "qvv() (psi4.core.dftensor method)": [[30, "psi4.core.DFTensor.Qvv", false]], "r (psi4.core.aoshellcombinationsiterator attribute)": [[3, "psi4.core.AOShellCombinationsIterator.r", false]], "r4s (detci)": [[1704, "term-R4S-DETCI", true]], "r_a() (psi4.core.fdds_dispersion method)": [[75, "psi4.core.FDDS_Dispersion.R_A", false]], "r_b() (psi4.core.fdds_dispersion method)": [[75, "psi4.core.FDDS_Dispersion.R_B", false]], "r_convergence (adc)": [[1704, "term-R_CONVERGENCE-ADC", true]], "r_convergence (ccenergy)": [[1704, "term-R_CONVERGENCE-CCENERGY", true]], "r_convergence (cceom)": [[1704, "term-R_CONVERGENCE-CCEOM", true]], "r_convergence (cclambda)": [[1704, "term-R_CONVERGENCE-CCLAMBDA", true]], "r_convergence (ccresponse)": [[1704, "term-R_CONVERGENCE-CCRESPONSE", true]], "r_convergence (dct)": [[1704, "term-R_CONVERGENCE-DCT", true]], "r_convergence (detci)": [[1704, "term-R_CONVERGENCE-DETCI", true]], "r_convergence (dfocc)": [[1704, "term-R_CONVERGENCE-DFOCC", true]], "r_convergence (dlpno)": [[1704, "term-R_CONVERGENCE-DLPNO", true]], "r_convergence (fnocc)": [[1704, "term-R_CONVERGENCE-FNOCC", true]], "r_convergence (occ)": [[1704, "term-R_CONVERGENCE-OCC", true]], "r_convergence (psimrcc)": [[1704, "term-R_CONVERGENCE-PSIMRCC", true]], "r_points (scf)": [[1704, "term-R_POINTS-SCF", true]], "radial_scale (psi4.driver.p4util.inpsight attribute)": [[323, "psi4.driver.p4util.InPsight.radial_scale", false]], "radii (psi4.driver.p4util.inpsight attribute)": [[323, "psi4.driver.p4util.InPsight.radii", false]], "radius (scf)": [[1704, "term-RADIUS-SCF", true]], "random phase approximation": [[1841, "index-0", false]], "ranged_bend (optking)": [[1704, "term-RANGED_BEND-OPTKING", true]], "ranged_dihedral (optking)": [[1704, "term-RANGED_DIHEDRAL-OPTKING", true]], "ranged_distance (optking)": [[1704, "term-RANGED_DISTANCE-OPTKING", true]], "ranged_oofp (optking)": [[1704, "term-RANGED_OOFP-OPTKING", true]], "ras1 (globals)": [[1704, "term-RAS1-GLOBALS", true]], "ras2 (globals)": [[1704, "term-RAS2-GLOBALS", true]], "ras3 (globals)": [[1704, "term-RAS3-GLOBALS", true]], "ras34_max (detci)": [[1704, "term-RAS34_MAX-DETCI", true]], "ras3_max (detci)": [[1704, "term-RAS3_MAX-DETCI", true]], "ras4 (globals)": [[1704, "term-RAS4-GLOBALS", true]], "ras4_max (detci)": [[1704, "term-RAS4_MAX-DETCI", true]], "raw_compute_properties() (psi4.core.cubeproperties method)": [[21, "psi4.core.CubeProperties.raw_compute_properties", false]], "raw_plot() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.raw_plot", false]], "read() (psi4.core.civector method)": [[12, "psi4.core.CIVector.read", false]], "read_globals() (psi4.core.options method)": [[114, "psi4.core.Options.read_globals", false]], "read_scf_3index (dfocc)": [[1704, "term-READ_SCF_3INDEX-DFOCC", true]], "real (psi4.core.fragmenttype attribute)": [[79, "psi4.core.FragmentType.Real", false]], "reference (adc)": [[1704, "term-REFERENCE-ADC", true]], "reference (ccdensity)": [[1704, "term-REFERENCE-CCDENSITY", true]], "reference (ccenergy)": [[1704, "term-REFERENCE-CCENERGY", true]], "reference (cceom)": [[1704, "term-REFERENCE-CCEOM", true]], "reference (ccresponse)": [[1704, "term-REFERENCE-CCRESPONSE", true]], "reference (cctransort)": [[1704, "term-REFERENCE-CCTRANSORT", true]], "reference (cctriples)": [[1704, "term-REFERENCE-CCTRIPLES", true]], "reference (dct)": [[1704, "term-REFERENCE-DCT", true]], "reference (detci)": [[1704, "term-REFERENCE-DETCI", true]], "reference (mcscf)": [[1704, "term-REFERENCE-MCSCF", true]], "reference (scf)": [[1704, "term-REFERENCE-SCF", true]], "reference_sym (detci)": [[1704, "term-REFERENCE_SYM-DETCI", true]], "reference_wavefunction() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.reference_wavefunction", false]], "refresh() (psi4.core.blockopoints method)": [[9, "psi4.core.BlockOPoints.refresh", false]], "reg_param (dfocc)": [[1704, "term-REG_PARAM-DFOCC", true]], "register_composite_function() (in module psi4.driver.driver_cbs_helper)": [[1740, "psi4.driver.driver_cbs_helper.register_composite_function", false]], "register_xtpl_function() (in module psi4.driver.driver_cbs_helper)": [[1740, "psi4.driver.driver_cbs_helper.register_xtpl_function", false]], "regularization (dfocc)": [[1704, "term-REGULARIZATION-DFOCC", true]], "rehash() (psi4.core.io method)": [[86, "psi4.core.IO.rehash", false]], "reinterpret_coordentry() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.reinterpret_coordentry", false]], "relativistic": [[1836, "index-0", false]], "relativistic (globals)": [[1704, "term-RELATIVISTIC-GLOBALS", true]], "relax_guess_orbitals (dct)": [[1704, "term-RELAX_GUESS_ORBITALS-DCT", true]], "relaxed (occ)": [[1704, "term-RELAXED-OCC", true]], "remove() (psi4.core.bsvec method)": [[5, "psi4.core.BSVec.remove", false]], "remove_symmetry() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.remove_symmetry", false]], "remp2 correlation energy": [[1776, "psivar-REMP2-CORRELATION-ENERGY", false]], "remp2 doubles energy": [[1776, "psivar-REMP2-DOUBLES-ENERGY", false]], "remp2 opposite-spin correlation energy": [[1776, "psivar-REMP2-OPPOSITE-SPIN-CORRELATION-ENERGY", false]], "remp2 same-spin correlation energy": [[1776, "psivar-REMP2-SAME-SPIN-CORRELATION-ENERGY", false]], "remp2 singles energy": [[1776, "psivar-REMP2-SINGLES-ENERGY", false]], "remp2 total energy": [[1776, "psivar-REMP2-TOTAL-ENERGY", false]], "remp_a (dfocc)": [[1704, "term-REMP_A-DFOCC", true]], "remp_a (occ)": [[1704, "term-REMP_A-OCC", true]], "reopen_outfile() (in module psi4.core)": [[234, "psi4.core.reopen_outfile", false]], "repl_otf (detci)": [[1704, "term-REPL_OTF-DETCI", true]], "reset_ci_h0block() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.reset_ci_H0block", false]], "reset_occ_ (psi4.core.hf attribute)": [[84, "psi4.core.HF.reset_occ_", false]], "reset_occupation() (psi4.core.hf method)": [[84, "psi4.core.HF.reset_occupation", false]], "reset_point_group() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.reset_point_group", false]], "reset_so_int() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.reset_so_int", false]], "residue() (psi4.driver.p4util.solverengine method)": [[329, "psi4.driver.p4util.SolverEngine.residue", false]], "response_algorithm (dct)": [[1704, "term-RESPONSE_ALGORITHM-DCT", true]], "restart": [[1767, "index-0", false]], "restart (ccenergy)": [[1704, "term-RESTART-CCENERGY", true]], "restart (cclambda)": [[1704, "term-RESTART-CCLAMBDA", true]], "restart (ccresponse)": [[1704, "term-RESTART-CCRESPONSE", true]], "restart (detci)": [[1704, "term-RESTART-DETCI", true]], "restart_eom_cc3 (cceom)": [[1704, "term-RESTART_EOM_CC3-CCEOM", true]], "restore() (psi4.driver.p4util.optionsstate method)": [[327, "psi4.driver.p4util.OptionsState.restore", false]], "restore() (psi4.driver.p4util.optionstate method)": [[326, "psi4.driver.p4util.OptionState.restore", false]], "restricted_docc (globals)": [[1704, "term-RESTRICTED_DOCC-GLOBALS", true]], "restricted_uocc (globals)": [[1704, "term-RESTRICTED_UOCC-GLOBALS", true]], "result (psi4.driver.atomiccomputer attribute)": [[265, "psi4.driver.AtomicComputer.result", false]], "result_id (psi4.driver.atomiccomputer attribute)": [[265, "psi4.driver.AtomicComputer.result_id", false]], "results_list (psi4.driver.driver_cbs.compositecomputer attribute)": [[1740, "psi4.driver.driver_cbs.CompositeComputer.results_list", false]], "return_total_data (psi4.driver.driver_nbody.manybodycomputer attribute)": [[1794, "psi4.driver.driver_nbody.ManyBodyComputer.return_total_data", false]], "revoke_global_option_changed() (in module psi4.core)": [[235, "psi4.core.revoke_global_option_changed", false]], "revoke_local_option_changed() (in module psi4.core)": [[236, "psi4.core.revoke_local_option_changed", false]], "rfo_follow_root (optking)": [[1704, "term-RFO_FOLLOW_ROOT-OPTKING", true]], "rfo_normalization_max (optking)": [[1704, "term-RFO_NORMALIZATION_MAX-OPTKING", true]], "rfo_root (optking)": [[1704, "term-RFO_ROOT-OPTKING", true]], "rhf (class in psi4.core)": [[128, "psi4.core.RHF", false]], "rhf_energy() (psi4.core.somcscf method)": [[133, "psi4.core.SOMCSCF.rhf_energy", false]], "rhf_triplets (cceom)": [[1704, "term-RHF_TRIPLETS-CCEOM", true]], "right (psi4.driver.p4util.inpsight attribute)": [[323, "psi4.driver.p4util.InPsight.right", false]], "rksfunctions (class in psi4.core)": [[129, "psi4.core.RKSFunctions", false]], "rms() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.rms", false]], "rms_disp_g_convergence (optking)": [[1704, "term-RMS_DISP_G_CONVERGENCE-OPTKING", true]], "rms_force_g_convergence (optking)": [[1704, "term-RMS_FORCE_G_CONVERGENCE-OPTKING", true]], "rms_mograd_convergence (dfocc)": [[1704, "term-RMS_MOGRAD_CONVERGENCE-DFOCC", true]], "rms_mograd_convergence (occ)": [[1704, "term-RMS_MOGRAD_CONVERGENCE-OCC", true]], "rohf (class in psi4.core)": [[130, "psi4.core.ROHF", false]], "roots_per_irrep (adc)": [[1704, "term-ROOTS_PER_IRREP-ADC", true]], "roots_per_irrep (ccdensity)": [[1704, "term-ROOTS_PER_IRREP-CCDENSITY", true]], "roots_per_irrep (cceom)": [[1704, "term-ROOTS_PER_IRREP-CCEOM", true]], "roots_per_irrep (cclambda)": [[1704, "term-ROOTS_PER_IRREP-CCLAMBDA", true]], "rotate_columns() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.rotate_columns", false]], "rotate_mcscf_integrals() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.rotate_mcscf_integrals", false]], "rotate_mo_angle (mcscf)": [[1704, "term-ROTATE_MO_ANGLE-MCSCF", true]], "rotate_mo_irrep (mcscf)": [[1704, "term-ROTATE_MO_IRREP-MCSCF", true]], "rotate_mo_p (mcscf)": [[1704, "term-ROTATE_MO_P-MCSCF", true]], "rotate_mo_q (mcscf)": [[1704, "term-ROTATE_MO_Q-MCSCF", true]], "rotate_n() (psi4.core.symmetryoperation method)": [[139, "psi4.core.SymmetryOperation.rotate_n", false]], "rotate_orbitals() (psi4.core.hf method)": [[84, "psi4.core.HF.rotate_orbitals", false]], "rotate_theta() (psi4.core.symmetryoperation method)": [[139, "psi4.core.SymmetryOperation.rotate_theta", false]], "rotational_constants() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.rotational_constants", false]], "rotational_symmetry_number (thermo)": [[1704, "term-ROTATIONAL_SYMMETRY_NUMBER-THERMO", true]], "rotational_symmetry_number() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.rotational_symmetry_number", false]], "rotor_type() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.rotor_type", false]], "rowdim() (psi4.core.dpdbuf4 method)": [[183, "psi4.core.dpdbuf4.rowdim", false]], "rowdim() (psi4.core.dpdfile2 method)": [[184, "psi4.core.dpdfile2.rowdim", false]], "rowdim() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.rowdim", false]], "rows() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.rows", false]], "rpa": [[1841, "index-0", false]], "rsrfo_alpha_max (optking)": [[1704, "term-RSRFO_ALPHA_MAX-OPTKING", true]], "run_ccsd (fnocc)": [[1704, "term-RUN_CCSD-FNOCC", true]], "run_cctransort (cctransort)": [[1704, "term-RUN_CCTRANSORT-CCTRANSORT", true]], "run_cepa (fnocc)": [[1704, "term-RUN_CEPA-FNOCC", true]], "run_cfour() (in module psi4.driver.procrouting.interface_cfour)": [[1743, "psi4.driver.procrouting.interface_cfour.run_cfour", false]], "run_dftd3() (in module qcdb.molecule)": [[1759, "qcdb.Molecule.run_dftd3", false]], "run_dftd3() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.run_dftd3", false]], "run_dftd4() (in module qcdb.molecule)": [[1759, "qcdb.Molecule.run_dftd4", false]], "run_dftd4() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.run_dftd4", false]], "run_gcp() (in module qcdb.molecule)": [[1774, "qcdb.Molecule.run_gcp", false]], "run_gcp() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.run_gcp", false]], "run_mp2 (fnocc)": [[1704, "term-RUN_MP2-FNOCC", true]], "run_mp3 (fnocc)": [[1704, "term-RUN_MP3-FNOCC", true]], "run_mp4 (fnocc)": [[1704, "term-RUN_MP4-FNOCC", true]], "s (detci)": [[1704, "term-S-DETCI", true]], "s (psi4.core.aoshellcombinationsiterator attribute)": [[3, "psi4.core.AOShellCombinationsIterator.s", false]], "s() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.S", false]], "s6() (psi4.core.dispersion method)": [[68, "psi4.core.Dispersion.s6", false]], "s8() (psi4.core.dispersion method)": [[68, "psi4.core.Dispersion.s8", false]], "s_cholesky_tolerance (scf)": [[1704, "term-S_CHOLESKY_TOLERANCE-SCF", true]], "s_cut (dlpno)": [[1704, "term-S_CUT-DLPNO", true]], "s_orthogonalization (scf)": [[1704, "term-S_ORTHOGONALIZATION-SCF", true]], "s_tolerance (scf)": [[1704, "term-S_TOLERANCE-SCF", true]], "sad_ (psi4.core.hf attribute)": [[84, "psi4.core.HF.sad_", false]], "sad_chol_tolerance (scf)": [[1704, "term-SAD_CHOL_TOLERANCE-SCF", true]], "sad_d_convergence (scf)": [[1704, "term-SAD_D_CONVERGENCE-SCF", true]], "sad_e_convergence (scf)": [[1704, "term-SAD_E_CONVERGENCE-SCF", true]], "sad_frac_occ (scf)": [[1704, "term-SAD_FRAC_OCC-SCF", true]], "sad_maxiter (scf)": [[1704, "term-SAD_MAXITER-SCF", true]], "sad_print (scf)": [[1704, "term-SAD_PRINT-SCF", true]], "sad_scf_type (scf)": [[1704, "term-SAD_SCF_TYPE-SCF", true]], "sad_spin_average (scf)": [[1704, "term-SAD_SPIN_AVERAGE-SCF", true]], "sadguess (class in psi4.core)": [[131, "psi4.core.SADGuess", false]], "salc_name() (psi4.core.cdsalclist method)": [[16, "psi4.core.CdSalcList.salc_name", false]], "salccomponent (class in psi4.core)": [[134, "psi4.core.SalcComponent", false]], "same_a_b_dens() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.same_a_b_dens", false]], "same_a_b_orbs() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.same_a_b_orbs", false]], "sanitize_method() (in module psi4.driver)": [[391, "psi4.driver.sanitize_method", false]], "sanitize_method() (in module psi4.driver.p4util)": [[373, "psi4.driver.p4util.sanitize_method", false]], "sanitize_name() (in module psi4.driver)": [[392, "psi4.driver.sanitize_name", false]], "sapgau_basis (scf)": [[1704, "term-SAPGAU_BASIS-SCF", true]], "sapt": [[1837, "index-0", false], [1837, "index-1", false], [1837, "index-2", false], [1837, "index-3", false], [1837, "index-4", false], [1837, "index-5", false]], "sapt (scf)": [[1704, "term-SAPT-SCF", true]], "sapt alpha": [[1776, "psivar-SAPT-ALPHA", false]], "sapt ct energy": [[1776, "psivar-SAPT-CT-ENERGY", false]], "sapt disp energy": [[1776, "psivar-SAPT-DISP-ENERGY", false]], "sapt disp2(ccd) energy": [[1776, "psivar-SAPT-DISP2-CCD-ENERGY", false]], "sapt disp20 energy": [[1776, "psivar-SAPT-DISP20-ENERGY", false]], "sapt disp21 energy": [[1776, "psivar-SAPT-DISP21-ENERGY", false]], "sapt disp22(s)(ccd) energy": [[1776, "psivar-SAPT-DISP22-S-CCD-ENERGY", false]], "sapt disp22(sdq) energy": [[1776, "psivar-SAPT-DISP22-SDQ-ENERGY", false]], "sapt disp22(t) energy": [[1776, "psivar-SAPT-DISP22-T-ENERGY", false]], "sapt disp22(t)(ccd) energy": [[1776, "psivar-SAPT-DISP22-T-CCD-ENERGY", false]], "sapt disp30 energy": [[1776, "psivar-SAPT-DISP30-ENERGY", false]], "sapt elst energy": [[1776, "psivar-SAPT-ELST-ENERGY", false]], "sapt elst extern-extern energy": [[1776, "psivar-SAPT-ELST-EXTERN-EXTERN-ENERGY", false]], "sapt elst10,r energy": [[1776, "psivar-SAPT-ELST10-R-ENERGY", false]], "sapt elst12,r energy": [[1776, "psivar-SAPT-ELST12-R-ENERGY", false]], "sapt elst13,r energy": [[1776, "psivar-SAPT-ELST13-R-ENERGY", false]], "sapt energy": [[1776, "psivar-SAPT-ENERGY", false]], "sapt est.disp22(t) energy": [[1776, "psivar-SAPT-EST.DISP22-T-ENERGY", false]], "sapt est.disp22(t)(ccd) energy": [[1776, "psivar-SAPT-EST.DISP22-T-CCD-ENERGY", false]], "sapt exch energy": [[1776, "psivar-SAPT-EXCH-ENERGY", false]], "sapt exch-disp20 energy": [[1776, "psivar-SAPT-EXCH-DISP20-ENERGY", false]], "sapt exch-disp20(s^inf) energy": [[1776, "psivar-SAPT-EXCH-DISP20-S-INF-ENERGY", false]], "sapt exch-disp30 energy": [[1776, "psivar-SAPT-EXCH-DISP30-ENERGY", false]], "sapt exch-ind-disp30 energy": [[1776, "psivar-SAPT-EXCH-IND-DISP30-ENERGY", false]], "sapt exch-ind20,r energy": [[1776, "psivar-SAPT-EXCH-IND20-R-ENERGY", false]], "sapt exch-ind20,u energy": [[1776, "psivar-SAPT-EXCH-IND20-U-ENERGY", false]], "sapt exch-ind22 energy": [[1776, "psivar-SAPT-EXCH-IND22-ENERGY", false]], "sapt exch-ind30(s^inf) energy": [[1776, "psivar-SAPT-EXCH-IND30-S-INF-ENERGY", false]], "sapt exch-ind30,r energy": [[1776, "psivar-SAPT-EXCH-IND30-R-ENERGY", false]], "sapt exch-ind30,r(s^inf) energy": [[1776, "psivar-SAPT-EXCH-IND30-R-S-INF-ENERGY", false]], "sapt exch10 energy": [[1776, "psivar-SAPT-EXCH10-ENERGY", false]], "sapt exch10(s^2) energy": [[1776, "psivar-SAPT-EXCH10-S-2-ENERGY", false]], "sapt exch11(s^2) energy": [[1776, "psivar-SAPT-EXCH11-S-2-ENERGY", false]], "sapt exch12(s^2) energy": [[1776, "psivar-SAPT-EXCH12-S-2-ENERGY", false]], "sapt hf total energy": [[1776, "psivar-SAPT-HF-TOTAL-ENERGY", false]], "sapt hf(2) energy a(0)": [[1776, "psivar-SAPT-HF-2-ENERGY-A-0", false]], "sapt hf(2) energy a(hf)": [[1776, "psivar-SAPT-HF-2-ENERGY-A-HF", false]], "sapt hf(2) energy ab(hf)": [[1776, "psivar-SAPT-HF-2-ENERGY-AB-HF", false]], "sapt hf(2) energy abc(hf)": [[1776, "psivar-SAPT-HF-2-ENERGY-ABC-HF", false]], "sapt hf(2) energy ac(0)": [[1776, "psivar-SAPT-HF-2-ENERGY-AC-0", false]], "sapt hf(2) energy ac(hf)": [[1776, "psivar-SAPT-HF-2-ENERGY-AC-HF", false]], "sapt hf(2) energy b(0)": [[1776, "psivar-SAPT-HF-2-ENERGY-B-0", false]], "sapt hf(2) energy b(hf)": [[1776, "psivar-SAPT-HF-2-ENERGY-B-HF", false]], "sapt hf(2) energy bc(0)": [[1776, "psivar-SAPT-HF-2-ENERGY-BC-0", false]], "sapt hf(2) energy bc(hf)": [[1776, "psivar-SAPT-HF-2-ENERGY-BC-HF", false]], "sapt hf(2) energy c": [[1776, "psivar-SAPT-HF-2-ENERGY-C", false]], "sapt hf(2) energy hf": [[1776, "psivar-SAPT-HF-2-ENERGY-HF", false]], "sapt ind energy": [[1776, "psivar-SAPT-IND-ENERGY", false]], "sapt ind-disp30 energy": [[1776, "psivar-SAPT-IND-DISP30-ENERGY", false]], "sapt ind20,r energy": [[1776, "psivar-SAPT-IND20-R-ENERGY", false]], "sapt ind20,u energy": [[1776, "psivar-SAPT-IND20-U-ENERGY", false]], "sapt ind22 energy": [[1776, "psivar-SAPT-IND22-ENERGY", false]], "sapt ind30,r energy": [[1776, "psivar-SAPT-IND30-R-ENERGY", false]], "sapt mp2 correlation energy": [[1776, "psivar-SAPT-MP2-CORRELATION-ENERGY", false]], "sapt same-spin disp20 energy": [[1776, "psivar-SAPT-SAME-SPIN-DISP20-ENERGY", false]], "sapt same-spin exch-disp20 energy": [[1776, "psivar-SAPT-SAME-SPIN-EXCH-DISP20-ENERGY", false]], "sapt total energy": [[1776, "psivar-SAPT-TOTAL-ENERGY", false]], "sapt() (in module psi4.core)": [[237, "psi4.core.sapt", false]], "sapt(dft)": [[1837, "index-2", false]], "sapt0": [[1837, "index-1", false]], "sapt0 disp energy": [[1776, "psivar-SAPT0-DISP-ENERGY", false]], "sapt0 elst energy": [[1776, "psivar-SAPT0-ELST-ENERGY", false]], "sapt0 exch energy": [[1776, "psivar-SAPT0-EXCH-ENERGY", false]], "sapt0 ind energy": [[1776, "psivar-SAPT0-IND-ENERGY", false]], "sapt0 total energy": [[1776, "psivar-SAPT0-TOTAL-ENERGY", false]], "sapt0_e10 (sapt)": [[1704, "term-SAPT0_E10-SAPT", true]], "sapt0_e20disp (sapt)": [[1704, "term-SAPT0_E20DISP-SAPT", true]], "sapt0_e20ind (sapt)": [[1704, "term-SAPT0_E20IND-SAPT", true]], "sapt2 disp energy": [[1776, "psivar-SAPT2-DISP-ENERGY", false]], "sapt2 elst energy": [[1776, "psivar-SAPT2-ELST-ENERGY", false]], "sapt2 exch energy": [[1776, "psivar-SAPT2-EXCH-ENERGY", false]], "sapt2 ind energy": [[1776, "psivar-SAPT2-IND-ENERGY", false]], "sapt2 total energy": [[1776, "psivar-SAPT2-TOTAL-ENERGY", false]], "sapt2+ disp energy": [[1776, "psivar-1", false]], "sapt2+ elst energy": [[1776, "psivar-2", false]], "sapt2+ exch energy": [[1776, "psivar-3", false]], "sapt2+ ind energy": [[1776, "psivar-4", false]], "sapt2+ total energy": [[1776, "psivar-9", false]], "sapt2+(3) disp energy": [[1776, "psivar-SAPT2-3-DISP-ENERGY", false]], "sapt2+(3) elst energy": [[1776, "psivar-SAPT2-3-ELST-ENERGY", false]], "sapt2+(3) exch energy": [[1776, "psivar-SAPT2-3-EXCH-ENERGY", false]], "sapt2+(3) ind energy": [[1776, "psivar-SAPT2-3-IND-ENERGY", false]], "sapt2+(3) total energy": [[1776, "psivar-SAPT2-3-TOTAL-ENERGY", false]], "sapt2+(3)(ccd) disp energy": [[1776, "psivar-SAPT2-3-CCD-DISP-ENERGY", false]], "sapt2+(3)(ccd) elst energy": [[1776, "psivar-SAPT2-3-CCD-ELST-ENERGY", false]], "sapt2+(3)(ccd) exch energy": [[1776, "psivar-SAPT2-3-CCD-EXCH-ENERGY", false]], "sapt2+(3)(ccd) ind energy": [[1776, "psivar-SAPT2-3-CCD-IND-ENERGY", false]], "sapt2+(3)(ccd) total energy": [[1776, "psivar-SAPT2-3-CCD-TOTAL-ENERGY", false]], "sapt2+(3)(ccd)dmp2 disp energy": [[1776, "psivar-SAPT2-3-CCD-DMP2-DISP-ENERGY", false]], "sapt2+(3)(ccd)dmp2 elst energy": [[1776, "psivar-SAPT2-3-CCD-DMP2-ELST-ENERGY", false]], "sapt2+(3)(ccd)dmp2 exch energy": [[1776, "psivar-SAPT2-3-CCD-DMP2-EXCH-ENERGY", false]], "sapt2+(3)(ccd)dmp2 ind energy": [[1776, "psivar-SAPT2-3-CCD-DMP2-IND-ENERGY", false]], "sapt2+(3)(ccd)dmp2 total energy": [[1776, "psivar-SAPT2-3-CCD-DMP2-TOTAL-ENERGY", false]], "sapt2+(3)dmp2 disp energy": [[1776, "psivar-SAPT2-3-DMP2-DISP-ENERGY", false]], "sapt2+(3)dmp2 elst energy": [[1776, "psivar-SAPT2-3-DMP2-ELST-ENERGY", false]], "sapt2+(3)dmp2 exch energy": [[1776, "psivar-SAPT2-3-DMP2-EXCH-ENERGY", false]], "sapt2+(3)dmp2 ind energy": [[1776, "psivar-SAPT2-3-DMP2-IND-ENERGY", false]], "sapt2+(3)dmp2 total energy": [[1776, "psivar-SAPT2-3-DMP2-TOTAL-ENERGY", false]], "sapt2+(ccd) disp energy": [[1776, "psivar-SAPT2-CCD-DISP-ENERGY", false]], "sapt2+(ccd) elst energy": [[1776, "psivar-SAPT2-CCD-ELST-ENERGY", false]], "sapt2+(ccd) exch energy": [[1776, "psivar-SAPT2-CCD-EXCH-ENERGY", false]], "sapt2+(ccd) ind energy": [[1776, "psivar-SAPT2-CCD-IND-ENERGY", false]], "sapt2+(ccd) total energy": [[1776, "psivar-SAPT2-CCD-TOTAL-ENERGY", false]], "sapt2+(ccd)dmp2 disp energy": [[1776, "psivar-SAPT2-CCD-DMP2-DISP-ENERGY", false]], "sapt2+(ccd)dmp2 elst energy": [[1776, "psivar-SAPT2-CCD-DMP2-ELST-ENERGY", false]], "sapt2+(ccd)dmp2 exch energy": [[1776, "psivar-SAPT2-CCD-DMP2-EXCH-ENERGY", false]], "sapt2+(ccd)dmp2 ind energy": [[1776, "psivar-SAPT2-CCD-DMP2-IND-ENERGY", false]], "sapt2+(ccd)dmp2 total energy": [[1776, "psivar-SAPT2-CCD-DMP2-TOTAL-ENERGY", false]], "sapt2+3 disp energy": [[1776, "psivar-5", false]], "sapt2+3 elst energy": [[1776, "psivar-6", false]], "sapt2+3 exch energy": [[1776, "psivar-7", false]], "sapt2+3 ind energy": [[1776, "psivar-8", false]], "sapt2+3 total energy": [[1776, "psivar-10", false]], "sapt2+3(ccd) disp energy": [[1776, "psivar-11", false]], "sapt2+3(ccd) elst energy": [[1776, "psivar-12", false]], "sapt2+3(ccd) exch energy": [[1776, "psivar-13", false]], "sapt2+3(ccd) ind energy": [[1776, "psivar-14", false]], "sapt2+3(ccd) total energy": [[1776, "psivar-15", false]], "sapt2+3(ccd)dmp2 disp energy": [[1776, "psivar-16", false]], "sapt2+3(ccd)dmp2 elst energy": [[1776, "psivar-17", false]], "sapt2+3(ccd)dmp2 exch energy": [[1776, "psivar-18", false]], "sapt2+3(ccd)dmp2 ind energy": [[1776, "psivar-19", false]], "sapt2+3(ccd)dmp2 total energy": [[1776, "psivar-20", false]], "sapt2+3dmp2 disp energy": [[1776, "psivar-SAPT2-3DMP2-DISP-ENERGY", false]], "sapt2+3dmp2 elst energy": [[1776, "psivar-SAPT2-3DMP2-ELST-ENERGY", false]], "sapt2+3dmp2 exch energy": [[1776, "psivar-SAPT2-3DMP2-EXCH-ENERGY", false]], "sapt2+3dmp2 ind energy": [[1776, "psivar-SAPT2-3DMP2-IND-ENERGY", false]], "sapt2+3dmp2 total energy": [[1776, "psivar-SAPT2-3DMP2-TOTAL-ENERGY", false]], "sapt2+dmp2 disp energy": [[1776, "psivar-SAPT2-DMP2-DISP-ENERGY", false]], "sapt2+dmp2 elst energy": [[1776, "psivar-SAPT2-DMP2-ELST-ENERGY", false]], "sapt2+dmp2 exch energy": [[1776, "psivar-SAPT2-DMP2-EXCH-ENERGY", false]], "sapt2+dmp2 ind energy": [[1776, "psivar-SAPT2-DMP2-IND-ENERGY", false]], "sapt2+dmp2 total energy": [[1776, "psivar-SAPT2-DMP2-TOTAL-ENERGY", false]], "sapt_dft_do_dhf (sapt)": [[1704, "term-SAPT_DFT_DO_DHF-SAPT", true]], "sapt_dft_do_hybrid (sapt)": [[1704, "term-SAPT_DFT_DO_HYBRID-SAPT", true]], "sapt_dft_exch_disp_fixed_scale (sapt)": [[1704, "term-SAPT_DFT_EXCH_DISP_FIXED_SCALE-SAPT", true]], "sapt_dft_exch_disp_scale_scheme (sapt)": [[1704, "term-SAPT_DFT_EXCH_DISP_SCALE_SCHEME-SAPT", true]], "sapt_dft_functional (sapt)": [[1704, "term-SAPT_DFT_FUNCTIONAL-SAPT", true]], "sapt_dft_grac_determination (sapt)": [[1704, "term-SAPT_DFT_GRAC_DETERMINATION-SAPT", true]], "sapt_dft_grac_shift_a (sapt)": [[1704, "term-SAPT_DFT_GRAC_SHIFT_A-SAPT", true]], "sapt_dft_grac_shift_b (sapt)": [[1704, "term-SAPT_DFT_GRAC_SHIFT_B-SAPT", true]], "sapt_dft_mp2_disp_alg (sapt)": [[1704, "term-SAPT_DFT_MP2_DISP_ALG-SAPT", true]], "sapt_fdds_disp_leg_lambda (sapt)": [[1704, "term-SAPT_FDDS_DISP_LEG_LAMBDA-SAPT", true]], "sapt_fdds_disp_num_points (sapt)": [[1704, "term-SAPT_FDDS_DISP_NUM_POINTS-SAPT", true]], "sapt_fdds_v2_rho_cutoff (sapt)": [[1704, "term-SAPT_FDDS_V2_RHO_CUTOFF-SAPT", true]], "sapt_level (sapt)": [[1704, "term-SAPT_LEVEL-SAPT", true]], "sapt_mem_check (sapt)": [[1704, "term-SAPT_MEM_CHECK-SAPT", true]], "sapt_mem_factor (sapt)": [[1704, "term-SAPT_MEM_FACTOR-SAPT", true]], "sapt_mem_safety (sapt)": [[1704, "term-SAPT_MEM_SAFETY-SAPT", true]], "sapt_quiet (sapt)": [[1704, "term-SAPT_QUIET-SAPT", true]], "save() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.save", false]], "save() (psi4.core.vector method)": [[148, "psi4.core.Vector.save", false]], "save_density() (psi4.driver.p4util.inpsight method)": [[323, "psi4.driver.p4util.InPsight.save_density", false]], "save_density_and_energy() (psi4.core.hf method)": [[84, "psi4.core.HF.save_density_and_energy", false]], "save_jk (scf)": [[1704, "term-SAVE_JK-SCF", true]], "save_molecule() (psi4.driver.p4util.inpsight method)": [[323, "psi4.driver.p4util.InPsight.save_molecule", false]], "save_optimization (optking)": [[1704, "term-SAVE_OPTIMIZATION-OPTKING", true]], "save_string_xyz() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.save_string_xyz", false]], "save_string_xyz_file() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.save_string_xyz_file", false]], "save_uhf_nos (scf)": [[1704, "term-SAVE_UHF_NOS-SCF", true]], "save_xyz_file() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.save_xyz_file", false]], "savetype (class in psi4.core)": [[135, "psi4.core.SaveType", false]], "scalar_variable() (in module psi4.core)": [[238, "psi4.core.scalar_variable", false]], "scalar_variable() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.scalar_variable", false]], "scalar_variables() (in module psi4.core)": [[239, "psi4.core.scalar_variables", false]], "scalar_variables() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.scalar_variables", false]], "scalars() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.scalars", false]], "scale() (psi4.core.civector method)": [[12, "psi4.core.CIVector.scale", false]], "scale() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.scale", false]], "scale() (psi4.core.vector method)": [[148, "psi4.core.Vector.scale", false]], "scale_column() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.scale_column", false]], "scale_row() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.scale_row", false]], "scatter() (in module psi4.core)": [[240, "psi4.core.scatter", false]], "scf": [[1838, "index-0", false], [1838, "index-1", false]], "scf dipole": [[1776, "psivar-SCF-DIPOLE", false]], "scf dipole gradient": [[1776, "psivar-SCF-DIPOLE-GRADIENT", false]], "scf iterations": [[1776, "psivar-SCF-ITERATIONS", false]], "scf quadrupole": [[1776, "psivar-SCF-QUADRUPOLE", false]], "scf stability eigenvalues": [[1776, "psivar-SCF-STABILITY-EIGENVALUES", false]], "scf total energy": [[1776, "psivar-SCF-TOTAL-ENERGY", false]], "scf total gradient": [[1776, "psivar-SCF-TOTAL-GRADIENT", false]], "scf total hessian": [[1776, "psivar-SCF-TOTAL-HESSIAN", false]], "scf() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.scf", false]], "scf_dtot() (psi4.core.fchkwriter method)": [[74, "psi4.core.FCHKWriter.SCF_Dtot", false]], "scf_helper() (in module psi4.driver)": [[393, "psi4.driver.scf_helper", false]], "scf_initial_accelerator (scf)": [[1704, "term-SCF_INITIAL_ACCELERATOR-SCF", true]], "scf_initial_finish_diis_transition (scf)": [[1704, "term-SCF_INITIAL_FINISH_DIIS_TRANSITION-SCF", true]], "scf_initial_start_diis_transition (scf)": [[1704, "term-SCF_INITIAL_START_DIIS_TRANSITION-SCF", true]], "scf_mem_safety_factor (scf)": [[1704, "term-SCF_MEM_SAFETY_FACTOR-SCF", true]], "scf_properties (scf)": [[1704, "term-SCF_PROPERTIES-SCF", true]], "scf_subtype (scf)": [[1704, "term-SCF_SUBTYPE-SCF", true]], "scf_type (cphf)": [[1704, "term-SCF_TYPE-CPHF", true]], "scf_type (globals)": [[1704, "term-SCF_TYPE-GLOBALS", true]], "scf_type() (psi4.core.hf method)": [[84, "psi4.core.HF.scf_type", false]], "scf_wavefunction_factory() (in module psi4.driver)": [[394, "psi4.driver.scf_wavefunction_factory", false]], "scf_xtpl_helgaker_2() (in module psi4.driver.driver_cbs_helper)": [[1740, "psi4.driver.driver_cbs_helper.scf_xtpl_helgaker_2", false]], "scf_xtpl_helgaker_3() (in module psi4.driver.driver_cbs_helper)": [[1740, "psi4.driver.driver_cbs_helper.scf_xtpl_helgaker_3", false]], "scf_xtpl_karton_2() (in module psi4.driver.driver_cbs_helper)": [[1740, "psi4.driver.driver_cbs_helper.scf_xtpl_karton_2", false]], "scf_xtpl_truhlar_2() (in module psi4.driver.driver_cbs_helper)": [[1740, "psi4.driver.driver_cbs_helper.scf_xtpl_truhlar_2", false]], "scfconvergenceerror": [[276, "psi4.driver.SCFConvergenceError", false]], "scfgrad() (in module psi4.core)": [[241, "psi4.core.scfgrad", false]], "scfhess() (in module psi4.core)": [[242, "psi4.core.scfhess", false]], "schmidt() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.schmidt", false]], "schmidt_add_residual_tolerance (cceom)": [[1704, "term-SCHMIDT_ADD_RESIDUAL_TOLERANCE-CCEOM", true]], "schoenflies_symbol() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.schoenflies_symbol", false]], "scramble() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.scramble", false]], "scratch files": [[1767, "index-0", false]], "screening (globals)": [[1704, "term-SCREENING-GLOBALS", true]], "scs(n)-mp2 correlation energy": [[1776, "psivar-SCS-N-MP2-CORRELATION-ENERGY", false]], "scs(n)-mp2 total energy": [[1776, "psivar-SCS-N-MP2-TOTAL-ENERGY", false]], "scs(n)-omp2 correlation energy": [[1776, "psivar-SCS-N-OMP2-CORRELATION-ENERGY", false]], "scs(n)-omp2 total energy": [[1776, "psivar-SCS-N-OMP2-TOTAL-ENERGY", false]], "scs-ccsd correlation energy": [[1776, "psivar-SCS-CCSD-CORRELATION-ENERGY", false]], "scs-ccsd total energy": [[1776, "psivar-SCS-CCSD-TOTAL-ENERGY", false]], "scs-mp2 correlation energy": [[1776, "psivar-SCS-MP2-CORRELATION-ENERGY", false]], "scs-mp2 total energy": [[1776, "psivar-SCS-MP2-TOTAL-ENERGY", false]], "scs-mp2-vdw correlation energy": [[1776, "psivar-SCS-MP2-VDW-CORRELATION-ENERGY", false]], "scs-mp2-vdw total energy": [[1776, "psivar-SCS-MP2-VDW-TOTAL-ENERGY", false]], "scs-mp3 correlation energy": [[1776, "psivar-SCS-MP3-CORRELATION-ENERGY", false]], "scs-mp3 total energy": [[1776, "psivar-SCS-MP3-TOTAL-ENERGY", false]], "scs-omp2 correlation energy": [[1776, "psivar-SCS-OMP2-CORRELATION-ENERGY", false]], "scs-omp2 total energy": [[1776, "psivar-SCS-OMP2-TOTAL-ENERGY", false]], "scs-omp3 correlation energy": [[1776, "psivar-SCS-OMP3-CORRELATION-ENERGY", false]], "scs-omp3 total energy": [[1776, "psivar-SCS-OMP3-TOTAL-ENERGY", false]], "scs_ccsd (ccenergy)": [[1704, "term-SCS_CCSD-CCENERGY", true]], "scs_ccsd (fnocc)": [[1704, "term-SCS_CCSD-FNOCC", true]], "scs_cepa (fnocc)": [[1704, "term-SCS_CEPA-FNOCC", true]], "scs_mp2 (ccenergy)": [[1704, "term-SCS_MP2-CCENERGY", true]], "scs_mp2 (fnocc)": [[1704, "term-SCS_MP2-FNOCC", true]], "scs_type (dfocc)": [[1704, "term-SCS_TYPE-DFOCC", true]], "scs_type (occ)": [[1704, "term-SCS_TYPE-OCC", true]], "scsn-omp2 correlation energy": [[1776, "psivar-SCSN-OMP2-CORRELATION-ENERGY", false]], "scsn-omp2 total energy": [[1776, "psivar-SCSN-OMP2-TOTAL-ENERGY", false]], "scsn_mp2 (ccenergy)": [[1704, "term-SCSN_MP2-CCENERGY", true]], "sekino (cclambda)": [[1704, "term-SEKINO-CCLAMBDA", true]], "sekino (ccresponse)": [[1704, "term-SEKINO-CCRESPONSE", true]], "semicanonical (ccenergy)": [[1704, "term-SEMICANONICAL-CCENERGY", true]], "semicanonical (cceom)": [[1704, "term-SEMICANONICAL-CCEOM", true]], "semicanonical (cctransort)": [[1704, "term-SEMICANONICAL-CCTRANSORT", true]], "semicanonical (cctriples)": [[1704, "term-SEMICANONICAL-CCTRIPLES", true]], "semicanonical_orbs() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.semicanonical_orbs", false]], "semicanonicalize() (psi4.core.hf method)": [[84, "psi4.core.HF.semicanonicalize", false]], "set() (psi4.core.intvector method)": [[88, "psi4.core.IntVector.set", false]], "set() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.set", false]], "set() (psi4.core.vector method)": [[148, "psi4.core.Vector.set", false]], "set_aa_int_name() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.set_aa_int_name", false]], "set_ab_int_name() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.set_ab_int_name", false]], "set_active_fragment() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.set_active_fragment", false]], "set_active_fragments() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.set_active_fragments", false]], "set_active_molecule() (in module psi4.core)": [[243, "psi4.core.set_active_molecule", false]], "set_alpha() (psi4.core.functional method)": [[80, "psi4.core.Functional.set_alpha", false]], "set_ansatz() (psi4.core.pointfunctions method)": [[119, "psi4.core.PointFunctions.set_ansatz", false]], "set_ao_core() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.set_AO_core", false]], "set_array() (psi4.core.options method)": [[114, "psi4.core.Options.set_array", false]], "set_array() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.set_array", false]], "set_array_variable() (in module psi4.core)": [[244, "psi4.core.set_array_variable", false]], "set_array_variable() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.set_array_variable", false]], "set_atomic_fit_bases() (psi4.core.sadguess method)": [[131, "psi4.core.SADGuess.set_atomic_fit_bases", false]], "set_basis() (psi4.driver.atomiccomputer class method)": [[265, "psi4.driver.AtomicComputer.set_basis", false]], "set_basis_all_atoms() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.set_basis_all_atoms", false]], "set_basis_by_label() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.set_basis_by_label", false]], "set_basis_by_number() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.set_basis_by_number", false]], "set_basis_by_symbol() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.set_basis_by_symbol", false]], "set_basisset() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.set_basisset", false]], "set_basisset() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.set_basisset", false]], "set_bb_int_name() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.set_bb_int_name", false]], "set_bibtex() (psi4.core.dispersion method)": [[68, "psi4.core.Dispersion.set_bibtex", false]], "set_block() (psi4.core.intvector method)": [[88, "psi4.core.IntVector.set_block", false]], "set_block() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.set_block", false]], "set_block() (psi4.core.vector method)": [[148, "psi4.core.Vector.set_block", false]], "set_bool() (psi4.core.options method)": [[114, "psi4.core.Options.set_bool", false]], "set_bsse_type() (psi4.driver.driver_nbody.manybodycomputer class method)": [[1794, "psi4.driver.driver_nbody.ManyBodyComputer.set_bsse_type", false]], "set_c_alpha() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.set_c_alpha", false]], "set_c_omega() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.set_c_omega", false]], "set_c_os_alpha() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.set_c_os_alpha", false]], "set_c_ss_alpha() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.set_c_ss_alpha", false]], "set_camera() (psi4.driver.p4util.inpsight method)": [[323, "psi4.driver.p4util.InPsight.set_camera", false]], "set_ci_guess() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.set_ci_guess", false]], "set_citation() (psi4.core.dispersion method)": [[68, "psi4.core.Dispersion.set_citation", false]], "set_citation() (psi4.core.functional method)": [[80, "psi4.core.Functional.set_citation", false]], "set_citation() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.set_citation", false]], "set_color() (psi4.driver.p4util.inpsight method)": [[323, "psi4.driver.p4util.InPsight.set_color", false]], "set_comment() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.set_comment", false]], "set_connectivity() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.set_connectivity", false]], "set_cosx_grid() (psi4.core.compositejk method)": [[18, "psi4.core.CompositeJK.set_COSX_grid", false]], "set_current_module() (psi4.core.options method)": [[114, "psi4.core.Options.set_current_module", false]], "set_cutoff() (psi4.core.jk method)": [[92, "psi4.core.JK.set_cutoff", false]], "set_d() (psi4.core.vbase method)": [[147, "psi4.core.VBase.set_D", false]], "set_da_ao() (psi4.core.oeprop method)": [[111, "psi4.core.OEProp.set_Da_ao", false]], "set_da_mo() (psi4.core.oeprop method)": [[111, "psi4.core.OEProp.set_Da_mo", false]], "set_da_so() (psi4.core.oeprop method)": [[111, "psi4.core.OEProp.set_Da_so", false]], "set_datadir() (in module psi4.core)": [[245, "psi4.core.set_datadir", false]], "set_db_ao() (psi4.core.oeprop method)": [[111, "psi4.core.OEProp.set_Db_ao", false]], "set_db_mo() (psi4.core.oeprop method)": [[111, "psi4.core.OEProp.set_Db_mo", false]], "set_db_so() (psi4.core.oeprop method)": [[111, "psi4.core.OEProp.set_Db_so", false]], "set_debug() (psi4.core.sadguess method)": [[131, "psi4.core.SADGuess.set_debug", false]], "set_debug() (psi4.core.vbase method)": [[147, "psi4.core.VBase.set_debug", false]], "set_default_namespace() (psi4.core.io static method)": [[86, "psi4.core.IO.set_default_namespace", false]], "set_default_path() (psi4.core.iomanager method)": [[87, "psi4.core.IOManager.set_default_path", false]], "set_define() (psi4.driver.p4util.inpsight method)": [[323, "psi4.driver.p4util.InPsight.set_define", false]], "set_delta() (psi4.core.basisextents method)": [[6, "psi4.core.BasisExtents.set_delta", false]], "set_density_cutoff() (psi4.core.functional method)": [[80, "psi4.core.Functional.set_density_cutoff", false]], "set_density_cutoff() (psi4.core.libxcfunctional method)": [[96, "psi4.core.LibXCFunctional.set_density_cutoff", false]], "set_density_tolerance() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.set_density_tolerance", false]], "set_deriv() (psi4.core.basisfunctions method)": [[7, "psi4.core.BasisFunctions.set_deriv", false]], "set_deriv() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.set_deriv", false]], "set_deriv_density_backtransformed() (psi4.core.deriv method)": [[61, "psi4.core.Deriv.set_deriv_density_backtransformed", false]], "set_description() (psi4.core.dispersion method)": [[68, "psi4.core.Dispersion.set_description", false]], "set_description() (psi4.core.functional method)": [[80, "psi4.core.Functional.set_description", false]], "set_description() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.set_description", false]], "set_do_j() (psi4.core.jk method)": [[92, "psi4.core.JK.set_do_J", false]], "set_do_k() (psi4.core.jk method)": [[92, "psi4.core.JK.set_do_K", false]], "set_do_vv10() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.set_do_vv10", false]], "set_do_wk() (psi4.core.jk method)": [[92, "psi4.core.JK.set_do_wK", false]], "set_double() (psi4.core.options method)": [[114, "psi4.core.Options.set_double", false]], "set_dpd_id() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.set_dpd_id", false]], "set_dpd_int_file() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.set_dpd_int_file", false]], "set_driver() (psi4.driver.driver_findif.finitedifferencecomputer class method)": [[1772, "psi4.driver.driver_findif.FiniteDifferenceComputer.set_driver", false]], "set_embedding_charges() (psi4.driver.driver_nbody.manybodycomputer class method)": [[1794, "psi4.driver.driver_nbody.ManyBodyComputer.set_embedding_charges", false]], "set_energies() (psi4.core.hf method)": [[84, "psi4.core.HF.set_energies", false]], "set_energy() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.set_energy", false]], "set_external_cpscf_perturbation() (psi4.core.hf method)": [[84, "psi4.core.HF.set_external_cpscf_perturbation", false]], "set_external_potential() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.set_external_potential", false]], "set_full_geometry() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.set_full_geometry", false]], "set_geometry() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.set_geometry", false]], "set_gga() (psi4.core.functional method)": [[80, "psi4.core.Functional.set_gga", false]], "set_ghost_fragment() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.set_ghost_fragment", false]], "set_ghost_fragments() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.set_ghost_fragments", false]], "set_global_option() (in module psi4.core)": [[246, "psi4.core.set_global_option", false]], "set_global_option_python() (in module psi4.core)": [[247, "psi4.core.set_global_option_python", false]], "set_grac_alpha() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.set_grac_alpha", false]], "set_grac_beta() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.set_grac_beta", false]], "set_grac_shift() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.set_grac_shift", false]], "set_gradient() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.set_gradient", false]], "set_hessian() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.set_hessian", false]], "set_ignore_reference() (psi4.core.deriv method)": [[61, "psi4.core.Deriv.set_ignore_reference", false]], "set_input_units_to_au() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.set_input_units_to_au", false]], "set_int() (psi4.core.options method)": [[114, "psi4.core.Options.set_int", false]], "set_jk() (psi4.core.hf method)": [[84, "psi4.core.HF.set_jk", false]], "set_keep_dpd_so_ints() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.set_keep_dpd_so_ints", false]], "set_keep_ht_ints() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.set_keep_ht_ints", false]], "set_keep_iwl_so_ints() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.set_keep_iwl_so_ints", false]], "set_keywords() (psi4.driver.atomiccomputer class method)": [[265, "psi4.driver.AtomicComputer.set_keywords", false]], "set_lagrangian() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.set_lagrangian", false]], "set_local_option() (in module psi4.core)": [[248, "psi4.core.set_local_option", false]], "set_local_option_python() (in module psi4.core)": [[249, "psi4.core.set_local_option_python", false]], "set_lock() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.set_lock", false]], "set_lsda_cutoff() (psi4.core.functional method)": [[80, "psi4.core.Functional.set_lsda_cutoff", false]], "set_mass() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.set_mass", false]], "set_max_nbody() (psi4.driver.driver_nbody.manybodycomputer class method)": [[1794, "psi4.driver.driver_nbody.ManyBodyComputer.set_max_nbody", false]], "set_max_points() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.set_max_points", false]], "set_memory() (in module psi4.driver)": [[395, "psi4.driver.set_memory", false]], "set_memory() (in module psi4.driver.p4util)": [[374, "psi4.driver.p4util.set_memory", false]], "set_memory() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.set_memory", false]], "set_memory() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.set_memory", false]], "set_memory() (psi4.core.jk method)": [[92, "psi4.core.JK.set_memory", false]], "set_memory_bytes() (in module psi4.core)": [[250, "psi4.core.set_memory_bytes", false]], "set_meta() (psi4.core.functional method)": [[80, "psi4.core.Functional.set_meta", false]], "set_meta_cutoff() (psi4.core.functional method)": [[80, "psi4.core.Functional.set_meta_cutoff", false]], "set_method() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.set_method", false]], "set_method() (psi4.driver.atomiccomputer class method)": [[265, "psi4.driver.AtomicComputer.set_method", false]], "set_mo_core() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.set_MO_core", false]], "set_module() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.set_module", false]], "set_module_options() (in module psi4.driver)": [[396, "psi4.driver.set_module_options", false]], "set_module_options() (in module psi4.driver.p4util)": [[375, "psi4.driver.p4util.set_module_options", false]], "set_molecular_charge() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.set_molecular_charge", false]], "set_molecule() (psi4.driver.driver_cbs.compositecomputer class method)": [[1740, "psi4.driver.driver_cbs.CompositeComputer.set_molecule", false]], "set_molecule() (psi4.driver.driver_findif.finitedifferencecomputer class method)": [[1772, "psi4.driver.driver_findif.FiniteDifferenceComputer.set_molecule", false]], "set_molecule() (psi4.driver.driver_nbody.manybodycomputer class method)": [[1794, "psi4.driver.driver_nbody.ManyBodyComputer.set_molecule", false]], "set_multiplicity() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.set_multiplicity", false]], "set_name() (psi4.core.dispersion method)": [[68, "psi4.core.Dispersion.set_name", false]], "set_name() (psi4.core.functional method)": [[80, "psi4.core.Functional.set_name", false]], "set_name() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.set_name", false]], "set_name() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.set_name", false]], "set_name() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.set_name", false]], "set_names() (psi4.core.oeprop method)": [[111, "psi4.core.OEProp.set_names", false]], "set_nfragments() (psi4.driver.driver_nbody.manybodycomputer class method)": [[1794, "psi4.driver.driver_nbody.ManyBodyComputer.set_nfragments", false]], "set_nthreads() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.set_nthreads", false]], "set_nuclear_charge() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.set_nuclear_charge", false]], "set_num_threads() (in module psi4.core)": [[251, "psi4.core.set_num_threads", false]], "set_nvec() (psi4.core.civector method)": [[12, "psi4.core.CIVector.set_nvec", false]], "set_omega() (psi4.core.functional method)": [[80, "psi4.core.Functional.set_omega", false]], "set_omega() (psi4.core.jk method)": [[92, "psi4.core.JK.set_omega", false]], "set_omega() (psi4.core.libxcfunctional method)": [[96, "psi4.core.LibXCFunctional.set_omega", false]], "set_omega_alpha() (psi4.core.jk method)": [[92, "psi4.core.JK.set_omega_alpha", false]], "set_omega_beta() (psi4.core.jk method)": [[92, "psi4.core.JK.set_omega_beta", false]], "set_omp_nthread() (psi4.core.jk method)": [[92, "psi4.core.JK.set_omp_nthread", false]], "set_options() (in module psi4.driver)": [[397, "psi4.driver.set_options", false]], "set_options() (in module psi4.driver.p4util)": [[376, "psi4.driver.p4util.set_options", false]], "set_orbitals() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.set_orbitals", false]], "set_orbitals() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.set_orbitals", false]], "set_output_file() (in module psi4)": [[1768, "psi4.set_output_file", false]], "set_output_file() (in module psi4.core)": [[252, "psi4.core.set_output_file", false]], "set_parameter() (psi4.core.functional method)": [[80, "psi4.core.Functional.set_parameter", false]], "set_params() (psi4.core.correlationfactor method)": [[19, "psi4.core.CorrelationFactor.set_params", false]], "set_pid() (psi4.core.io method)": [[86, "psi4.core.IO.set_pid", false]], "set_point_group() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.set_point_group", false]], "set_pointers() (psi4.core.pointfunctions method)": [[119, "psi4.core.PointFunctions.set_pointers", false]], "set_postscf_density_label() (psi4.core.fchkwriter method)": [[74, "psi4.core.FCHKWriter.set_postscf_density_label", false]], "set_potential_variable() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.set_potential_variable", false]], "set_print() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.set_print", false]], "set_print() (psi4.core.jk method)": [[92, "psi4.core.JK.set_print", false]], "set_print() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.set_print", false]], "set_print() (psi4.core.sadguess method)": [[131, "psi4.core.SADGuess.set_print", false]], "set_print() (psi4.core.vbase method)": [[147, "psi4.core.VBase.set_print", false]], "set_print() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.set_print", false]], "set_provenance() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.set_provenance", false]], "set_psi_file_prefix() (in module psi4.core)": [[253, "psi4.core.set_psi_file_prefix", false]], "set_psio() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.set_psio", false]], "set_radius() (psi4.driver.p4util.inpsight method)": [[323, "psi4.driver.p4util.InPsight.set_radius", false]], "set_read_globals() (psi4.core.options method)": [[114, "psi4.core.Options.set_read_globals", false]], "set_reference_wavefunction() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.set_reference_wavefunction", false]], "set_return_total_data() (psi4.driver.driver_nbody.manybodycomputer class method)": [[1794, "psi4.driver.driver_nbody.ManyBodyComputer.set_return_total_data", false]], "set_sad_basissets() (psi4.core.hf method)": [[84, "psi4.core.HF.set_sad_basissets", false]], "set_sad_fitting_basissets() (psi4.core.hf method)": [[84, "psi4.core.HF.set_sad_fitting_basissets", false]], "set_scalar_variable() (in module psi4.core)": [[254, "psi4.core.set_scalar_variable", false]], "set_scalar_variable() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.set_scalar_variable", false]], "set_schwarz_cutoff() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.set_schwarz_cutoff", false]], "set_size() (psi4.driver.p4util.inpsight method)": [[323, "psi4.driver.p4util.InPsight.set_size", false]], "set_so_tei_file() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.set_so_tei_file", false]], "set_specific_path() (psi4.core.iomanager method)": [[87, "psi4.core.IOManager.set_specific_path", false]], "set_specific_retention() (psi4.core.iomanager method)": [[87, "psi4.core.IOManager.set_specific_retention", false]], "set_str() (psi4.core.options method)": [[114, "psi4.core.Options.set_str", false]], "set_str_i() (psi4.core.options method)": [[114, "psi4.core.Options.set_str_i", false]], "set_subalgo() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.set_subalgo", false]], "set_tei_already_presorted() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.set_tei_already_presorted", false]], "set_title() (psi4.core.oeprop method)": [[111, "psi4.core.OEProp.set_title", false]], "set_tpdm_already_presorted() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.set_tpdm_already_presorted", false]], "set_tpdm_presorted() (psi4.core.deriv method)": [[61, "psi4.core.Deriv.set_tpdm_presorted", false]], "set_tweak() (psi4.core.libxcfunctional method)": [[96, "psi4.core.LibXCFunctional.set_tweak", false]], "set_units() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.set_units", false]], "set_variable() (in module psi4.core)": [[255, "psi4.core.set_variable", false]], "set_variable() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.set_variable", false]], "set_variable() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.set_variable", false]], "set_view() (psi4.driver.p4util.inpsight method)": [[323, "psi4.driver.p4util.InPsight.set_view", false]], "set_vv10_b() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.set_vv10_b", false]], "set_vv10_c() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.set_vv10_c", false]], "set_wcombine() (psi4.core.jk method)": [[92, "psi4.core.JK.set_wcombine", false]], "set_write_dpd_so_tpdm() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.set_write_dpd_so_tpdm", false]], "set_x_alpha() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.set_x_alpha", false]], "set_x_beta() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.set_x_beta", false]], "set_x_omega() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.set_x_omega", false]], "set_xclib_description() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.set_xclib_description", false]], "setname() (psi4.core.externalpotential method)": [[73, "psi4.core.ExternalPotential.setName", false]], "setting": [[1740, "index-0", false], [1752, "index-0", false], [1761, "index-0", false], [1766, "index-0", false], [1772, "index-0", false], [1794, "index-1", false], [1800, "index-0", false], [1826, "index-0", false], [1832, "index-2", false], [1833, "index-2", false]], "setting keywords": [[1798, "index-2", false], [1798, "index-3", false], [1798, "index-4", false], [1798, "index-5", false], [1798, "index-6", false]], "sf_restrict (detci)": [[1704, "term-SF_RESTRICT-DETCI", true]], "shallow_copy() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.shallow_copy", false]], "shape (psi4.core.matrix attribute)": [[100, "psi4.core.Matrix.shape", false]], "shape (psi4.core.vector attribute)": [[148, "psi4.core.Vector.shape", false]], "shared_object() (psi4.core.io static method)": [[86, "psi4.core.IO.shared_object", false]], "shared_object() (psi4.core.iomanager static method)": [[87, "psi4.core.IOManager.shared_object", false]], "shell() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.shell", false]], "shell_extents() (psi4.core.basisextents method)": [[6, "psi4.core.BasisExtents.shell_extents", false]], "shell_on_center() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.shell_on_center", false]], "shell_significant() (psi4.core.twobodyaoint method)": [[143, "psi4.core.TwoBodyAOInt.shell_significant", false]], "shell_significant() (psi4.core.twoelectronint method)": [[144, "psi4.core.TwoElectronInt.shell_significant", false]], "shell_to_ao_function() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.shell_to_ao_function", false]], "shell_to_basis_function() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.shell_to_basis_function", false]], "shell_to_center() (psi4.core.basisset method)": [[8, "psi4.core.BasisSet.shell_to_center", false]], "shellinfo (class in psi4.core)": [[136, "psi4.core.ShellInfo", false]], "shells_iterator() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.shells_iterator", false]], "shells_local_to_global() (psi4.core.blockopoints method)": [[9, "psi4.core.BlockOPoints.shells_local_to_global", false]], "sherrill_gold_standard() (in module psi4.driver.aliases)": [[1740, "psi4.driver.aliases.sherrill_gold_standard", false]], "shift() (psi4.core.civector method)": [[12, "psi4.core.CIVector.shift", false]], "sigma() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.sigma", false]], "sigma_overlap (detci)": [[1704, "term-SIGMA_OVERLAP-DETCI", true]], "sigma_xy() (psi4.core.symmetryoperation method)": [[139, "psi4.core.SymmetryOperation.sigma_xy", false]], "sigma_xz() (psi4.core.symmetryoperation method)": [[139, "psi4.core.SymmetryOperation.sigma_xz", false]], "sigma_yz() (psi4.core.symmetryoperation method)": [[139, "psi4.core.SymmetryOperation.sigma_yz", false]], "simint": [[1839, "index-0", false]], "sinf_disp() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.sinf_disp", false]], "single-point": [[1766, "index-0", false]], "singles_print (cceom)": [[1704, "term-SINGLES_PRINT-CCEOM", true]], "sky (psi4.driver.p4util.inpsight attribute)": [[323, "psi4.driver.p4util.InPsight.sky", false]], "slice (class in psi4.core)": [[137, "psi4.core.Slice", false]], "small_cutoff (psimrcc)": [[1704, "term-SMALL_CUTOFF-PSIMRCC", true]], "snlink_basis_tolerance (scf)": [[1704, "term-SNLINK_BASIS_TOLERANCE-SCF", true]], "snlink_density_tolerance (scf)": [[1704, "term-SNLINK_DENSITY_TOLERANCE-SCF", true]], "snlink_force_cartesian (scf)": [[1704, "term-SNLINK_FORCE_CARTESIAN-SCF", true]], "snlink_gpu_mem (scf)": [[1704, "term-SNLINK_GPU_MEM-SCF", true]], "snlink_grid_batch_size (scf)": [[1704, "term-SNLINK_GRID_BATCH_SIZE-SCF", true]], "snlink_integrator_kernel (scf)": [[1704, "term-SNLINK_INTEGRATOR_KERNEL-SCF", true]], "snlink_ints_tolerance (scf)": [[1704, "term-SNLINK_INTS_TOLERANCE-SCF", true]], "snlink_load_balancer_kernel (scf)": [[1704, "term-SNLINK_LOAD_BALANCER_KERNEL-SCF", true]], "snlink_lwd_kernel (scf)": [[1704, "term-SNLINK_LWD_KERNEL-SCF", true]], "snlink_mol_weights_kernel (scf)": [[1704, "term-SNLINK_MOL_WEIGHTS_KERNEL-SCF", true]], "snlink_pruning_scheme (scf)": [[1704, "term-SNLINK_PRUNING_SCHEME-SCF", true]], "snlink_radial_points (scf)": [[1704, "term-SNLINK_RADIAL_POINTS-SCF", true]], "snlink_radial_scheme (scf)": [[1704, "term-SNLINK_RADIAL_SCHEME-SCF", true]], "snlink_reduction_kernel (scf)": [[1704, "term-SNLINK_REDUCTION_KERNEL-SCF", true]], "snlink_spherical_points (scf)": [[1704, "term-SNLINK_SPHERICAL_POINTS-SCF", true]], "snlink_use_debug_grid (scf)": [[1704, "term-SNLINK_USE_DEBUG_GRID-SCF", true]], "snlink_use_gpu (scf)": [[1704, "term-SNLINK_USE_GPU-SCF", true]], "sns-mp2": [[1806, "index-0", false]], "so_angular_momentum() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.so_angular_momentum", false]], "so_angular_momentum() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.so_angular_momentum", false]], "so_dipole() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.so_dipole", false]], "so_dipole() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.so_dipole", false]], "so_dkh() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.so_dkh", false]], "so_kinetic() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.so_kinetic", false]], "so_kinetic() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.so_kinetic", false]], "so_multipoles() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.so_multipoles", false]], "so_nabla() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.so_nabla", false]], "so_nabla() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.so_nabla", false]], "so_overlap() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.so_overlap", false]], "so_overlap() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.so_overlap", false]], "so_potential() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.so_potential", false]], "so_potential() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.so_potential", false]], "so_quadrupole() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.so_quadrupole", false]], "so_quadrupole() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.so_quadrupole", false]], "so_traceless_quadrupole() (psi4.core.integralfactory method)": [[89, "psi4.core.IntegralFactory.so_traceless_quadrupole", false]], "so_traceless_quadrupole() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.so_traceless_quadrupole", false]], "sobasisset (class in psi4.core)": [[132, "psi4.core.SOBasisSet", false]], "sobasisset() (psi4.core.mintshelper method)": [[103, "psi4.core.MintsHelper.sobasisset", false]], "sobasisset() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.sobasisset", false]], "socc (globals)": [[1704, "term-SOCC-GLOBALS", true]], "socc (mcscf)": [[1704, "term-SOCC-MCSCF", true]], "soccpi() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.soccpi", false]], "sofeff() (psi4.core.rohf method)": [[130, "psi4.core.ROHF.soFeff", false]], "solve() (psi4.core.somcscf method)": [[133, "psi4.core.SOMCSCF.solve", false]], "solver_convergence (cphf)": [[1704, "term-SOLVER_CONVERGENCE-CPHF", true]], "solver_convergence (scf)": [[1704, "term-SOLVER_CONVERGENCE-SCF", true]], "solver_maxiter (cphf)": [[1704, "term-SOLVER_MAXITER-CPHF", true]], "solver_maxiter (scf)": [[1704, "term-SOLVER_MAXITER-SCF", true]], "solver_n_guess (cphf)": [[1704, "term-SOLVER_N_GUESS-CPHF", true]], "solver_n_guess (scf)": [[1704, "term-SOLVER_N_GUESS-SCF", true]], "solver_n_root (scf)": [[1704, "term-SOLVER_N_ROOT-SCF", true]], "solver_precondition (cphf)": [[1704, "term-SOLVER_PRECONDITION-CPHF", true]], "solver_roots_per_irrep (scf)": [[1704, "term-SOLVER_ROOTS_PER_IRREP-SCF", true]], "solverengine (class in psi4.driver.p4util)": [[329, "psi4.driver.p4util.SolverEngine", false]], "somcscf (class in psi4.core)": [[133, "psi4.core.SOMCSCF", false]], "sos-mp2 correlation energy": [[1776, "psivar-SOS-MP2-CORRELATION-ENERGY", false]], "sos-mp2 total energy": [[1776, "psivar-SOS-MP2-TOTAL-ENERGY", false]], "sos-omp2 correlation energy": [[1776, "psivar-SOS-OMP2-CORRELATION-ENERGY", false]], "sos-omp2 total energy": [[1776, "psivar-SOS-OMP2-TOTAL-ENERGY", false]], "sos-omp3 correlation energy": [[1776, "psivar-SOS-OMP3-CORRELATION-ENERGY", false]], "sos-omp3 total energy": [[1776, "psivar-SOS-OMP3-TOTAL-ENERGY", false]], "sos-pi-mp2 correlation energy": [[1776, "psivar-SOS-PI-MP2-CORRELATION-ENERGY", false]], "sos-pi-mp2 total energy": [[1776, "psivar-SOS-PI-MP2-TOTAL-ENERGY", false]], "sos_type (dfocc)": [[1704, "term-SOS_TYPE-DFOCC", true]], "sos_type (occ)": [[1704, "term-SOS_TYPE-OCC", true]], "soscf": [[1838, "index-3", false]], "soscf (scf)": [[1704, "term-SOSCF-SCF", true]], "soscf_conv (scf)": [[1704, "term-SOSCF_CONV-SCF", true]], "soscf_max_iter (scf)": [[1704, "term-SOSCF_MAX_ITER-SCF", true]], "soscf_min_iter (scf)": [[1704, "term-SOSCF_MIN_ITER-SCF", true]], "soscf_print (scf)": [[1704, "term-SOSCF_PRINT-SCF", true]], "soscf_start_convergence (scf)": [[1704, "term-SOSCF_START_CONVERGENCE-SCF", true]], "soscf_update() (psi4.core.hf method)": [[84, "psi4.core.HF.soscf_update", false]], "sotoao() (psi4.core.petitelist method)": [[118, "psi4.core.PetiteList.sotoao", false]], "specification": [[1833, "index-0", false]], "spectrum() (in module psi4.driver.p4util)": [[377, "psi4.driver.p4util.spectrum", false]], "spin multiplicities of higher roots": [[1755, "index-3", false]], "spin_scale_type (occ)": [[1704, "term-SPIN_SCALE_TYPE-OCC", true]], "sr6() (psi4.core.dispersion method)": [[68, "psi4.core.Dispersion.sr6", false]], "ss_e_convergence (cceom)": [[1704, "term-SS_E_CONVERGENCE-CCEOM", true]], "ss_r_convergence (cceom)": [[1704, "term-SS_R_CONVERGENCE-CCEOM", true]], "ss_scale (occ)": [[1704, "term-SS_SCALE-OCC", true]], "ss_skip_diag (cceom)": [[1704, "term-SS_SKIP_DIAG-CCEOM", true]], "ss_vecs_per_root (cceom)": [[1704, "term-SS_VECS_PER_ROOT-CCEOM", true]], "ssapt0 disp energy": [[1776, "psivar-SSAPT0-DISP-ENERGY", false]], "ssapt0 elst energy": [[1776, "psivar-SSAPT0-ELST-ENERGY", false]], "ssapt0 exch energy": [[1776, "psivar-SSAPT0-EXCH-ENERGY", false]], "ssapt0 ind energy": [[1776, "psivar-SSAPT0-IND-ENERGY", false]], "ssapt0 total energy": [[1776, "psivar-SSAPT0-TOTAL-ENERGY", false]], "ssapt0_scale (fisapt)": [[1704, "term-SSAPT0_SCALE-FISAPT", true]], "stability_add_vectors (dct)": [[1704, "term-STABILITY_ADD_VECTORS-DCT", true]], "stability_analysis (scf)": [[1704, "term-STABILITY_ANALYSIS-SCF", true]], "stability_analysis() (psi4.core.hf method)": [[84, "psi4.core.HF.stability_analysis", false]], "stability_analysis() (psi4.core.uhf method)": [[145, "psi4.core.UHF.stability_analysis", false]], "stability_augment_space_tol (dct)": [[1704, "term-STABILITY_AUGMENT_SPACE_TOL-DCT", true]], "stability_check (dct)": [[1704, "term-STABILITY_CHECK-DCT", true]], "stability_convergence (dct)": [[1704, "term-STABILITY_CONVERGENCE-DCT", true]], "stability_max_space_size (dct)": [[1704, "term-STABILITY_MAX_SPACE_SIZE-DCT", true]], "stability_n_eigenvalues (dct)": [[1704, "term-STABILITY_N_EIGENVALUES-DCT", true]], "stability_n_guess_vectors (dct)": [[1704, "term-STABILITY_N_GUESS_VECTORS-DCT", true]], "state() (psi4.core.io method)": [[86, "psi4.core.IO.state", false]], "state_to_atomicinput() (in module psi4.driver.p4util)": [[378, "psi4.driver.p4util.state_to_atomicinput", false]], "stats (psi4.driver.managedmethoderror attribute)": [[268, "psi4.driver.ManagedMethodError.stats", false]], "stats (psi4.driver.tdscfconvergenceerror attribute)": [[277, "psi4.driver.TDSCFConvergenceError.stats", false]], "step_type (optking)": [[1704, "term-STEP_TYPE-OPTKING", true]], "subblocks (psi4.core.savetype attribute)": [[135, "psi4.core.SaveType.SubBlocks", false]], "subdegen() (psi4.core.correlationtable method)": [[20, "psi4.core.CorrelationTable.subdegen", false]], "subgroup() (psi4.core.correlationtable method)": [[20, "psi4.core.CorrelationTable.subgroup", false]], "subn() (psi4.core.correlationtable method)": [[20, "psi4.core.CorrelationTable.subn", false]], "subtaskcomputers (in module psi4.driver.driver_nbody)": [[1768, "psi4.driver.driver_nbody.SubTaskComputers", false]], "subtract() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.subtract", false]], "success (psi4.core.psireturntype attribute)": [[126, "psi4.core.PsiReturnType.Success", false]], "sum() (psi4.core.dimension method)": [[64, "psi4.core.Dimension.sum", false]], "sum_of_squares() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.sum_of_squares", false]], "summation_fields (pe)": [[1704, "term-SUMMATION_FIELDS-PE", true]], "superfunctional (class in psi4.core)": [[138, "psi4.core.SuperFunctional", false]], "symbol() (psi4.core.irreduciblerepresentation method)": [[91, "psi4.core.IrreducibleRepresentation.symbol", false]], "symbol() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.symbol", false]], "symbol() (psi4.core.pointgroup method)": [[120, "psi4.core.PointGroup.symbol", false]], "symm_operation() (psi4.core.charactertable method)": [[17, "psi4.core.CharacterTable.symm_operation", false]], "symmetrize (occ)": [[1704, "term-SYMMETRIZE-OCC", true]], "symmetrize() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.symmetrize", false]], "symmetrize_gradient() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.symmetrize_gradient", false]], "symmetry": [[1833, "index-2", false], [1833, "index-6", false]], "symmetry() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.symmetry", false]], "symmetry_from_input() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.symmetry_from_input", false]], "symmetryoperation (class in psi4.core)": [[139, "psi4.core.SymmetryOperation", false]], "symnormalize() (psi4.core.civector method)": [[12, "psi4.core.CIVector.symnormalize", false]], "t (thermo)": [[1704, "term-T-THERMO", true]], "t2_coupled (ccenergy)": [[1704, "term-T2_COUPLED-CCENERGY", true]], "t3_ws_incore (ccenergy)": [[1704, "term-T3_WS_INCORE-CCENERGY", true]], "t3_ws_incore (cceom)": [[1704, "term-T3_WS_INCORE-CCEOM", true]], "t_amps (cchbar)": [[1704, "term-T_AMPS-CCHBAR", true]], "t_cut_clmo (dlpno)": [[1704, "term-T_CUT_CLMO-DLPNO", true]], "t_cut_cpao (dlpno)": [[1704, "term-T_CUT_CPAO-DLPNO", true]], "t_cut_do (dlpno)": [[1704, "term-T_CUT_DO-DLPNO", true]], "t_cut_do_ij (dlpno)": [[1704, "term-T_CUT_DO_IJ-DLPNO", true]], "t_cut_do_pre (dlpno)": [[1704, "term-T_CUT_DO_PRE-DLPNO", true]], "t_cut_mkn (dlpno)": [[1704, "term-T_CUT_MKN-DLPNO", true]], "t_cut_pno (dlpno)": [[1704, "term-T_CUT_PNO-DLPNO", true]], "t_cut_pre (dlpno)": [[1704, "term-T_CUT_PRE-DLPNO", true]], "tag (psi4.driver.atomiccomputer attribute)": [[265, "psi4.driver.AtomicComputer.tag", false]], "tamm--dancoff approximation": [[1841, "index-0", false]], "task_list (psi4.driver.driver_cbs.compositecomputer attribute)": [[1740, "psi4.driver.driver_cbs.CompositeComputer.task_list", false]], "task_list (psi4.driver.driver_findif.finitedifferencecomputer attribute)": [[1772, "psi4.driver.driver_findif.FiniteDifferenceComputer.task_list", false]], "task_list (psi4.driver.driver_nbody.manybodycomputer attribute)": [[1794, "psi4.driver.driver_nbody.ManyBodyComputer.task_list", false]], "task_planner() (in module psi4.driver.task_planner)": [[1768, "psi4.driver.task_planner.task_planner", false]], "taskcomputers (in module psi4.driver.task_planner)": [[1768, "psi4.driver.task_planner.TaskComputers", false]], "td-fctl root 0 (h) -> root n (i) electric transition dipole moment (len)": [[1776, "psivar-TD-fctl-ROOT-0-h-ROOT-n-i-ELECTRIC-TRANSITION-DIPOLE-MOMENT-LEN", false]], "td-fctl root 0 (h) -> root n (i) electric transition dipole moment (vel)": [[1776, "psivar-TD-fctl-ROOT-0-h-ROOT-n-i-ELECTRIC-TRANSITION-DIPOLE-MOMENT-VEL", false]], "td-fctl root 0 (h) -> root n (i) excitation energy": [[1776, "psivar-TD-fctl-ROOT-0-h-ROOT-n-i-EXCITATION-ENERGY", false]], "td-fctl root 0 (h) -> root n (i) left eigenvector alpha": [[1776, "psivar-TD-fctl-ROOT-0-h-ROOT-n-i-LEFT-EIGENVECTOR-ALPHA", false]], "td-fctl root 0 (h) -> root n (i) left eigenvector beta": [[1776, "psivar-TD-fctl-ROOT-0-h-ROOT-n-i-LEFT-EIGENVECTOR-BETA", false]], "td-fctl root 0 (h) -> root n (i) magnetic transition dipole moment": [[1776, "psivar-TD-fctl-ROOT-0-h-ROOT-n-i-MAGNETIC-TRANSITION-DIPOLE-MOMENT", false]], "td-fctl root 0 (h) -> root n (i) oscillator strength (len)": [[1776, "psivar-TD-fctl-ROOT-0-h-ROOT-n-i-OSCILLATOR-STRENGTH-LEN", false]], "td-fctl root 0 (h) -> root n (i) oscillator strength (vel)": [[1776, "psivar-TD-fctl-ROOT-0-h-ROOT-n-i-OSCILLATOR-STRENGTH-VEL", false]], "td-fctl root 0 (h) -> root n (i) right eigenvector alpha": [[1776, "psivar-TD-fctl-ROOT-0-h-ROOT-n-i-RIGHT-EIGENVECTOR-ALPHA", false]], "td-fctl root 0 (h) -> root n (i) right eigenvector beta": [[1776, "psivar-TD-fctl-ROOT-0-h-ROOT-n-i-RIGHT-EIGENVECTOR-BETA", false]], "td-fctl root 0 (h) -> root n (i) rotatory strength (len)": [[1776, "psivar-TD-fctl-ROOT-0-h-ROOT-n-i-ROTATORY-STRENGTH-LEN", false]], "td-fctl root 0 (h) -> root n (i) rotatory strength (vel)": [[1776, "psivar-TD-fctl-ROOT-0-h-ROOT-n-i-ROTATORY-STRENGTH-VEL", false]], "td-fctl root 0 (in h) -> root n (in i) electric transition dipole moment (len)": [[1776, "psivar-TD-fctl-ROOT-0-IN-h-ROOT-n-IN-i-ELECTRIC-TRANSITION-DIPOLE-MOMENT-LEN", false]], "td-fctl root 0 (in h) -> root n (in i) electric transition dipole moment (vel)": [[1776, "psivar-TD-fctl-ROOT-0-IN-h-ROOT-n-IN-i-ELECTRIC-TRANSITION-DIPOLE-MOMENT-VEL", false]], "td-fctl root 0 (in h) -> root n (in i) excitation energy": [[1776, "psivar-TD-fctl-ROOT-0-IN-h-ROOT-n-IN-i-EXCITATION-ENERGY", false]], "td-fctl root 0 (in h) -> root n (in i) left eigenvector alpha": [[1776, "psivar-TD-fctl-ROOT-0-IN-h-ROOT-n-IN-i-LEFT-EIGENVECTOR-ALPHA", false]], "td-fctl root 0 (in h) -> root n (in i) left eigenvector beta": [[1776, "psivar-TD-fctl-ROOT-0-IN-h-ROOT-n-IN-i-LEFT-EIGENVECTOR-BETA", false]], "td-fctl root 0 (in h) -> root n (in i) magnetic transition dipole moment": [[1776, "psivar-TD-fctl-ROOT-0-IN-h-ROOT-n-IN-i-MAGNETIC-TRANSITION-DIPOLE-MOMENT", false]], "td-fctl root 0 (in h) -> root n (in i) oscillator strength (len)": [[1776, "psivar-TD-fctl-ROOT-0-IN-h-ROOT-n-IN-i-OSCILLATOR-STRENGTH-LEN", false]], "td-fctl root 0 (in h) -> root n (in i) oscillator strength (vel)": [[1776, "psivar-TD-fctl-ROOT-0-IN-h-ROOT-n-IN-i-OSCILLATOR-STRENGTH-VEL", false]], "td-fctl root 0 (in h) -> root n (in i) right eigenvector alpha": [[1776, "psivar-TD-fctl-ROOT-0-IN-h-ROOT-n-IN-i-RIGHT-EIGENVECTOR-ALPHA", false]], "td-fctl root 0 (in h) -> root n (in i) right eigenvector beta": [[1776, "psivar-TD-fctl-ROOT-0-IN-h-ROOT-n-IN-i-RIGHT-EIGENVECTOR-BETA", false]], "td-fctl root 0 (in h) -> root n (in i) rotatory strength (len)": [[1776, "psivar-TD-fctl-ROOT-0-IN-h-ROOT-n-IN-i-ROTATORY-STRENGTH-LEN", false]], "td-fctl root 0 (in h) -> root n (in i) rotatory strength (vel)": [[1776, "psivar-TD-fctl-ROOT-0-IN-h-ROOT-n-IN-i-ROTATORY-STRENGTH-VEL", false]], "td-fctl root 0 -> root n electric transition dipole moment (len)": [[1776, "psivar-TD-fctl-ROOT-0-ROOT-n-ELECTRIC-TRANSITION-DIPOLE-MOMENT-LEN", false]], "td-fctl root 0 -> root n electric transition dipole moment (len) - h transition": [[1776, "psivar-TD-fctl-ROOT-0-ROOT-n-ELECTRIC-TRANSITION-DIPOLE-MOMENT-LEN-h-TRANSITION", false]], "td-fctl root 0 -> root n electric transition dipole moment (vel)": [[1776, "psivar-TD-fctl-ROOT-0-ROOT-n-ELECTRIC-TRANSITION-DIPOLE-MOMENT-VEL", false]], "td-fctl root 0 -> root n electric transition dipole moment (vel) - h transition": [[1776, "psivar-TD-fctl-ROOT-0-ROOT-n-ELECTRIC-TRANSITION-DIPOLE-MOMENT-VEL-h-TRANSITION", false]], "td-fctl root 0 -> root n excitation energy": [[1776, "psivar-TD-fctl-ROOT-0-ROOT-n-EXCITATION-ENERGY", false]], "td-fctl root 0 -> root n excitation energy - h transition": [[1776, "psivar-TD-fctl-ROOT-0-ROOT-n-EXCITATION-ENERGY-h-TRANSITION", false]], "td-fctl root 0 -> root n left eigenvector alpha": [[1776, "psivar-TD-fctl-ROOT-0-ROOT-n-LEFT-EIGENVECTOR-ALPHA", false]], "td-fctl root 0 -> root n left eigenvector alpha - h transition": [[1776, "psivar-TD-fctl-ROOT-0-ROOT-n-LEFT-EIGENVECTOR-ALPHA-h-TRANSITION", false]], "td-fctl root 0 -> root n left eigenvector beta": [[1776, "psivar-TD-fctl-ROOT-0-ROOT-n-LEFT-EIGENVECTOR-BETA", false]], "td-fctl root 0 -> root n left eigenvector beta - h transition": [[1776, "psivar-TD-fctl-ROOT-0-ROOT-n-LEFT-EIGENVECTOR-BETA-h-TRANSITION", false]], "td-fctl root 0 -> root n magnetic transition dipole moment": [[1776, "psivar-TD-fctl-ROOT-0-ROOT-n-MAGNETIC-TRANSITION-DIPOLE-MOMENT", false]], "td-fctl root 0 -> root n magnetic transition dipole moment - h transition": [[1776, "psivar-TD-fctl-ROOT-0-ROOT-n-MAGNETIC-TRANSITION-DIPOLE-MOMENT-h-TRANSITION", false]], "td-fctl root 0 -> root n oscillator strength (len)": [[1776, "psivar-TD-fctl-ROOT-0-ROOT-n-OSCILLATOR-STRENGTH-LEN", false]], "td-fctl root 0 -> root n oscillator strength (len) - h transition": [[1776, "psivar-TD-fctl-ROOT-0-ROOT-n-OSCILLATOR-STRENGTH-LEN-h-TRANSITION", false]], "td-fctl root 0 -> root n oscillator strength (vel)": [[1776, "psivar-TD-fctl-ROOT-0-ROOT-n-OSCILLATOR-STRENGTH-VEL", false]], "td-fctl root 0 -> root n oscillator strength (vel) - h transition": [[1776, "psivar-TD-fctl-ROOT-0-ROOT-n-OSCILLATOR-STRENGTH-VEL-h-TRANSITION", false]], "td-fctl root 0 -> root n right eigenvector alpha": [[1776, "psivar-TD-fctl-ROOT-0-ROOT-n-RIGHT-EIGENVECTOR-ALPHA", false]], "td-fctl root 0 -> root n right eigenvector alpha - h transition": [[1776, "psivar-TD-fctl-ROOT-0-ROOT-n-RIGHT-EIGENVECTOR-ALPHA-h-TRANSITION", false]], "td-fctl root 0 -> root n right eigenvector beta": [[1776, "psivar-TD-fctl-ROOT-0-ROOT-n-RIGHT-EIGENVECTOR-BETA", false]], "td-fctl root 0 -> root n right eigenvector beta - h transition": [[1776, "psivar-TD-fctl-ROOT-0-ROOT-n-RIGHT-EIGENVECTOR-BETA-h-TRANSITION", false]], "td-fctl root 0 -> root n rotatory strength (len)": [[1776, "psivar-TD-fctl-ROOT-0-ROOT-n-ROTATORY-STRENGTH-LEN", false]], "td-fctl root 0 -> root n rotatory strength (len) - h transition": [[1776, "psivar-TD-fctl-ROOT-0-ROOT-n-ROTATORY-STRENGTH-LEN-h-TRANSITION", false]], "td-fctl root 0 -> root n rotatory strength (vel)": [[1776, "psivar-TD-fctl-ROOT-0-ROOT-n-ROTATORY-STRENGTH-VEL", false]], "td-fctl root 0 -> root n rotatory strength (vel) - h transition": [[1776, "psivar-TD-fctl-ROOT-0-ROOT-n-ROTATORY-STRENGTH-VEL-h-TRANSITION", false]], "td-fctl root n (h) total energy": [[1776, "psivar-TD-fctl-ROOT-n-h-TOTAL-ENERGY", false]], "td-fctl root n (in h) total energy": [[1776, "psivar-TD-fctl-ROOT-n-IN-h-TOTAL-ENERGY", false]], "td-fctl root n total energy": [[1776, "psivar-TD-fctl-ROOT-n-TOTAL-ENERGY", false]], "td-fctl root n total energy - h transition": [[1776, "psivar-TD-fctl-ROOT-n-TOTAL-ENERGY-h-TRANSITION", false]], "tda": [[1841, "index-0", false]], "tddft": [[1841, "index-0", false]], "tdm (detci)": [[1704, "term-TDM-DETCI", true]], "tdscf": [[1841, "index-0", false], [1841, "index-1", false]], "tdscf() (in module psi4.driver)": [[398, "psi4.driver.tdscf", false]], "tdscf_coeff_cutoff (scf)": [[1704, "term-TDSCF_COEFF_CUTOFF-SCF", true]], "tdscf_guess (scf)": [[1704, "term-TDSCF_GUESS-SCF", true]], "tdscf_maxiter (scf)": [[1704, "term-TDSCF_MAXITER-SCF", true]], "tdscf_print (scf)": [[1704, "term-TDSCF_PRINT-SCF", true]], "tdscf_r_convergence (scf)": [[1704, "term-TDSCF_R_CONVERGENCE-SCF", true]], "tdscf_states (scf)": [[1704, "term-TDSCF_STATES-SCF", true]], "tdscf_tda (scf)": [[1704, "term-TDSCF_TDA-SCF", true]], "tdscf_tdm_print (scf)": [[1704, "term-TDSCF_TDM_PRINT-SCF", true]], "tdscf_triplets (scf)": [[1704, "term-TDSCF_TRIPLETS-SCF", true]], "tdscfconvergenceerror": [[277, "psi4.driver.TDSCFConvergenceError", false]], "test_b (optking)": [[1704, "term-TEST_B-OPTKING", true]], "test_derivative_b (optking)": [[1704, "term-TEST_DERIVATIVE_B-OPTKING", true]], "test_functional() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.test_functional", false]], "test_matrix_dpd_interface() (in module psi4.core)": [[256, "psi4.core.test_matrix_dpd_interface", false]], "testcomparisonerror": [[278, "psi4.driver.TestComparisonError", false]], "the total electronic gradient [e_h/a0] of the mp2 level of theory, ({nat}, 3).": [[1776, "psivar-The-total-electronic-gradient-E_h-a0-of-the-MP2-level-of-theory-nat-3-.", false]], "theory": [[0, "index-2", false], [284, "index-0", false], [1740, "index-1", false], [1741, "index-0", false], [1742, "index-0", false], [1753, "index-0", false], [1755, "index-1", false], [1756, "index-1", false], [1757, "index-0", false], [1763, "index-1", false], [1770, "index-0", false], [1789, "index-1", false], [1798, "index-1", false], [1799, "index-0", false], [1837, "index-0", false], [1838, "index-1", false], [1841, "index-1", false]], "thermal energy": [[1776, "psivar-THERMAL-ENERGY", false]], "thermal energy correction": [[1776, "psivar-THERMAL-ENERGY-CORRECTION", false]], "thermo() (in module psi4.driver.qcdb.vib)": [[390, "psi4.driver.qcdb.vib.thermo", false]], "theta_points (scf)": [[1704, "term-THETA_POINTS-SCF", true]], "thickness (scf)": [[1704, "term-THICKNESS-SCF", true]], "threading": [[1767, "index-6", false], [1767, "index-9", false]], "three_particle (dct)": [[1704, "term-THREE_PARTICLE-DCT", true]], "threecenteroverlapint (class in psi4.core)": [[141, "psi4.core.ThreeCenterOverlapInt", false]], "tikhonow_max (psimrcc)": [[1704, "term-TIKHONOW_MAX-PSIMRCC", true]], "tikhonow_omega (dct)": [[1704, "term-TIKHONOW_OMEGA-DCT", true]], "tikhonow_omega (psimrcc)": [[1704, "term-TIKHONOW_OMEGA-PSIMRCC", true]], "tikhonow_triples (psimrcc)": [[1704, "term-TIKHONOW_TRIPLES-PSIMRCC", true]], "tile_sz (scf)": [[1704, "term-TILE_SZ-SCF", true]], "timer_off() (in module psi4.core)": [[257, "psi4.core.timer_off", false]], "timer_on() (in module psi4.core)": [[258, "psi4.core.timer_on", false]], "tlaplacedenominator (class in psi4.core)": [[140, "psi4.core.TLaplaceDenominator", false]], "to_array() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.to_array", false]], "to_array() (psi4.core.vector method)": [[148, "psi4.core.Vector.to_array", false]], "to_arrays() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.to_arrays", false]], "to_dict() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.to_dict", false]], "to_file() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.to_file", false]], "to_schema() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.to_schema", false]], "to_serial() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.to_serial", false]], "to_serial() (psi4.core.vector method)": [[148, "psi4.core.Vector.to_serial", false]], "to_string() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.to_string", false]], "to_tuple() (psi4.core.dimension method)": [[64, "psi4.core.Dimension.to_tuple", false]], "tocclean() (psi4.core.io method)": [[86, "psi4.core.IO.tocclean", false]], "tocentry_exists() (psi4.core.io method)": [[86, "psi4.core.IO.tocentry_exists", false]], "tocprint() (psi4.core.io method)": [[86, "psi4.core.IO.tocprint", false]], "tocscan() (psi4.core.io method)": [[86, "psi4.core.IO.tocscan", false]], "tocwrite() (psi4.core.io method)": [[86, "psi4.core.IO.tocwrite", false]], "total_index() (psi4.core.ccwavefunction method)": [[11, "psi4.core.CCWavefunction.total_index", false]], "tpdm (detci)": [[1704, "term-TPDM-DETCI", true]], "tpdm() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.tpdm", false]], "tpdm_abcd_type (occ)": [[1704, "term-TPDM_ABCD_TYPE-OCC", true]], "trace() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.trace", false]], "trace() (psi4.core.symmetryoperation method)": [[139, "psi4.core.SymmetryOperation.trace", false]], "tracelessquadrupoleint (class in psi4.core)": [[142, "psi4.core.TracelessQuadrupoleInt", false]], "transform() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.transform", false]], "transform() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.transform", false]], "transform() (psi4.core.symmetryoperation method)": [[139, "psi4.core.SymmetryOperation.transform", false]], "transform_ci_integrals() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.transform_ci_integrals", false]], "transform_mcscf_integrals() (psi4.core.ciwavefunction method)": [[13, "psi4.core.CIWavefunction.transform_mcscf_integrals", false]], "transform_tei() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.transform_tei", false]], "transform_tei_first_half() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.transform_tei_first_half", false]], "transform_tei_second_half() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.transform_tei_second_half", false]], "transition state": [[1802, "index-2", false]], "translate() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.translate", false]], "translate_psi4 (cfour)": [[1704, "term-TRANSLATE_PSI4-CFOUR", true]], "transpose() (psi4.core.dfhelper method)": [[27, "psi4.core.DFHelper.transpose", false]], "transpose() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.transpose", false]], "transpose() (psi4.core.symmetryoperation method)": [[139, "psi4.core.SymmetryOperation.transpose", false]], "transpose_this() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.transpose_this", false]], "tree_expansion_order (pe)": [[1704, "term-TREE_EXPANSION_ORDER-PE", true]], "tree_theta (pe)": [[1704, "term-TREE_THETA-PE", true]], "triples_algorithm (psimrcc)": [[1704, "term-TRIPLES_ALGORITHM-PSIMRCC", true]], "triples_diis (psimrcc)": [[1704, "term-TRIPLES_DIIS-PSIMRCC", true]], "triples_iabc_type (dfocc)": [[1704, "term-TRIPLES_IABC_TYPE-DFOCC", true]], "triples_low_memory (fnocc)": [[1704, "term-TRIPLES_LOW_MEMORY-FNOCC", true]], "triplet() (in module psi4.core)": [[259, "psi4.core.triplet", false]], "triplet() (psi4.core.matrix static method)": [[100, "psi4.core.Matrix.triplet", false]], "trove (psi4.driver.driver_cbs.compositecomputer attribute)": [[1740, "psi4.driver.driver_cbs.CompositeComputer.trove", false]], "true_atomic_number() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.true_atomic_number", false]], "tstart() (in module psi4.core)": [[260, "psi4.core.tstart", false]], "tstop() (in module psi4.core)": [[261, "psi4.core.tstop", false]], "turn_on_actv (mcscf)": [[1704, "term-TURN_ON_ACTV-MCSCF", true]], "two-electron energy": [[1776, "psivar-TWO-ELECTRON-ENERGY", false]], "twobodyaoint (class in psi4.core)": [[143, "psi4.core.TwoBodyAOInt", false]], "twoel_hx() (psi4.core.hf method)": [[84, "psi4.core.HF.twoel_Hx", false]], "twoel_hx_full() (psi4.core.rhf method)": [[128, "psi4.core.RHF.twoel_Hx_full", false]], "twoelectronint (class in psi4.core)": [[144, "psi4.core.TwoElectronInt", false]], "u (psi4.core.localizer attribute)": [[97, "psi4.core.Localizer.U", false]], "uhf (class in psi4.core)": [[145, "psi4.core.UHF", false]], "uhf_noons (scf)": [[1704, "term-UHF_NOONS-SCF", true]], "uksfunctions (class in psi4.core)": [[146, "psi4.core.UKSFunctions", false]], "uncp-corrected 2-body interaction energy": [[1776, "psivar-UNCP-CORRECTED-2-BODY-INTERACTION-ENERGY", false]], "unfreeze_dihedrals (optking)": [[1704, "term-UNFREEZE_DIHEDRALS-OPTKING", true]], "unify() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.unify", false]], "unify_part2() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.unify_part2", false]], "unit() (psi4.core.symmetryoperation method)": [[139, "psi4.core.SymmetryOperation.unit", false]], "units": [[1833, "index-2", false]], "units() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.units", false]], "unnormalized (psi4.core.primitivetype attribute)": [[122, "psi4.core.PrimitiveType.Unnormalized", false]], "up (psi4.driver.p4util.inpsight attribute)": [[323, "psi4.driver.p4util.InPsight.up", false]], "update (detci)": [[1704, "term-UPDATE-DETCI", true]], "update() (psi4.core.somcscf method)": [[133, "psi4.core.SOMCSCF.update", false]], "update_density() (psi4.core.twobodyaoint method)": [[143, "psi4.core.TwoBodyAOInt.update_density", false]], "update_geometry() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.update_geometry", false]], "update_geometry() (psi4.driver.p4util.inpsight method)": [[323, "psi4.driver.p4util.InPsight.update_geometry", false]], "update_orbitals() (psi4.core.integraltransform method)": [[90, "psi4.core.IntegralTransform.update_orbitals", false]], "upgradehelper": [[279, "psi4.driver.UpgradeHelper", false]], "use_df_ints (fnocc)": [[1704, "term-USE_DF_INTS-FNOCC", true]], "use_spin_sym (psimrcc)": [[1704, "term-USE_SPIN_SYM-PSIMRCC", true]], "use_spin_symmetry (psimrcc)": [[1704, "term-USE_SPIN_SYMMETRY-PSIMRCC", true]], "using pcm": [[1803, "index-1", false]], "using pe": [[1749, "index-1", false]], "v2rdm_casscf": [[1807, "index-0", false]], "v_potential() (psi4.core.hf method)": [[84, "psi4.core.HF.V_potential", false]], "va() (psi4.core.hf method)": [[84, "psi4.core.HF.Va", false]], "val_ex_level (detci)": [[1704, "term-VAL_EX_LEVEL-DETCI", true]], "valid_methods (psi4.core.oeprop attribute)": [[111, "psi4.core.OEProp.valid_methods", false]], "validate_diis() (psi4.core.hf method)": [[84, "psi4.core.HF.validate_diis", false]], "validate_options() (psi4.core.options method)": [[114, "psi4.core.Options.validate_options", false]], "validationerror": [[280, "psi4.driver.ValidationError", false]], "value (psi4.core.derivcalctype attribute)": [[62, "psi4.core.DerivCalcType.value", false]], "value (psi4.core.diagonalizeorder attribute)": [[63, "psi4.core.DiagonalizeOrder.value", false]], "value (psi4.core.fragmenttype attribute)": [[79, "psi4.core.FragmentType.value", false]], "value (psi4.core.gaussiantype attribute)": [[82, "psi4.core.GaussianType.value", false]], "value (psi4.core.geometryunits attribute)": [[83, "psi4.core.GeometryUnits.value", false]], "value (psi4.core.primitivetype attribute)": [[122, "psi4.core.PrimitiveType.value", false]], "value (psi4.core.psireturntype attribute)": [[126, "psi4.core.PsiReturnType.value", false]], "value (psi4.core.savetype attribute)": [[135, "psi4.core.SaveType.value", false]], "value() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.value", false]], "values() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.values", false]], "variable() (in module psi4.core)": [[262, "psi4.core.variable", false]], "variable() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.variable", false]], "variables() (in module psi4.core)": [[263, "psi4.core.variables", false]], "variables() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.variables", false]], "vb() (psi4.core.hf method)": [[84, "psi4.core.HF.Vb", false]], "vbase (class in psi4.core)": [[147, "psi4.core.VBase", false]], "vdot() (psi4.core.civector method)": [[12, "psi4.core.CIVector.vdot", false]], "vecs_cc3 (cceom)": [[1704, "term-VECS_CC3-CCEOM", true]], "vecs_per_root (cceom)": [[1704, "term-VECS_PER_ROOT-CCEOM", true]], "vector (class in psi4.core)": [[148, "psi4.core.Vector", false]], "vector3 (class in psi4.core)": [[149, "psi4.core.Vector3", false]], "vector_axpy() (psi4.driver.p4util.solverengine method)": [[329, "psi4.driver.p4util.SolverEngine.vector_axpy", false]], "vector_copy() (psi4.driver.p4util.solverengine method)": [[329, "psi4.driver.p4util.SolverEngine.vector_copy", false]], "vector_dot() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.vector_dot", false]], "vector_dot() (psi4.core.vector method)": [[148, "psi4.core.Vector.vector_dot", false]], "vector_dot() (psi4.driver.p4util.solverengine static method)": [[329, "psi4.driver.p4util.SolverEngine.vector_dot", false]], "vector_multiply() (psi4.core.civector method)": [[12, "psi4.core.CIVector.vector_multiply", false]], "vector_scale() (psi4.driver.p4util.solverengine method)": [[329, "psi4.driver.p4util.SolverEngine.vector_scale", false]], "vectors() (psi4.core.fisapt method)": [[76, "psi4.core.FISAPT.vectors", false]], "verbose (psi4.driver.driver_cbs.compositecomputer attribute)": [[1740, "psi4.driver.driver_cbs.CompositeComputer.verbose", false]], "version() (in module psi4.core)": [[264, "psi4.core.version", false]], "vibanal_wfn() (in module psi4.driver)": [[399, "psi4.driver.vibanal_wfn", false]], "vibrational analysis": [[1772, "index-0", false], [1843, "index-1", false]], "vir() (psi4.core.mospace static method)": [[98, "psi4.core.MOSpace.vir", false]], "visualization": [[1750, "index-0", false], [1791, "index-0", false]], "vmdpath": [[1750, "envvar-VMDPATH", false], [1750, "index-1", false]], "vmfc": [[1794, "index-1", false]], "vmfc (psi4.driver.driver_nbody.bsseenum attribute)": [[1794, "psi4.driver.driver_nbody.BsseEnum.vmfc", false]], "vv10_b() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.vv10_b", false]], "vv10_c() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.vv10_c", false]], "vvals() (psi4.core.oeprop method)": [[111, "psi4.core.OEProp.Vvals", false]], "w() (psi4.core.blockopoints method)": [[9, "psi4.core.BlockOPoints.w", false]], "wabei_lowdisk (cchbar)": [[1704, "term-WABEI_LOWDISK-CCHBAR", true]], "wavefunction (class in psi4.core)": [[150, "psi4.core.Wavefunction", false]], "wcombine (scf)": [[1704, "term-WCOMBINE-SCF", true]], "webmo": [[1791, "index-0", false]], "wfn (ccdensity)": [[1704, "term-WFN-CCDENSITY", true]], "wfn (ccenergy)": [[1704, "term-WFN-CCENERGY", true]], "wfn (cceom)": [[1704, "term-WFN-CCEOM", true]], "wfn (cchbar)": [[1704, "term-WFN-CCHBAR", true]], "wfn (cclambda)": [[1704, "term-WFN-CCLAMBDA", true]], "wfn (ccresponse)": [[1704, "term-WFN-CCRESPONSE", true]], "wfn (cctransort)": [[1704, "term-WFN-CCTRANSORT", true]], "wfn (cctriples)": [[1704, "term-WFN-CCTRIPLES", true]], "wfn (detci)": [[1704, "term-WFN-DETCI", true]], "wfn (globals)": [[1704, "term-WFN-GLOBALS", true]], "wfn (psi4.driver.optimizationconvergenceerror attribute)": [[270, "psi4.driver.OptimizationConvergenceError.wfn", false]], "wfn (psi4.driver.scfconvergenceerror attribute)": [[276, "psi4.driver.SCFConvergenceError.wfn", false]], "wfn (psi4.driver.tdscfconvergenceerror attribute)": [[277, "psi4.driver.TDSCFConvergenceError.wfn", false]], "wfn (scf)": [[1704, "term-WFN-SCF", true]], "wfn_sym (mcscf)": [[1704, "term-WFN_SYM-MCSCF", true]], "wfn_sym (psimrcc)": [[1704, "term-WFN_SYM-PSIMRCC", true]], "wfn_type (dfocc)": [[1704, "term-WFN_TYPE-DFOCC", true]], "wfn_type (occ)": [[1704, "term-WFN_TYPE-OCC", true]], "what (psi4.driver.tdscfconvergenceerror attribute)": [[277, "psi4.driver.TDSCFConvergenceError.what", false]], "wiberg lowdin indices": [[1776, "psivar-WIBERG-LOWDIN-INDICES", false]], "width (psi4.driver.p4util.inpsight attribute)": [[323, "psi4.driver.p4util.InPsight.width", false]], "wk() (psi4.core.jk method)": [[92, "psi4.core.JK.wK", false]], "write() (psi4.core.civector method)": [[12, "psi4.core.CIVector.write", false]], "write() (psi4.core.fchkwriter method)": [[74, "psi4.core.FCHKWriter.write", false]], "write() (psi4.core.moldenwriter method)": [[104, "psi4.core.MoldenWriter.write", false]], "write() (psi4.core.mowriter method)": [[99, "psi4.core.MOWriter.write", false]], "write_molden() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.write_molden", false]], "write_nbo() (psi4.core.wavefunction method)": [[150, "psi4.core.Wavefunction.write_nbo", false]], "write_nos (ccdensity)": [[1704, "term-WRITE_NOS-CCDENSITY", true]], "write_opt_history (optking)": [[1704, "term-WRITE_OPT_HISTORY-OPTKING", true]], "write_opt_result (optking)": [[1704, "term-WRITE_OPT_RESULT-OPTKING", true]], "write_scratch_file() (psi4.core.iomanager method)": [[87, "psi4.core.IOManager.write_scratch_file", false]], "write_trajectory (optking)": [[1704, "term-WRITE_TRAJECTORY-OPTKING", true]], "writer_file_label (globals)": [[1704, "term-WRITER_FILE_LABEL-GLOBALS", true]], "x() (psi4.core.blockopoints method)": [[9, "psi4.core.BlockOPoints.x", false]], "x() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.x", false]], "x_alpha() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.x_alpha", false]], "x_beta() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.x_beta", false]], "x_functional() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.x_functional", false]], "x_functionals() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.x_functionals", false]], "x_omega() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.x_omega", false]], "xc_build() (psi4.core.superfunctional static method)": [[138, "psi4.core.SuperFunctional.XC_build", false]], "xclib_description() (psi4.core.libxcfunctional method)": [[96, "psi4.core.LibXCFunctional.xclib_description", false]], "xclib_description() (psi4.core.superfunctional method)": [[138, "psi4.core.SuperFunctional.xclib_description", false]], "xi (ccdensity)": [[1704, "term-XI-CCDENSITY", true]], "xi_connect (ccdensity)": [[1704, "term-XI_CONNECT-CCDENSITY", true]], "xtpl_highest_1() (in module psi4.driver.driver_cbs_helper)": [[1740, "psi4.driver.driver_cbs_helper.xtpl_highest_1", false]], "xyz (psi4.core.salccomponent attribute)": [[134, "psi4.core.SalcComponent.xyz", false]], "xyz() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.xyz", false]], "y() (psi4.core.blockopoints method)": [[9, "psi4.core.BlockOPoints.y", false]], "y() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.y", false]], "z() (psi4.core.blockopoints method)": [[9, "psi4.core.BlockOPoints.z", false]], "z() (psi4.core.molecule method)": [[106, "psi4.core.Molecule.Z", false], [106, "psi4.core.Molecule.z", false]], "zaptn correlation energy": [[1776, "psivar-ZAPTn-CORRELATION-ENERGY", false]], "zaptn total energy": [[1776, "psivar-ZAPTn-TOTAL-ENERGY", false]], "zero k enthalpy": [[1776, "psivar-ZERO-K-ENTHALPY", false]], "zero() (psi4.core.civector method)": [[12, "psi4.core.CIVector.zero", false]], "zero() (psi4.core.dimension method)": [[64, "psi4.core.Dimension.zero", false]], "zero() (psi4.core.dpdbuf4 method)": [[183, "psi4.core.dpdbuf4.zero", false]], "zero() (psi4.core.dpdfile2 method)": [[184, "psi4.core.dpdfile2.zero", false]], "zero() (psi4.core.intvector method)": [[88, "psi4.core.IntVector.zero", false]], "zero() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.zero", false]], "zero() (psi4.core.symmetryoperation method)": [[139, "psi4.core.SymmetryOperation.zero", false]], "zero() (psi4.core.vector method)": [[148, "psi4.core.Vector.zero", false]], "zero_ao_basis_set() (psi4.core.basisset static method)": [[8, "psi4.core.BasisSet.zero_ao_basis_set", false]], "zero_diagonal() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.zero_diagonal", false]], "zero_internal_amps (psimrcc)": [[1704, "term-ZERO_INTERNAL_AMPS-PSIMRCC", true]], "zero_lower() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.zero_lower", false]], "zero_redundant() (psi4.core.somcscf method)": [[133, "psi4.core.SOMCSCF.zero_redundant", false]], "zero_upper() (psi4.core.matrix method)": [[100, "psi4.core.Matrix.zero_upper", false]], "zeta (ccdensity)": [[1704, "term-ZETA-CCDENSITY", true]], "zeta (cclambda)": [[1704, "term-ZETA-CCLAMBDA", true]], "zoom (psi4.driver.p4util.inpsight attribute)": [[323, "psi4.driver.p4util.InPsight.zoom", false]], "zpve": [[1776, "psivar-ZPVE", false]]}, "objects": {"": [[1776, 9, 1, "psivar-AT-CORRECTION-ENERGY", "(AT) CORRECTION ENERGY"], [1776, 9, 1, "psivar-0", "(T) CORRECTION ENERGY"], [1776, 9, 1, "psivar-2-BODY-PAIRWISE-DISPERSION-CORRECTION-ANALYSIS", "2-BODY PAIRWISE DISPERSION CORRECTION ANALYSIS"], [1776, 9, 1, "psivar-A-T-CORRECTION-ENERGY", "A-(T) CORRECTION ENERGY"], [1776, 9, 1, "psivar-A-CCSD-T-CORRELATION-ENERGY", "A-CCSD(T) CORRELATION ENERGY"], [1776, 9, 1, "psivar-A-CCSD-T-TOTAL-ENERGY", "A-CCSD(T) TOTAL ENERGY"], [1776, 9, 1, "psivar-AAA-T-CORRECTION-ENERGY", "AAA (T) CORRECTION ENERGY"], [1776, 9, 1, "psivar-AAB-T-CORRECTION-ENERGY", "AAB (T) CORRECTION ENERGY"], [1776, 9, 1, "psivar-ABB-T-CORRECTION-ENERGY", "ABB (T) CORRECTION ENERGY"], [1776, 9, 1, "psivar-ACPF-CORRELATION-ENERGY", "ACPF CORRELATION ENERGY"], [1776, 9, 1, "psivar-ACPF-DIPOLE", "ACPF DIPOLE"], [1776, 9, 1, "psivar-ACPF-DOUBLES-ENERGY", "ACPF DOUBLES ENERGY"], [1776, 9, 1, "psivar-ACPF-OPPOSITE-SPIN-CORRELATION-ENERGY", "ACPF OPPOSITE-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-ACPF-QUADRUPOLE", "ACPF QUADRUPOLE"], [1776, 9, 1, "psivar-ACPF-SAME-SPIN-CORRELATION-ENERGY", "ACPF SAME-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-ACPF-SINGLES-ENERGY", "ACPF SINGLES ENERGY"], [1776, 9, 1, "psivar-ACPF-TOTAL-ENERGY", "ACPF TOTAL ENERGY"], [1776, 9, 1, "psivar-ADC-ITERATIONS", "ADC ITERATIONS"], [1776, 9, 1, "psivar-ADC-ROOT-0-IN-h-ROOT-n-IN-i-ELECTRIC-TRANSITION-DIPOLE-MOMENT-LEN", "ADC ROOT 0 (IN h) -&gt; ROOT n (IN i) ELECTRIC TRANSITION DIPOLE MOMENT (LEN)"], [1776, 9, 1, "psivar-ADC-ROOT-0-IN-h-ROOT-n-IN-i-EXCITATION-ENERGY", "ADC ROOT 0 (IN h) -&gt; ROOT n (IN i) EXCITATION ENERGY"], [1776, 9, 1, "psivar-ADC-ROOT-0-IN-h-ROOT-n-IN-i-OSCILLATOR-STRENGTH-LEN", "ADC ROOT 0 (IN h) -&gt; ROOT n (IN i) OSCILLATOR STRENGTH (LEN)"], [1776, 9, 1, "psivar-ADC-ROOT-0-IN-h-ROOT-n-IN-i-OSCILLATOR-STRENGTH-VEL", "ADC ROOT 0 (IN h) -&gt; ROOT n (IN i) OSCILLATOR STRENGTH (VEL)"], [1776, 9, 1, "psivar-ADC-ROOT-0-IN-h-ROOT-n-IN-i-ROTATORY-STRENGTH-VEL", "ADC ROOT 0 (IN h) -&gt; ROOT n (IN i) ROTATORY STRENGTH (VEL)"], [1776, 9, 1, "psivar-ADC-ROOT-0-h-ROOT-n-i-ELECTRIC-TRANSITION-DIPOLE-MOMENT-LEN", "ADC ROOT 0 (h) -&gt; ROOT n (i) ELECTRIC TRANSITION DIPOLE MOMENT (LEN)"], [1776, 9, 1, "psivar-ADC-ROOT-0-h-ROOT-n-i-EXCITATION-ENERGY", "ADC ROOT 0 (h) -&gt; ROOT n (i) EXCITATION ENERGY"], [1776, 9, 1, "psivar-ADC-ROOT-0-h-ROOT-n-i-OSCILLATOR-STRENGTH-LEN", "ADC ROOT 0 (h) -&gt; ROOT n (i) OSCILLATOR STRENGTH (LEN)"], [1776, 9, 1, "psivar-ADC-ROOT-0-h-ROOT-n-i-OSCILLATOR-STRENGTH-VEL", "ADC ROOT 0 (h) -&gt; ROOT n (i) OSCILLATOR STRENGTH (VEL)"], [1776, 9, 1, "psivar-ADC-ROOT-0-h-ROOT-n-i-ROTATORY-STRENGTH-VEL", "ADC ROOT 0 (h) -&gt; ROOT n (i) ROTATORY STRENGTH (VEL)"], [1776, 9, 1, "psivar-ADC-ROOT-0-ROOT-n-ELECTRIC-TRANSITION-DIPOLE-MOMENT-LEN", "ADC ROOT 0 -&gt; ROOT n ELECTRIC TRANSITION DIPOLE MOMENT (LEN)"], [1776, 9, 1, "psivar-ADC-ROOT-0-ROOT-n-ELECTRIC-TRANSITION-DIPOLE-MOMENT-LEN-h-TRANSITION", "ADC ROOT 0 -&gt; ROOT n ELECTRIC TRANSITION DIPOLE MOMENT (LEN) - h TRANSITION"], [1776, 9, 1, "psivar-ADC-ROOT-0-ROOT-n-EXCITATION-ENERGY", "ADC ROOT 0 -&gt; ROOT n EXCITATION ENERGY"], [1776, 9, 1, "psivar-ADC-ROOT-0-ROOT-n-EXCITATION-ENERGY-h-TRANSITION", "ADC ROOT 0 -&gt; ROOT n EXCITATION ENERGY - h TRANSITION"], [1776, 9, 1, "psivar-ADC-ROOT-0-ROOT-n-OSCILLATOR-STRENGTH-LEN", "ADC ROOT 0 -&gt; ROOT n OSCILLATOR STRENGTH (LEN)"], [1776, 9, 1, "psivar-ADC-ROOT-0-ROOT-n-OSCILLATOR-STRENGTH-LEN-h-TRANSITION", "ADC ROOT 0 -&gt; ROOT n OSCILLATOR STRENGTH (LEN) - h TRANSITION"], [1776, 9, 1, "psivar-ADC-ROOT-0-ROOT-n-OSCILLATOR-STRENGTH-VEL", "ADC ROOT 0 -&gt; ROOT n OSCILLATOR STRENGTH (VEL)"], [1776, 9, 1, "psivar-ADC-ROOT-0-ROOT-n-OSCILLATOR-STRENGTH-VEL-h-TRANSITION", "ADC ROOT 0 -&gt; ROOT n OSCILLATOR STRENGTH (VEL) - h TRANSITION"], [1776, 9, 1, "psivar-ADC-ROOT-0-ROOT-n-ROTATORY-STRENGTH-VEL", "ADC ROOT 0 -&gt; ROOT n ROTATORY STRENGTH (VEL)"], [1776, 9, 1, "psivar-ADC-ROOT-0-ROOT-n-ROTATORY-STRENGTH-VEL-h-TRANSITION", "ADC ROOT 0 -&gt; ROOT n ROTATORY STRENGTH (VEL) - h TRANSITION"], [1776, 9, 1, "psivar-AQCC-CORRELATION-ENERGY", "AQCC CORRELATION ENERGY"], [1776, 9, 1, "psivar-AQCC-DIPOLE", "AQCC DIPOLE"], [1776, 9, 1, "psivar-AQCC-DOUBLES-ENERGY", "AQCC DOUBLES ENERGY"], [1776, 9, 1, "psivar-AQCC-OPPOSITE-SPIN-CORRELATION-ENERGY", "AQCC OPPOSITE-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-AQCC-QUADRUPOLE", "AQCC QUADRUPOLE"], [1776, 9, 1, "psivar-AQCC-SAME-SPIN-CORRELATION-ENERGY", "AQCC SAME-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-AQCC-SINGLES-ENERGY", "AQCC SINGLES ENERGY"], [1776, 9, 1, "psivar-AQCC-TOTAL-ENERGY", "AQCC TOTAL ENERGY"], [1776, 9, 1, "psivar-BBB-T-CORRECTION-ENERGY", "BBB (T) CORRECTION ENERGY"], [1735, 10, 1, "-", "BRIANQC_ENABLE"], [1735, 10, 1, "-", "BRIANQC_INSTALL_PATH"], [1735, 10, 1, "-", "BRIANQC_SDK_INSTALL"], [1776, 9, 1, "psivar-BRUECKNER-CONVERGED", "BRUECKNER CONVERGED"], [1776, 9, 1, "psivar-CBS-CORRELATION-ENERGY", "CBS CORRELATION ENERGY"], [1776, 9, 1, "psivar-CBS-NUMBER", "CBS NUMBER"], [1776, 9, 1, "psivar-CBS-REFERENCE-ENERGY", "CBS REFERENCE ENERGY"], [1776, 9, 1, "psivar-CBS-TOTAL-ENERGY", "CBS TOTAL ENERGY"], [1776, 9, 1, "psivar-CC-ALPHA-ALPHA-PAIR-ENERGIES", "CC ALPHA-ALPHA PAIR ENERGIES"], [1776, 9, 1, "psivar-CC-ALPHA-BETA-PAIR-ENERGIES", "CC ALPHA-BETA PAIR ENERGIES"], [1776, 9, 1, "psivar-CC-CORRELATION-ENERGY", "CC CORRELATION ENERGY"], [1776, 9, 1, "psivar-CC-CORRELATION-KINETIC-ENERGY", "CC CORRELATION KINETIC ENERGY"], [1776, 9, 1, "psivar-CC-CORRELATION-POTENTIAL-ENERGY", "CC CORRELATION POTENTIAL ENERGY"], [1776, 9, 1, "psivar-CC-CORRELATION-VIRIAL-RATIO", "CC CORRELATION VIRIAL RATIO"], [1776, 9, 1, "psivar-CC-D1-DIAGNOSTIC", "CC D1 DIAGNOSTIC"], [1776, 9, 1, "psivar-CC-D2-DIAGNOSTIC", "CC D2 DIAGNOSTIC"], [1776, 9, 1, "psivar-CC-DIPOLE", "CC DIPOLE"], [1776, 9, 1, "psivar-CC-NEW-D1-DIAGNOSTIC", "CC NEW D1 DIAGNOSTIC"], [1776, 9, 1, "psivar-CC-SINGLET-PAIR-ENERGIES", "CC SINGLET PAIR ENERGIES"], [1776, 9, 1, "psivar-CC-T1-DIAGNOSTIC", "CC T1 DIAGNOSTIC"], [1776, 9, 1, "psivar-CC-TOTAL-ENERGY", "CC TOTAL ENERGY"], [1776, 9, 1, "psivar-CC-TRIPLET-PAIR-ENERGIES", "CC TRIPLET PAIR ENERGIES"], [1776, 9, 1, "psivar-CC-VIRIAL-RATIO", "CC VIRIAL RATIO"], [1776, 9, 1, "psivar-CC-n-1-n-CORRELATION-ENERGY", "CC(n-1)(n) CORRELATION ENERGY"], [1776, 9, 1, "psivar-CC-n-1-n-TOTAL-ENERGY", "CC(n-1)(n) TOTAL ENERGY"], [1776, 9, 1, "psivar-CC-n-1-n-_L-CORRELATION-ENERGY", "CC(n-1)(n)_L CORRELATION ENERGY"], [1776, 9, 1, "psivar-CC-n-1-n-_L-TOTAL-ENERGY", "CC(n-1)(n)_L TOTAL ENERGY"], [1776, 9, 1, "psivar-CC2-ALPHA-ALPHA-PAIR-ENERGIES", "CC2 ALPHA-ALPHA PAIR ENERGIES"], [1776, 9, 1, "psivar-CC2-ALPHA-BETA-PAIR-ENERGIES", "CC2 ALPHA-BETA PAIR ENERGIES"], [1776, 9, 1, "psivar-CC2-CORRELATION-ENERGY", "CC2 CORRELATION ENERGY"], [1776, 9, 1, "psivar-CC2-DIPOLE-POLARIZABILITY-xNM", "CC2 DIPOLE POLARIZABILITY @ xNM"], [1776, 9, 1, "psivar-CC2-DIPOLE-POLARIZABILITY-TENSOR-xNM", "CC2 DIPOLE POLARIZABILITY TENSOR @ xNM"], [1776, 9, 1, "psivar-CC2-QUADRUPOLE-POLARIZABILITY-xNM", "CC2 QUADRUPOLE POLARIZABILITY @ xNM"], [1776, 9, 1, "psivar-CC2-QUADRUPOLE-POLARIZABILITY-TENSOR-xNM", "CC2 QUADRUPOLE POLARIZABILITY TENSOR @ xNM"], [1776, 9, 1, "psivar-CC2-ROTATION-LEN-ORIGIN-DEPENDENCE-xNM", "CC2 ROTATION (LEN) ORIGIN-DEPENDENCE @ xNM"], [1776, 9, 1, "psivar-CC2-SINGLET-PAIR-ENERGIES", "CC2 SINGLET PAIR ENERGIES"], [1776, 9, 1, "psivar-CC2-SPECIFIC-ROTATION-LEN-xNM", "CC2 SPECIFIC ROTATION (LEN) @ xNM"], [1776, 9, 1, "psivar-CC2-SPECIFIC-ROTATION-MVG-xNM", "CC2 SPECIFIC ROTATION (MVG) @ xNM"], [1776, 9, 1, "psivar-CC2-SPECIFIC-ROTATION-VEL-xNM", "CC2 SPECIFIC ROTATION (VEL) @ xNM"], [1776, 9, 1, "psivar-CC2-TOTAL-ENERGY", "CC2 TOTAL ENERGY"], [1776, 9, 1, "psivar-CC2-TRIPLET-PAIR-ENERGIES", "CC2 TRIPLET PAIR ENERGIES"], [1776, 9, 1, "psivar-CC3-ALPHA-ALPHA-PAIR-ENERGIES", "CC3 ALPHA-ALPHA PAIR ENERGIES"], [1776, 9, 1, "psivar-CC3-ALPHA-BETA-PAIR-ENERGIES", "CC3 ALPHA-BETA PAIR ENERGIES"], [1776, 9, 1, "psivar-CC3-CORRELATION-ENERGY", "CC3 CORRELATION ENERGY"], [1776, 9, 1, "psivar-CC3-SINGLET-PAIR-ENERGIES", "CC3 SINGLET PAIR ENERGIES"], [1776, 9, 1, "psivar-CC3-TOTAL-ENERGY", "CC3 TOTAL ENERGY"], [1776, 9, 1, "psivar-CC3-TRIPLET-PAIR-ENERGIES", "CC3 TRIPLET PAIR ENERGIES"], [1776, 9, 1, "psivar-CC4-CORRELATION-ENERGY", "CC4 CORRELATION ENERGY"], [1776, 9, 1, "psivar-CC4-TOTAL-ENERGY", "CC4 TOTAL ENERGY"], [1776, 9, 1, "psivar-CCD-CORRELATION-ENERGY", "CCD CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCD-DOUBLES-ENERGY", "CCD DOUBLES ENERGY"], [1776, 9, 1, "psivar-CCD-OPPOSITE-SPIN-CORRELATION-ENERGY", "CCD OPPOSITE-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCD-SAME-SPIN-CORRELATION-ENERGY", "CCD SAME-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCD-SINGLES-ENERGY", "CCD SINGLES ENERGY"], [1776, 9, 1, "psivar-CCD-TOTAL-ENERGY", "CCD TOTAL ENERGY"], [1776, 9, 1, "psivar-CCSD-ALPHA-ALPHA-PAIR-ENERGIES", "CCSD ALPHA-ALPHA PAIR ENERGIES"], [1776, 9, 1, "psivar-CCSD-ALPHA-BETA-PAIR-ENERGIES", "CCSD ALPHA-BETA PAIR ENERGIES"], [1776, 9, 1, "psivar-CCSD-CORRELATION-ENERGY", "CCSD CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCSD-DIPOLE-POLARIZABILITY-xNM", "CCSD DIPOLE POLARIZABILITY @ xNM"], [1776, 9, 1, "psivar-CCSD-DIPOLE-POLARIZABILITY-TENSOR-xNM", "CCSD DIPOLE POLARIZABILITY TENSOR @ xNM"], [1776, 9, 1, "psivar-CCSD-DOUBLES-ENERGY", "CCSD DOUBLES ENERGY"], [1776, 9, 1, "psivar-CCSD-ITERATIONS", "CCSD ITERATIONS"], [1776, 9, 1, "psivar-CCSD-OPPOSITE-SPIN-CORRELATION-ENERGY", "CCSD OPPOSITE-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCSD-QUADRUPOLE-POLARIZABILITY-xNM", "CCSD QUADRUPOLE POLARIZABILITY @ xNM"], [1776, 9, 1, "psivar-CCSD-QUADRUPOLE-POLARIZABILITY-TENSOR-xNM", "CCSD QUADRUPOLE POLARIZABILITY TENSOR @ xNM"], [1776, 9, 1, "psivar-CCSD-ROTATION-LEN-ORIGIN-DEPENDENCE-xNM", "CCSD ROTATION (LEN) ORIGIN-DEPENDENCE @ xNM"], [1776, 9, 1, "psivar-CCSD-SAME-SPIN-CORRELATION-ENERGY", "CCSD SAME-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCSD-SINGLES-ENERGY", "CCSD SINGLES ENERGY"], [1776, 9, 1, "psivar-CCSD-SINGLET-PAIR-ENERGIES", "CCSD SINGLET PAIR ENERGIES"], [1776, 9, 1, "psivar-CCSD-SPECIFIC-ROTATION-LEN-xNM", "CCSD SPECIFIC ROTATION (LEN) @ xNM"], [1776, 9, 1, "psivar-CCSD-SPECIFIC-ROTATION-MVG-xNM", "CCSD SPECIFIC ROTATION (MVG) @ xNM"], [1776, 9, 1, "psivar-CCSD-SPECIFIC-ROTATION-VEL-xNM", "CCSD SPECIFIC ROTATION (VEL) @ xNM"], [1776, 9, 1, "psivar-CCSD-TOTAL-ENERGY", "CCSD TOTAL ENERGY"], [1776, 9, 1, "psivar-CCSD-TRIPLET-PAIR-ENERGIES", "CCSD TRIPLET PAIR ENERGIES"], [1776, 9, 1, "psivar-CCSD-AT-CORRELATION-ENERGY", "CCSD(AT) CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCSD-AT-TOTAL-ENERGY", "CCSD(AT) TOTAL ENERGY"], [1776, 9, 1, "psivar-CCSD-T-CORRELATION-ENERGY", "CCSD(T) CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCSD-T-TOTAL-ENERGY", "CCSD(T) TOTAL ENERGY"], [1776, 9, 1, "psivar-CCSD-T-_L-CORRELATION-ENERGY", "CCSD(T)_L CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCSD-T-_L-TOTAL-ENERGY", "CCSD(T)_L TOTAL ENERGY"], [1776, 9, 1, "psivar-CCSDT-CORRELATION-ENERGY", "CCSDT CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCSDT-TOTAL-ENERGY", "CCSDT TOTAL ENERGY"], [1776, 9, 1, "psivar-CCSDT-Q-CORRELATION-ENERGY", "CCSDT(Q) CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCSDT-Q-TOTAL-ENERGY", "CCSDT(Q) TOTAL ENERGY"], [1776, 9, 1, "psivar-CCSDT-Q-A-CORRELATION-ENERGY", "CCSDT(Q)/A CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCSDT-Q-A-TOTAL-ENERGY", "CCSDT(Q)/A TOTAL ENERGY"], [1776, 9, 1, "psivar-CCSDT-Q-B-CORRELATION-ENERGY", "CCSDT(Q)/B CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCSDT-Q-B-TOTAL-ENERGY", "CCSDT(Q)/B TOTAL ENERGY"], [1776, 9, 1, "psivar-CCSDT-Q-_L-CORRELATION-ENERGY", "CCSDT(Q)_L CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCSDT-Q-_L-TOTAL-ENERGY", "CCSDT(Q)_L TOTAL ENERGY"], [1776, 9, 1, "psivar-CCSDT-1a-CORRELATION-ENERGY", "CCSDT-1a CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCSDT-1a-TOTAL-ENERGY", "CCSDT-1a TOTAL ENERGY"], [1776, 9, 1, "psivar-CCSDT-1b-CORRELATION-ENERGY", "CCSDT-1b CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCSDT-1b-TOTAL-ENERGY", "CCSDT-1b TOTAL ENERGY"], [1776, 9, 1, "psivar-CCSDT-3-CORRELATION-ENERGY", "CCSDT-3 CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCSDT-3-TOTAL-ENERGY", "CCSDT-3 TOTAL ENERGY"], [1776, 9, 1, "psivar-CCSDTQ-CORRELATION-ENERGY", "CCSDTQ CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCSDTQ-TOTAL-ENERGY", "CCSDTQ TOTAL ENERGY"], [1776, 9, 1, "psivar-CCSDTQ-1a-CORRELATION-ENERGY", "CCSDTQ-1a CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCSDTQ-1a-TOTAL-ENERGY", "CCSDTQ-1a TOTAL ENERGY"], [1776, 9, 1, "psivar-CCSDTQ-1b-CORRELATION-ENERGY", "CCSDTQ-1b CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCSDTQ-1b-TOTAL-ENERGY", "CCSDTQ-1b TOTAL ENERGY"], [1776, 9, 1, "psivar-CCSDTQ-3-CORRELATION-ENERGY", "CCSDTQ-3 CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCSDTQ-3-TOTAL-ENERGY", "CCSDTQ-3 TOTAL ENERGY"], [1776, 9, 1, "psivar-CCn-CORRELATION-ENERGY", "CCn CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCn-TOTAL-ENERGY", "CCn TOTAL ENERGY"], [1776, 9, 1, "psivar-CCn-1a-CORRELATION-ENERGY", "CCn-1a CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCn-1a-TOTAL-ENERGY", "CCn-1a TOTAL ENERGY"], [1776, 9, 1, "psivar-CCn-1b-CORRELATION-ENERGY", "CCn-1b CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCn-1b-TOTAL-ENERGY", "CCn-1b TOTAL ENERGY"], [1776, 9, 1, "psivar-CCn-3-CORRELATION-ENERGY", "CCn-3 CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCn-3-TOTAL-ENERGY", "CCn-3 TOTAL ENERGY"], [1776, 9, 1, "psivar-CCname-ROOT-m-IN-h-ROOT-n-IN-i-EINSTEIN-A-LEN", "CCname ROOT m (IN h) -&gt; ROOT n (IN i) EINSTEIN A (LEN)"], [1776, 9, 1, "psivar-CCname-ROOT-m-IN-h-ROOT-n-IN-i-EINSTEIN-B-LEN", "CCname ROOT m (IN h) -&gt; ROOT n (IN i) EINSTEIN B (LEN)"], [1776, 9, 1, "psivar-CCname-ROOT-m-IN-h-ROOT-n-IN-i-OSCILLATOR-STRENGTH-LEN", "CCname ROOT m (IN h) -&gt; ROOT n (IN i) OSCILLATOR STRENGTH (LEN)"], [1776, 9, 1, "psivar-CCname-ROOT-m-IN-h-ROOT-n-IN-i-ROTATORY-STRENGTH-LEN", "CCname ROOT m (IN h) -&gt; ROOT n (IN i) ROTATORY STRENGTH (LEN)"], [1776, 9, 1, "psivar-CCname-ROOT-m-IN-h-ROOT-n-IN-i-ROTATORY-STRENGTH-VEL", "CCname ROOT m (IN h) -&gt; ROOT n (IN i) ROTATORY STRENGTH (VEL)"], [1776, 9, 1, "psivar-CCname-ROOT-m-h-ROOT-n-i-EINSTEIN-A-LEN", "CCname ROOT m (h) -&gt; ROOT n (i) EINSTEIN A (LEN)"], [1776, 9, 1, "psivar-CCname-ROOT-m-h-ROOT-n-i-EINSTEIN-B-LEN", "CCname ROOT m (h) -&gt; ROOT n (i) EINSTEIN B (LEN)"], [1776, 9, 1, "psivar-CCname-ROOT-m-h-ROOT-n-i-OSCILLATOR-STRENGTH-LEN", "CCname ROOT m (h) -&gt; ROOT n (i) OSCILLATOR STRENGTH (LEN)"], [1776, 9, 1, "psivar-CCname-ROOT-m-h-ROOT-n-i-ROTATORY-STRENGTH-LEN", "CCname ROOT m (h) -&gt; ROOT n (i) ROTATORY STRENGTH (LEN)"], [1776, 9, 1, "psivar-CCname-ROOT-m-h-ROOT-n-i-ROTATORY-STRENGTH-VEL", "CCname ROOT m (h) -&gt; ROOT n (i) ROTATORY STRENGTH (VEL)"], [1776, 9, 1, "psivar-CCname-ROOT-m-ROOT-n-EINSTEIN-A-LEN", "CCname ROOT m -&gt; ROOT n EINSTEIN A (LEN)"], [1776, 9, 1, "psivar-CCname-ROOT-m-ROOT-n-EINSTEIN-A-LEN-h-TRANSITION", "CCname ROOT m -&gt; ROOT n EINSTEIN A (LEN) - h TRANSITION"], [1776, 9, 1, "psivar-CCname-ROOT-m-ROOT-n-EINSTEIN-B-LEN", "CCname ROOT m -&gt; ROOT n EINSTEIN B (LEN)"], [1776, 9, 1, "psivar-CCname-ROOT-m-ROOT-n-EINSTEIN-B-LEN-h-TRANSITION", "CCname ROOT m -&gt; ROOT n EINSTEIN B (LEN) - h TRANSITION"], [1776, 9, 1, "psivar-CCname-ROOT-m-ROOT-n-OSCILLATOR-STRENGTH-LEN", "CCname ROOT m -&gt; ROOT n OSCILLATOR STRENGTH (LEN)"], [1776, 9, 1, "psivar-CCname-ROOT-m-ROOT-n-OSCILLATOR-STRENGTH-LEN-h-TRANSITION", "CCname ROOT m -&gt; ROOT n OSCILLATOR STRENGTH (LEN) - h TRANSITION"], [1776, 9, 1, "psivar-CCname-ROOT-m-ROOT-n-ROTATORY-STRENGTH-LEN", "CCname ROOT m -&gt; ROOT n ROTATORY STRENGTH (LEN)"], [1776, 9, 1, "psivar-CCname-ROOT-m-ROOT-n-ROTATORY-STRENGTH-LEN-h-TRANSITION", "CCname ROOT m -&gt; ROOT n ROTATORY STRENGTH (LEN) - h TRANSITION"], [1776, 9, 1, "psivar-CCname-ROOT-m-ROOT-n-ROTATORY-STRENGTH-VEL", "CCname ROOT m -&gt; ROOT n ROTATORY STRENGTH (VEL)"], [1776, 9, 1, "psivar-CCname-ROOT-m-ROOT-n-ROTATORY-STRENGTH-VEL-h-TRANSITION", "CCname ROOT m -&gt; ROOT n ROTATORY STRENGTH (VEL) - h TRANSITION"], [1776, 9, 1, "psivar-CCname-ROOT-n-IN-h-CORRELATION-ENERGY", "CCname ROOT n (IN h) CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCname-ROOT-n-IN-h-DIPOLE", "CCname ROOT n (IN h) DIPOLE"], [1776, 9, 1, "psivar-CCname-ROOT-n-IN-h-QUADRUPOLE", "CCname ROOT n (IN h) QUADRUPOLE"], [1776, 9, 1, "psivar-CCname-ROOT-n-IN-h-TOTAL-ENERGY", "CCname ROOT n (IN h) TOTAL ENERGY"], [1776, 9, 1, "psivar-CCname-ROOT-n-h-CORRELATION-ENERGY", "CCname ROOT n (h) CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCname-ROOT-n-h-DIPOLE", "CCname ROOT n (h) DIPOLE"], [1776, 9, 1, "psivar-CCname-ROOT-n-h-QUADRUPOLE", "CCname ROOT n (h) QUADRUPOLE"], [1776, 9, 1, "psivar-CCname-ROOT-n-h-TOTAL-ENERGY", "CCname ROOT n (h) TOTAL ENERGY"], [1776, 9, 1, "psivar-CCname-ROOT-n-CORRELATION-ENERGY", "CCname ROOT n CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCname-ROOT-n-CORRELATION-ENERGY-h-TRANSITION", "CCname ROOT n CORRELATION ENERGY - h TRANSITION"], [1776, 9, 1, "psivar-CCname-ROOT-n-DIPOLE", "CCname ROOT n DIPOLE"], [1776, 9, 1, "psivar-CCname-ROOT-n-DIPOLE-h-TRANSITION", "CCname ROOT n DIPOLE - h TRANSITION"], [1776, 9, 1, "psivar-CCname-ROOT-n-QUADRUPOLE", "CCname ROOT n QUADRUPOLE"], [1776, 9, 1, "psivar-CCname-ROOT-n-QUADRUPOLE-h-TRANSITION", "CCname ROOT n QUADRUPOLE - h TRANSITION"], [1776, 9, 1, "psivar-CCname-ROOT-n-TOTAL-ENERGY", "CCname ROOT n TOTAL ENERGY"], [1776, 9, 1, "psivar-CCname-ROOT-n-TOTAL-ENERGY-h-TRANSITION", "CCname ROOT n TOTAL ENERGY - h TRANSITION"], [1776, 9, 1, "psivar-CCnn-CORRELATION-ENERGY", "CCnn CORRELATION ENERGY"], [1776, 9, 1, "psivar-CCnn-TOTAL-ENERGY", "CCnn TOTAL ENERGY"], [1776, 9, 1, "psivar-CEPA-0-CORRELATION-ENERGY", "CEPA(0) CORRELATION ENERGY"], [1776, 9, 1, "psivar-CEPA-0-DIPOLE", "CEPA(0) DIPOLE"], [1776, 9, 1, "psivar-CEPA-0-DOUBLES-ENERGY", "CEPA(0) DOUBLES ENERGY"], [1776, 9, 1, "psivar-CEPA-0-OPPOSITE-SPIN-CORRELATION-ENERGY", "CEPA(0) OPPOSITE-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-CEPA-0-QUADRUPOLE", "CEPA(0) QUADRUPOLE"], [1776, 9, 1, "psivar-CEPA-0-SAME-SPIN-CORRELATION-ENERGY", "CEPA(0) SAME-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-CEPA-0-SINGLES-ENERGY", "CEPA(0) SINGLES ENERGY"], [1776, 9, 1, "psivar-CEPA-0-TOTAL-ENERGY", "CEPA(0) TOTAL ENERGY"], [1776, 9, 1, "psivar-CEPA-1-CORRELATION-ENERGY", "CEPA(1) CORRELATION ENERGY"], [1776, 9, 1, "psivar-CEPA-1-DOUBLES-ENERGY", "CEPA(1) DOUBLES ENERGY"], [1776, 9, 1, "psivar-CEPA-1-OPPOSITE-SPIN-CORRELATION-ENERGY", "CEPA(1) OPPOSITE-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-CEPA-1-SAME-SPIN-CORRELATION-ENERGY", "CEPA(1) SAME-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-CEPA-1-SINGLES-ENERGY", "CEPA(1) SINGLES ENERGY"], [1776, 9, 1, "psivar-CEPA-1-TOTAL-ENERGY", "CEPA(1) TOTAL ENERGY"], [1776, 9, 1, "psivar-CEPA-2-CORRELATION-ENERGY", "CEPA(2) CORRELATION ENERGY"], [1776, 9, 1, "psivar-CEPA-2-DOUBLES-ENERGY", "CEPA(2) DOUBLES ENERGY"], [1776, 9, 1, "psivar-CEPA-2-OPPOSITE-SPIN-CORRELATION-ENERGY", "CEPA(2) OPPOSITE-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-CEPA-2-SAME-SPIN-CORRELATION-ENERGY", "CEPA(2) SAME-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-CEPA-2-SINGLES-ENERGY", "CEPA(2) SINGLES ENERGY"], [1776, 9, 1, "psivar-CEPA-2-TOTAL-ENERGY", "CEPA(2) TOTAL ENERGY"], [1776, 9, 1, "psivar-CEPA-3-CORRELATION-ENERGY", "CEPA(3) CORRELATION ENERGY"], [1776, 9, 1, "psivar-CEPA-3-DOUBLES-ENERGY", "CEPA(3) DOUBLES ENERGY"], [1776, 9, 1, "psivar-CEPA-3-OPPOSITE-SPIN-CORRELATION-ENERGY", "CEPA(3) OPPOSITE-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-CEPA-3-SAME-SPIN-CORRELATION-ENERGY", "CEPA(3) SAME-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-CEPA-3-SINGLES-ENERGY", "CEPA(3) SINGLES ENERGY"], [1776, 9, 1, "psivar-CEPA-3-TOTAL-ENERGY", "CEPA(3) TOTAL ENERGY"], [1776, 9, 1, "psivar-CFOUR-ERROR-CODE", "CFOUR ERROR CODE"], [1776, 9, 1, "psivar-CI-CORRELATION-ENERGY", "CI CORRELATION ENERGY"], [1776, 9, 1, "psivar-CI-DIPOLE", "CI DIPOLE"], [1776, 9, 1, "psivar-CI-QUADRUPOLE", "CI QUADRUPOLE"], [1776, 9, 1, "psivar-CI-ROOT-n-ROOT-m-DIPOLE", "CI ROOT n -&gt; ROOT m DIPOLE"], [1776, 9, 1, "psivar-CI-ROOT-n-ROOT-m-QUADRUPOLE", "CI ROOT n -&gt; ROOT m QUADRUPOLE"], [1776, 9, 1, "psivar-CI-ROOT-n-CORRELATION-ENERGY", "CI ROOT n CORRELATION ENERGY"], [1776, 9, 1, "psivar-CI-ROOT-n-DIPOLE", "CI ROOT n DIPOLE"], [1776, 9, 1, "psivar-CI-ROOT-n-QUADRUPOLE", "CI ROOT n QUADRUPOLE"], [1776, 9, 1, "psivar-CI-ROOT-n-TOTAL-ENERGY", "CI ROOT n TOTAL ENERGY"], [1776, 9, 1, "psivar-CI-STATE-AVERAGED-CORRELATION-ENERGY", "CI STATE-AVERAGED CORRELATION ENERGY"], [1776, 9, 1, "psivar-CI-STATE-AVERAGED-TOTAL-ENERGY", "CI STATE-AVERAGED TOTAL ENERGY"], [1776, 9, 1, "psivar-CI-TOTAL-ENERGY", "CI TOTAL ENERGY"], [1776, 9, 1, "psivar-CISD-CORRELATION-ENERGY", "CISD CORRELATION ENERGY"], [1776, 9, 1, "psivar-CISD-DIPOLE", "CISD DIPOLE"], [1776, 9, 1, "psivar-CISD-DOUBLES-ENERGY", "CISD DOUBLES ENERGY"], [1776, 9, 1, "psivar-CISD-OPPOSITE-SPIN-CORRELATION-ENERGY", "CISD OPPOSITE-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-CISD-QUADRUPOLE", "CISD QUADRUPOLE"], [1776, 9, 1, "psivar-CISD-SAME-SPIN-CORRELATION-ENERGY", "CISD SAME-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-CISD-SINGLES-ENERGY", "CISD SINGLES ENERGY"], [1776, 9, 1, "psivar-CISD-TOTAL-ENERGY", "CISD TOTAL ENERGY"], [1776, 9, 1, "psivar-CISDT-CORRELATION-ENERGY", "CISDT CORRELATION ENERGY"], [1776, 9, 1, "psivar-CISDT-TOTAL-ENERGY", "CISDT TOTAL ENERGY"], [1776, 9, 1, "psivar-CISDTQ-CORRELATION-ENERGY", "CISDTQ CORRELATION ENERGY"], [1776, 9, 1, "psivar-CISDTQ-TOTAL-ENERGY", "CISDTQ TOTAL ENERGY"], [1776, 9, 1, "psivar-CIn-CORRELATION-ENERGY", "CIn CORRELATION ENERGY"], [1776, 9, 1, "psivar-CIn-TOTAL-ENERGY", "CIn TOTAL ENERGY"], [1767, 10, 1, "-", "CONDA_PREFIX"], [1776, 9, 1, "psivar-CP-CORRECTED-2-BODY-INTERACTION-ENERGY", "CP-CORRECTED 2-BODY INTERACTION ENERGY"], [1738, 10, 1, "-", "CRAYPE_LINK_TYPE"], [1738, 10, 1, "-", "CRAY_ADD_RPATH"], [1776, 9, 1, "psivar-CURRENT-CORRELATION-ENERGY", "CURRENT CORRELATION ENERGY"], [1776, 9, 1, "psivar-CURRENT-DIPOLE", "CURRENT DIPOLE"], [1776, 9, 1, "psivar-CURRENT-DIPOLE-GRADIENT", "CURRENT DIPOLE GRADIENT"], [1776, 9, 1, "psivar-CURRENT-ENERGY", "CURRENT ENERGY"], [1776, 9, 1, "psivar-CURRENT-GRADIENT", "CURRENT GRADIENT"], [1776, 9, 1, "psivar-CURRENT-HESSIAN", "CURRENT HESSIAN"], [1776, 9, 1, "psivar-CURRENT-REFERENCE-ENERGY", "CURRENT REFERENCE ENERGY"], [1776, 9, 1, "psivar-CUSTOM-SCS-LCCD-CORRELATION-ENERGY", "CUSTOM SCS-LCCD CORRELATION ENERGY"], [1776, 9, 1, "psivar-CUSTOM-SCS-LCCD-TOTAL-ENERGY", "CUSTOM SCS-LCCD TOTAL ENERGY"], [1776, 9, 1, "psivar-CUSTOM-SCS-MP2-CORRELATION-ENERGY", "CUSTOM SCS-MP2 CORRELATION ENERGY"], [1776, 9, 1, "psivar-CUSTOM-SCS-MP2-TOTAL-ENERGY", "CUSTOM SCS-MP2 TOTAL ENERGY"], [1776, 9, 1, "psivar-CUSTOM-SCS-MP3-CORRELATION-ENERGY", "CUSTOM SCS-MP3 CORRELATION ENERGY"], [1776, 9, 1, "psivar-CUSTOM-SCS-MP3-TOTAL-ENERGY", "CUSTOM SCS-MP3 TOTAL ENERGY"], [1776, 9, 1, "psivar-CUSTOM-SCS-OLCCD-CORRELATION-ENERGY", "CUSTOM SCS-OLCCD CORRELATION ENERGY"], [1776, 9, 1, "psivar-CUSTOM-SCS-OLCCD-TOTAL-ENERGY", "CUSTOM SCS-OLCCD TOTAL ENERGY"], [1776, 9, 1, "psivar-CUSTOM-SCS-OMP2-CORRELATION-ENERGY", "CUSTOM SCS-OMP2 CORRELATION ENERGY"], [1776, 9, 1, "psivar-CUSTOM-SCS-OMP2-TOTAL-ENERGY", "CUSTOM SCS-OMP2 TOTAL ENERGY"], [1776, 9, 1, "psivar-CUSTOM-SCS-OMP3-CORRELATION-ENERGY", "CUSTOM SCS-OMP3 CORRELATION ENERGY"], [1776, 9, 1, "psivar-CUSTOM-SCS-OMP3-TOTAL-ENERGY", "CUSTOM SCS-OMP3 TOTAL ENERGY"], [1776, 9, 1, "psivar-CUSTOM-SCS-OREMP2-CORRELATION-ENERGY", "CUSTOM SCS-OREMP2 CORRELATION ENERGY"], [1776, 9, 1, "psivar-CUSTOM-SCS-OREMP2-TOTAL-ENERGY", "CUSTOM SCS-OREMP2 TOTAL ENERGY"], [1776, 9, 1, "psivar-CUSTOM-SCS-REMP2-CORRELATION-ENERGY", "CUSTOM SCS-REMP2 CORRELATION ENERGY"], [1776, 9, 1, "psivar-CUSTOM-SCS-REMP2-TOTAL-ENERGY", "CUSTOM SCS-REMP2 TOTAL ENERGY"], [1776, 9, 1, "psivar-DCT-LAMBDA-ENERGY", "DCT LAMBDA ENERGY"], [1776, 9, 1, "psivar-DCT-SCF-ENERGY", "DCT SCF ENERGY"], [1776, 9, 1, "psivar-DCT-THREE-PARTICLE-ENERGY", "DCT THREE-PARTICLE ENERGY"], [1776, 9, 1, "psivar-DCT-TOTAL-ENERGY", "DCT TOTAL ENERGY"], [1776, 9, 1, "psivar-DD-SOLVATION-ENERGY", "DD SOLVATION ENERGY"], [1776, 9, 1, "psivar-DETCI-AVG-DVEC-NORM", "DETCI AVG DVEC NORM"], [1776, 9, 1, "psivar-DFT-DIPOLE-GRADIENT", "DFT DIPOLE GRADIENT"], [1776, 9, 1, "psivar-DFT-FUNCTIONAL-TOTAL-ENERGY", "DFT FUNCTIONAL TOTAL ENERGY"], [1776, 9, 1, "psivar-DFT-TOTAL-ENERGY", "DFT TOTAL ENERGY"], [1776, 9, 1, "psivar-DFT-TOTAL-GRADIENT", "DFT TOTAL GRADIENT"], [1776, 9, 1, "psivar-DFT-TOTAL-HESSIAN", "DFT TOTAL HESSIAN"], [1776, 9, 1, "psivar-DFT-VV10-ENERGY", "DFT VV10 ENERGY"], [1776, 9, 1, "psivar-DFT-XC-ENERGY", "DFT XC ENERGY"], [1776, 9, 1, "psivar-DISPERSION-CORRECTION-ENERGY", "DISPERSION CORRECTION ENERGY"], [1776, 9, 1, "psivar-DMA-DISTRIBUTED-MULTIPOLES", "DMA DISTRIBUTED MULTIPOLES"], [1776, 9, 1, "psivar-DMA-TOTAL-MULTIPOLES", "DMA TOTAL MULTIPOLES"], [1776, 9, 1, "psivar-DMRG-CASPT2-TOTAL-ENERGY", "DMRG-CASPT2 TOTAL ENERGY"], [1776, 9, 1, "psivar-DMRG-SCF-TOTAL-ENERGY", "DMRG-SCF TOTAL ENERGY"], [1776, 9, 1, "psivar-DOUBLE-HYBRID-CORRECTION-ENERGY", "DOUBLE-HYBRID CORRECTION ENERGY"], [1776, 9, 1, "psivar-EFP-DISP-ENERGY", "EFP DISP ENERGY"], [1776, 9, 1, "psivar-EFP-ELST-ENERGY", "EFP ELST ENERGY"], [1776, 9, 1, "psivar-EFP-EXCH-ENERGY", "EFP EXCH ENERGY"], [1776, 9, 1, "psivar-EFP-IND-ENERGY", "EFP IND ENERGY"], [1776, 9, 1, "psivar-EFP-TORQUE", "EFP TORQUE"], [1776, 9, 1, "psivar-EFP-TOTAL-ENERGY", "EFP TOTAL ENERGY"], [1776, 9, 1, "-", "ENTHALPY"], [1776, 9, 1, "psivar-ENTHALPY-CORRECTION", "ENTHALPY CORRECTION"], [1776, 9, 1, "psivar-ESP-AT-CENTER-n", "ESP AT CENTER n"], [1776, 9, 1, "psivar-FCI-CORRELATION-ENERGY", "FCI CORRELATION ENERGY"], [1776, 9, 1, "psivar-FCI-TOTAL-ENERGY", "FCI TOTAL ENERGY"], [1776, 9, 1, "psivar-FINDIF-NUMBER", "FINDIF NUMBER"], [1776, 9, 1, "psivar-GIBBS-FREE-ENERGY", "GIBBS FREE ENERGY"], [1776, 9, 1, "psivar-GIBBS-FREE-ENERGY-CORRECTION", "GIBBS FREE ENERGY CORRECTION"], [1776, 9, 1, "psivar-GRID-ELECTRONS-ALPHA", "GRID ELECTRONS ALPHA"], [1776, 9, 1, "psivar-GRID-ELECTRONS-BETA", "GRID ELECTRONS BETA"], [1776, 9, 1, "psivar-GRID-ELECTRONS-TOTAL", "GRID ELECTRONS TOTAL"], [1776, 9, 1, "psivar-HF-DIPOLE-GRADIENT", "HF DIPOLE GRADIENT"], [1776, 9, 1, "psivar-HF-KINETIC-ENERGY", "HF KINETIC ENERGY"], [1776, 9, 1, "psivar-HF-POTENTIAL-ENERGY", "HF POTENTIAL ENERGY"], [1776, 9, 1, "psivar-HF-TOTAL-ENERGY", "HF TOTAL ENERGY"], [1776, 9, 1, "psivar-HF-TOTAL-GRADIENT", "HF TOTAL GRADIENT"], [1776, 9, 1, "psivar-HF-TOTAL-HESSIAN", "HF TOTAL HESSIAN"], [1776, 9, 1, "psivar-HF-VIRIAL-RATIO", "HF VIRIAL RATIO"], [1767, 10, 1, "-", "HOST"], [1776, 9, 1, "psivar-LCC2-LMP2-TOTAL-ENERGY", "LCC2 (+LMP2) TOTAL ENERGY"], [1776, 9, 1, "psivar-LCCD-CORRELATION-ENERGY", "LCCD CORRELATION ENERGY"], [1776, 9, 1, "psivar-LCCD-DOUBLES-ENERGY", "LCCD DOUBLES ENERGY"], [1776, 9, 1, "psivar-LCCD-OPPOSITE-SPIN-CORRELATION-ENERGY", "LCCD OPPOSITE-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-LCCD-SAME-SPIN-CORRELATION-ENERGY", "LCCD SAME-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-LCCD-SINGLES-ENERGY", "LCCD SINGLES ENERGY"], [1776, 9, 1, "psivar-LCCD-TOTAL-ENERGY", "LCCD TOTAL ENERGY"], [1776, 9, 1, "psivar-LCCSD-LMP2-TOTAL-ENERGY", "LCCSD (+LMP2) TOTAL ENERGY"], [1776, 9, 1, "psivar-LCCSD-CORRELATION-ENERGY", "LCCSD CORRELATION ENERGY"], [1776, 9, 1, "psivar-LCCSD-DOUBLES-ENERGY", "LCCSD DOUBLES ENERGY"], [1776, 9, 1, "psivar-LCCSD-OPPOSITE-SPIN-CORRELATION-ENERGY", "LCCSD OPPOSITE-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-LCCSD-SAME-SPIN-CORRELATION-ENERGY", "LCCSD SAME-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-LCCSD-SINGLES-ENERGY", "LCCSD SINGLES ENERGY"], [1776, 9, 1, "psivar-LCCSD-TOTAL-ENERGY", "LCCSD TOTAL ENERGY"], [1776, 9, 1, "psivar-LEFT-RIGHT-CC2-EIGENVECTOR-OVERLAP", "LEFT-RIGHT CC2 EIGENVECTOR OVERLAP"], [1776, 9, 1, "psivar-LEFT-RIGHT-CC3-EIGENVECTOR-OVERLAP", "LEFT-RIGHT CC3 EIGENVECTOR OVERLAP"], [1776, 9, 1, "psivar-LEFT-RIGHT-CCSD-EIGENVECTOR-OVERLAP", "LEFT-RIGHT CCSD EIGENVECTOR OVERLAP"], [1776, 9, 1, "psivar-LEFT-RIGHT-CCSD-T-EIGENVECTOR-OVERLAP", "LEFT-RIGHT CCSD(T) EIGENVECTOR OVERLAP"], [1776, 9, 1, "psivar-LOWDIN-CHARGES", "LOWDIN CHARGES"], [1738, 10, 1, "-", "MATH_ROOT"], [1776, 9, 1, "psivar-MAYER-INDICES", "MAYER INDICES"], [1776, 9, 1, "psivar-MBIS-CHARGES", "MBIS CHARGES"], [1776, 9, 1, "psivar-MBIS-DIPOLES", "MBIS DIPOLES"], [1776, 9, 1, "psivar-MBIS-FREE-ATOM-n-VOLUME", "MBIS FREE ATOM n VOLUME"], [1776, 9, 1, "psivar-MBIS-OCTUPOLES", "MBIS OCTUPOLES"], [1776, 9, 1, "psivar-MBIS-QUADRUPOLES", "MBIS QUADRUPOLES"], [1776, 9, 1, "psivar-MBIS-RADIAL-MOMENTS-R-3", "MBIS RADIAL MOMENTS &lt;R^3&gt;"], [1776, 9, 1, "psivar-MBIS-VALENCE-WIDTHS", "MBIS VALENCE WIDTHS"], [1776, 9, 1, "psivar-MBIS-VOLUME-RATIOS", "MBIS VOLUME RATIOS"], [1776, 9, 1, "psivar-MCSCF-TOTAL-ENERGY", "MCSCF TOTAL ENERGY"], [1767, 10, 1, "-", "MKL_NUM_THREADS"], [1738, 10, 1, "-", "MKL_ROOT"], [1750, 10, 1, "-", "MONTAGE"], [1776, 9, 1, "psivar-MP2-ALPHA-ALPHA-PAIR-ENERGIES", "MP2 ALPHA-ALPHA PAIR ENERGIES"], [1776, 9, 1, "psivar-MP2-ALPHA-BETA-PAIR-ENERGIES", "MP2 ALPHA-BETA PAIR ENERGIES"], [1776, 9, 1, "psivar-MP2-CORRELATION-ENERGY", "MP2 CORRELATION ENERGY"], [1776, 9, 1, "psivar-MP2-DIPOLE-GRADIENT", "MP2 DIPOLE GRADIENT"], [1776, 9, 1, "psivar-MP2-DOUBLES-ENERGY", "MP2 DOUBLES ENERGY"], [1776, 9, 1, "psivar-MP2-OPPOSITE-SPIN-CORRELATION-ENERGY", "MP2 OPPOSITE-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-MP2-SAME-SPIN-CORRELATION-ENERGY", "MP2 SAME-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-MP2-SINGLES-ENERGY", "MP2 SINGLES ENERGY"], [1776, 9, 1, "psivar-MP2-SINGLET-PAIR-ENERGIES", "MP2 SINGLET PAIR ENERGIES"], [1776, 9, 1, "psivar-MP2-TOTAL-ENERGY", "MP2 TOTAL ENERGY"], [1776, 9, 1, "psivar-MP2-TOTAL-GRADIENT", "MP2 TOTAL GRADIENT"], [1776, 9, 1, "psivar-MP2-TOTAL-HESSIAN", "MP2 TOTAL HESSIAN"], [1776, 9, 1, "psivar-MP2-TRIPLET-PAIR-ENERGIES", "MP2 TRIPLET PAIR ENERGIES"], [1776, 9, 1, "psivar-MP2-CCSD-TOTAL-ENERGY", "MP2-CCSD TOTAL ENERGY"], [1776, 9, 1, "psivar-MP3-CORRELATION-ENERGY", "MP3 CORRELATION ENERGY"], [1776, 9, 1, "psivar-MP3-DOUBLES-ENERGY", "MP3 DOUBLES ENERGY"], [1776, 9, 1, "psivar-MP3-OPPOSITE-SPIN-CORRELATION-ENERGY", "MP3 OPPOSITE-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-MP3-SAME-SPIN-CORRELATION-ENERGY", "MP3 SAME-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-MP3-SINGLES-ENERGY", "MP3 SINGLES ENERGY"], [1776, 9, 1, "psivar-MP3-TOTAL-ENERGY", "MP3 TOTAL ENERGY"], [1776, 9, 1, "psivar-MP4-CORRELATION-ENERGY", "MP4 CORRELATION ENERGY"], [1776, 9, 1, "psivar-MP4-TOTAL-ENERGY", "MP4 TOTAL ENERGY"], [1776, 9, 1, "psivar-MP4-SDQ-CORRELATION-ENERGY", "MP4(SDQ) CORRELATION ENERGY"], [1776, 9, 1, "psivar-MP4-SDQ-TOTAL-ENERGY", "MP4(SDQ) TOTAL ENERGY"], [1776, 9, 1, "psivar-MP4-SDTQ-CORRELATION-ENERGY", "MP4(SDTQ) CORRELATION ENERGY"], [1776, 9, 1, "psivar-MP4-SDTQ-TOTAL-ENERGY", "MP4(SDTQ) TOTAL ENERGY"], [1776, 9, 1, "psivar-MP4-T-CORRECTION-ENERGY", "MP4(T) CORRECTION ENERGY"], [1776, 9, 1, "psivar-MPn-CORRELATION-ENERGY", "MPn CORRELATION ENERGY"], [1776, 9, 1, "psivar-MPn-TOTAL-ENERGY", "MPn TOTAL ENERGY"], [1776, 9, 1, "psivar-MRCC-TOTAL-ENERGY", "MRCC TOTAL ENERGY"], [1776, 9, 1, "psivar-MRPT-TOTAL-ENERGY", "MRPT TOTAL ENERGY"], [1776, 9, 1, "psivar-MULLIKEN-CHARGES", "MULLIKEN CHARGES"], [1776, 9, 1, "psivar-NAUX-CC", "NAUX (CC)"], [1776, 9, 1, "psivar-NAUX-SCF", "NAUX (SCF)"], [1776, 9, 1, "psivar-NBODY-NUMBER", "NBODY NUMBER"], [1776, 9, 1, "psivar-NUCLEAR-REPULSION-ENERGY", "NUCLEAR REPULSION ENERGY"], [1776, 9, 1, "psivar-OCEPA-0-CORRELATION-ENERGY", "OCEPA(0) CORRELATION ENERGY"], [1776, 9, 1, "psivar-OCEPA-0-TOTAL-ENERGY", "OCEPA(0) TOTAL ENERGY"], [1776, 9, 1, "psivar-OLCCD-CORRELATION-ENERGY", "OLCCD CORRELATION ENERGY"], [1776, 9, 1, "psivar-OLCCD-DOUBLES-ENERGY", "OLCCD DOUBLES ENERGY"], [1776, 9, 1, "psivar-OLCCD-OPPOSITE-SPIN-CORRELATION-ENERGY", "OLCCD OPPOSITE-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-OLCCD-REFERENCE-CORRECTION-ENERGY", "OLCCD REFERENCE CORRECTION ENERGY"], [1776, 9, 1, "psivar-OLCCD-SAME-SPIN-CORRELATION-ENERGY", "OLCCD SAME-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-OLCCD-SINGLES-ENERGY", "OLCCD SINGLES ENERGY"], [1776, 9, 1, "psivar-OLCCD-TOTAL-ENERGY", "OLCCD TOTAL ENERGY"], [1776, 9, 1, "psivar-OMP2-CORRELATION-ENERGY", "OMP2 CORRELATION ENERGY"], [1776, 9, 1, "psivar-OMP2-DOUBLES-ENERGY", "OMP2 DOUBLES ENERGY"], [1776, 9, 1, "psivar-OMP2-OPPOSITE-SPIN-CORRELATION-ENERGY", "OMP2 OPPOSITE-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-OMP2-REFERENCE-CORRECTION-ENERGY", "OMP2 REFERENCE CORRECTION ENERGY"], [1776, 9, 1, "psivar-OMP2-SAME-SPIN-CORRELATION-ENERGY", "OMP2 SAME-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-OMP2-TOTAL-ENERGY", "OMP2 TOTAL ENERGY"], [1776, 9, 1, "psivar-OMP3-CORRELATION-ENERGY", "OMP3 CORRELATION ENERGY"], [1776, 9, 1, "psivar-OMP3-DOUBLES-ENERGY", "OMP3 DOUBLES ENERGY"], [1776, 9, 1, "psivar-OMP3-OPPOSITE-SPIN-CORRELATION-ENERGY", "OMP3 OPPOSITE-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-OMP3-REFERENCE-CORRECTION-ENERGY", "OMP3 REFERENCE CORRECTION ENERGY"], [1776, 9, 1, "psivar-OMP3-SAME-SPIN-CORRELATION-ENERGY", "OMP3 SAME-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-OMP3-TOTAL-ENERGY", "OMP3 TOTAL ENERGY"], [1767, 10, 1, "-", "OMP_NESTED"], [1767, 10, 1, "-", "OMP_NUM_THREADS"], [1776, 9, 1, "psivar-ONE-ELECTRON-ENERGY", "ONE-ELECTRON ENERGY"], [1776, 9, 1, "psivar-OPTIMIZATION-ITERATIONS", "OPTIMIZATION ITERATIONS"], [1776, 9, 1, "psivar-OREMP2-CORRELATION-ENERGY", "OREMP2 CORRELATION ENERGY"], [1776, 9, 1, "psivar-OREMP2-DOUBLES-ENERGY", "OREMP2 DOUBLES ENERGY"], [1776, 9, 1, "psivar-OREMP2-OPPOSITE-SPIN-CORRELATION-ENERGY", "OREMP2 OPPOSITE-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-OREMP2-REFERENCE-CORRECTION-ENERGY", "OREMP2 REFERENCE CORRECTION ENERGY"], [1776, 9, 1, "psivar-OREMP2-SAME-SPIN-CORRELATION-ENERGY", "OREMP2 SAME-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-OREMP2-SINGLES-ENERGY", "OREMP2 SINGLES ENERGY"], [1776, 9, 1, "psivar-OREMP2-TOTAL-ENERGY", "OREMP2 TOTAL ENERGY"], [1767, 10, 1, "-", "PATH"], [1776, 9, 1, "psivar-PCM-POLARIZATION-ENERGY", "PCM POLARIZATION ENERGY"], [1776, 9, 1, "psivar-PE-ENERGY", "PE ENERGY"], [1767, 10, 1, "-", "PSIDATADIR"], [1767, 10, 1, "-", "PSIPATH"], [1767, 10, 1, "-", "PSI_SCRATCH"], [1767, 10, 1, "-", "PYTHONPATH"], [1776, 9, 1, "psivar-QCISD-CORRELATION-ENERGY", "QCISD CORRELATION ENERGY"], [1776, 9, 1, "psivar-QCISD-DOUBLES-ENERGY", "QCISD DOUBLES ENERGY"], [1776, 9, 1, "psivar-QCISD-OPPOSITE-SPIN-CORRELATION-ENERGY", "QCISD OPPOSITE-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-QCISD-SAME-SPIN-CORRELATION-ENERGY", "QCISD SAME-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-QCISD-SINGLES-ENERGY", "QCISD SINGLES ENERGY"], [1776, 9, 1, "psivar-QCISD-TOTAL-ENERGY", "QCISD TOTAL ENERGY"], [1776, 9, 1, "psivar-QCISD-T-CORRECTION-ENERGY", "QCISD(T) CORRECTION ENERGY"], [1776, 9, 1, "psivar-QCISD-T-CORRELATION-ENERGY", "QCISD(T) CORRELATION ENERGY"], [1776, 9, 1, "psivar-QCISD-T-TOTAL-ENERGY", "QCISD(T) TOTAL ENERGY"], [1776, 9, 1, "psivar-REMP2-CORRELATION-ENERGY", "REMP2 CORRELATION ENERGY"], [1776, 9, 1, "psivar-REMP2-DOUBLES-ENERGY", "REMP2 DOUBLES ENERGY"], [1776, 9, 1, "psivar-REMP2-OPPOSITE-SPIN-CORRELATION-ENERGY", "REMP2 OPPOSITE-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-REMP2-SAME-SPIN-CORRELATION-ENERGY", "REMP2 SAME-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-REMP2-SINGLES-ENERGY", "REMP2 SINGLES ENERGY"], [1776, 9, 1, "psivar-REMP2-TOTAL-ENERGY", "REMP2 TOTAL ENERGY"], [1776, 9, 1, "psivar-SAPT-ALPHA", "SAPT ALPHA"], [1776, 9, 1, "psivar-SAPT-CT-ENERGY", "SAPT CT ENERGY"], [1776, 9, 1, "psivar-SAPT-DISP-ENERGY", "SAPT DISP ENERGY"], [1776, 9, 1, "psivar-SAPT-DISP2-CCD-ENERGY", "SAPT DISP2(CCD) ENERGY"], [1776, 9, 1, "psivar-SAPT-DISP20-ENERGY", "SAPT DISP20 ENERGY"], [1776, 9, 1, "psivar-SAPT-DISP21-ENERGY", "SAPT DISP21 ENERGY"], [1776, 9, 1, "psivar-SAPT-DISP22-S-CCD-ENERGY", "SAPT DISP22(S)(CCD) ENERGY"], [1776, 9, 1, "psivar-SAPT-DISP22-SDQ-ENERGY", "SAPT DISP22(SDQ) ENERGY"], [1776, 9, 1, "psivar-SAPT-DISP22-T-ENERGY", "SAPT DISP22(T) ENERGY"], [1776, 9, 1, "psivar-SAPT-DISP22-T-CCD-ENERGY", "SAPT DISP22(T)(CCD) ENERGY"], [1776, 9, 1, "psivar-SAPT-DISP30-ENERGY", "SAPT DISP30 ENERGY"], [1776, 9, 1, "psivar-SAPT-ELST-ENERGY", "SAPT ELST ENERGY"], [1776, 9, 1, "psivar-SAPT-ELST-EXTERN-EXTERN-ENERGY", "SAPT ELST EXTERN-EXTERN ENERGY"], [1776, 9, 1, "psivar-SAPT-ELST10-R-ENERGY", "SAPT ELST10,R ENERGY"], [1776, 9, 1, "psivar-SAPT-ELST12-R-ENERGY", "SAPT ELST12,R ENERGY"], [1776, 9, 1, "psivar-SAPT-ELST13-R-ENERGY", "SAPT ELST13,R ENERGY"], [1776, 9, 1, "psivar-SAPT-ENERGY", "SAPT ENERGY"], [1776, 9, 1, "psivar-SAPT-EXCH-ENERGY", "SAPT EXCH ENERGY"], [1776, 9, 1, "psivar-SAPT-EXCH-DISP20-ENERGY", "SAPT EXCH-DISP20 ENERGY"], [1776, 9, 1, "psivar-SAPT-EXCH-DISP20-S-INF-ENERGY", "SAPT EXCH-DISP20(S^INF) ENERGY"], [1776, 9, 1, "psivar-SAPT-EXCH-DISP30-ENERGY", "SAPT EXCH-DISP30 ENERGY"], [1776, 9, 1, "psivar-SAPT-EXCH-IND-DISP30-ENERGY", "SAPT EXCH-IND-DISP30 ENERGY"], [1776, 9, 1, "psivar-SAPT-EXCH-IND20-R-ENERGY", "SAPT EXCH-IND20,R ENERGY"], [1776, 9, 1, "psivar-SAPT-EXCH-IND20-U-ENERGY", "SAPT EXCH-IND20,U ENERGY"], [1776, 9, 1, "psivar-SAPT-EXCH-IND22-ENERGY", "SAPT EXCH-IND22 ENERGY"], [1776, 9, 1, "psivar-SAPT-EXCH-IND30-S-INF-ENERGY", "SAPT EXCH-IND30(S^INF) ENERGY"], [1776, 9, 1, "psivar-SAPT-EXCH-IND30-R-ENERGY", "SAPT EXCH-IND30,R ENERGY"], [1776, 9, 1, "psivar-SAPT-EXCH-IND30-R-S-INF-ENERGY", "SAPT EXCH-IND30,R(S^INF) ENERGY"], [1776, 9, 1, "psivar-SAPT-EXCH10-ENERGY", "SAPT EXCH10 ENERGY"], [1776, 9, 1, "psivar-SAPT-EXCH10-S-2-ENERGY", "SAPT EXCH10(S^2) ENERGY"], [1776, 9, 1, "psivar-SAPT-EXCH11-S-2-ENERGY", "SAPT EXCH11(S^2) ENERGY"], [1776, 9, 1, "psivar-SAPT-EXCH12-S-2-ENERGY", "SAPT EXCH12(S^2) ENERGY"], [1776, 9, 1, "psivar-SAPT-HF-TOTAL-ENERGY", "SAPT HF TOTAL ENERGY"], [1776, 9, 1, "psivar-SAPT-HF-2-ENERGY-A-0", "SAPT HF(2) ENERGY A(0)"], [1776, 9, 1, "psivar-SAPT-HF-2-ENERGY-A-HF", "SAPT HF(2) ENERGY A(HF)"], [1776, 9, 1, "psivar-SAPT-HF-2-ENERGY-AB-HF", "SAPT HF(2) ENERGY AB(HF)"], [1776, 9, 1, "psivar-SAPT-HF-2-ENERGY-ABC-HF", "SAPT HF(2) ENERGY ABC(HF)"], [1776, 9, 1, "psivar-SAPT-HF-2-ENERGY-AC-0", "SAPT HF(2) ENERGY AC(0)"], [1776, 9, 1, "psivar-SAPT-HF-2-ENERGY-AC-HF", "SAPT HF(2) ENERGY AC(HF)"], [1776, 9, 1, "psivar-SAPT-HF-2-ENERGY-B-0", "SAPT HF(2) ENERGY B(0)"], [1776, 9, 1, "psivar-SAPT-HF-2-ENERGY-B-HF", "SAPT HF(2) ENERGY B(HF)"], [1776, 9, 1, "psivar-SAPT-HF-2-ENERGY-BC-0", "SAPT HF(2) ENERGY BC(0)"], [1776, 9, 1, "psivar-SAPT-HF-2-ENERGY-BC-HF", "SAPT HF(2) ENERGY BC(HF)"], [1776, 9, 1, "psivar-SAPT-HF-2-ENERGY-C", "SAPT HF(2) ENERGY C"], [1776, 9, 1, "psivar-SAPT-HF-2-ENERGY-HF", "SAPT HF(2) ENERGY HF"], [1776, 9, 1, "psivar-SAPT-IND-ENERGY", "SAPT IND ENERGY"], [1776, 9, 1, "psivar-SAPT-IND-DISP30-ENERGY", "SAPT IND-DISP30 ENERGY"], [1776, 9, 1, "psivar-SAPT-IND20-R-ENERGY", "SAPT IND20,R ENERGY"], [1776, 9, 1, "psivar-SAPT-IND20-U-ENERGY", "SAPT IND20,U ENERGY"], [1776, 9, 1, "psivar-SAPT-IND22-ENERGY", "SAPT IND22 ENERGY"], [1776, 9, 1, "psivar-SAPT-IND30-R-ENERGY", "SAPT IND30,R ENERGY"], [1776, 9, 1, "psivar-SAPT-MP2-CORRELATION-ENERGY", "SAPT MP2 CORRELATION ENERGY"], [1776, 9, 1, "psivar-SAPT-SAME-SPIN-DISP20-ENERGY", "SAPT SAME-SPIN DISP20 ENERGY"], [1776, 9, 1, "psivar-SAPT-SAME-SPIN-EXCH-DISP20-ENERGY", "SAPT SAME-SPIN EXCH-DISP20 ENERGY"], [1776, 9, 1, "psivar-SAPT-TOTAL-ENERGY", "SAPT TOTAL ENERGY"], [1776, 9, 1, "psivar-SAPT0-DISP-ENERGY", "SAPT0 DISP ENERGY"], [1776, 9, 1, "psivar-SAPT0-ELST-ENERGY", "SAPT0 ELST ENERGY"], [1776, 9, 1, "psivar-SAPT0-EXCH-ENERGY", "SAPT0 EXCH ENERGY"], [1776, 9, 1, "psivar-SAPT0-IND-ENERGY", "SAPT0 IND ENERGY"], [1776, 9, 1, "psivar-SAPT0-TOTAL-ENERGY", "SAPT0 TOTAL ENERGY"], [1776, 9, 1, "psivar-SAPT2-DISP-ENERGY", "SAPT2 DISP ENERGY"], [1776, 9, 1, "psivar-SAPT2-ELST-ENERGY", "SAPT2 ELST ENERGY"], [1776, 9, 1, "psivar-SAPT2-EXCH-ENERGY", "SAPT2 EXCH ENERGY"], [1776, 9, 1, "psivar-SAPT2-IND-ENERGY", "SAPT2 IND ENERGY"], [1776, 9, 1, "psivar-SAPT2-TOTAL-ENERGY", "SAPT2 TOTAL ENERGY"], [1776, 9, 1, "psivar-1", "SAPT2+ DISP ENERGY"], [1776, 9, 1, "psivar-2", "SAPT2+ ELST ENERGY"], [1776, 9, 1, "psivar-3", "SAPT2+ EXCH ENERGY"], [1776, 9, 1, "psivar-4", "SAPT2+ IND ENERGY"], [1776, 9, 1, "psivar-9", "SAPT2+ TOTAL ENERGY"], [1776, 9, 1, "psivar-SAPT2-3-DISP-ENERGY", "SAPT2+(3) DISP ENERGY"], [1776, 9, 1, "psivar-SAPT2-3-ELST-ENERGY", "SAPT2+(3) ELST ENERGY"], [1776, 9, 1, "psivar-SAPT2-3-EXCH-ENERGY", "SAPT2+(3) EXCH ENERGY"], [1776, 9, 1, "psivar-SAPT2-3-IND-ENERGY", "SAPT2+(3) IND ENERGY"], [1776, 9, 1, "psivar-SAPT2-3-TOTAL-ENERGY", "SAPT2+(3) TOTAL ENERGY"], [1776, 9, 1, "psivar-SAPT2-3-CCD-DISP-ENERGY", "SAPT2+(3)(CCD) DISP ENERGY"], [1776, 9, 1, "psivar-SAPT2-3-CCD-ELST-ENERGY", "SAPT2+(3)(CCD) ELST ENERGY"], [1776, 9, 1, "psivar-SAPT2-3-CCD-EXCH-ENERGY", "SAPT2+(3)(CCD) EXCH ENERGY"], [1776, 9, 1, "psivar-SAPT2-3-CCD-IND-ENERGY", "SAPT2+(3)(CCD) IND ENERGY"], [1776, 9, 1, "psivar-SAPT2-3-CCD-TOTAL-ENERGY", "SAPT2+(3)(CCD) TOTAL ENERGY"], [1776, 9, 1, "psivar-SAPT2-3-CCD-DMP2-DISP-ENERGY", "SAPT2+(3)(CCD)DMP2 DISP ENERGY"], [1776, 9, 1, "psivar-SAPT2-3-CCD-DMP2-ELST-ENERGY", "SAPT2+(3)(CCD)DMP2 ELST ENERGY"], [1776, 9, 1, "psivar-SAPT2-3-CCD-DMP2-EXCH-ENERGY", "SAPT2+(3)(CCD)DMP2 EXCH ENERGY"], [1776, 9, 1, "psivar-SAPT2-3-CCD-DMP2-IND-ENERGY", "SAPT2+(3)(CCD)DMP2 IND ENERGY"], [1776, 9, 1, "psivar-SAPT2-3-CCD-DMP2-TOTAL-ENERGY", "SAPT2+(3)(CCD)DMP2 TOTAL ENERGY"], [1776, 9, 1, "psivar-SAPT2-3-DMP2-DISP-ENERGY", "SAPT2+(3)DMP2 DISP ENERGY"], [1776, 9, 1, "psivar-SAPT2-3-DMP2-ELST-ENERGY", "SAPT2+(3)DMP2 ELST ENERGY"], [1776, 9, 1, "psivar-SAPT2-3-DMP2-EXCH-ENERGY", "SAPT2+(3)DMP2 EXCH ENERGY"], [1776, 9, 1, "psivar-SAPT2-3-DMP2-IND-ENERGY", "SAPT2+(3)DMP2 IND ENERGY"], [1776, 9, 1, "psivar-SAPT2-3-DMP2-TOTAL-ENERGY", "SAPT2+(3)DMP2 TOTAL ENERGY"], [1776, 9, 1, "psivar-SAPT2-CCD-DISP-ENERGY", "SAPT2+(CCD) DISP ENERGY"], [1776, 9, 1, "psivar-SAPT2-CCD-ELST-ENERGY", "SAPT2+(CCD) ELST ENERGY"], [1776, 9, 1, "psivar-SAPT2-CCD-EXCH-ENERGY", "SAPT2+(CCD) EXCH ENERGY"], [1776, 9, 1, "psivar-SAPT2-CCD-IND-ENERGY", "SAPT2+(CCD) IND ENERGY"], [1776, 9, 1, "psivar-SAPT2-CCD-TOTAL-ENERGY", "SAPT2+(CCD) TOTAL ENERGY"], [1776, 9, 1, "psivar-SAPT2-CCD-DMP2-DISP-ENERGY", "SAPT2+(CCD)DMP2 DISP ENERGY"], [1776, 9, 1, "psivar-SAPT2-CCD-DMP2-ELST-ENERGY", "SAPT2+(CCD)DMP2 ELST ENERGY"], [1776, 9, 1, "psivar-SAPT2-CCD-DMP2-EXCH-ENERGY", "SAPT2+(CCD)DMP2 EXCH ENERGY"], [1776, 9, 1, "psivar-SAPT2-CCD-DMP2-IND-ENERGY", "SAPT2+(CCD)DMP2 IND ENERGY"], [1776, 9, 1, "psivar-SAPT2-CCD-DMP2-TOTAL-ENERGY", "SAPT2+(CCD)DMP2 TOTAL ENERGY"], [1776, 9, 1, "psivar-5", "SAPT2+3 DISP ENERGY"], [1776, 9, 1, "psivar-6", "SAPT2+3 ELST ENERGY"], [1776, 9, 1, "psivar-7", "SAPT2+3 EXCH ENERGY"], [1776, 9, 1, "psivar-8", "SAPT2+3 IND ENERGY"], [1776, 9, 1, "psivar-10", "SAPT2+3 TOTAL ENERGY"], [1776, 9, 1, "psivar-11", "SAPT2+3(CCD) DISP ENERGY"], [1776, 9, 1, "psivar-12", "SAPT2+3(CCD) ELST ENERGY"], [1776, 9, 1, "psivar-13", "SAPT2+3(CCD) EXCH ENERGY"], [1776, 9, 1, "psivar-14", "SAPT2+3(CCD) IND ENERGY"], [1776, 9, 1, "psivar-15", "SAPT2+3(CCD) TOTAL ENERGY"], [1776, 9, 1, "psivar-16", "SAPT2+3(CCD)DMP2 DISP ENERGY"], [1776, 9, 1, "psivar-17", "SAPT2+3(CCD)DMP2 ELST ENERGY"], [1776, 9, 1, "psivar-18", "SAPT2+3(CCD)DMP2 EXCH ENERGY"], [1776, 9, 1, "psivar-19", "SAPT2+3(CCD)DMP2 IND ENERGY"], [1776, 9, 1, "psivar-20", "SAPT2+3(CCD)DMP2 TOTAL ENERGY"], [1776, 9, 1, "psivar-SAPT2-3DMP2-DISP-ENERGY", "SAPT2+3DMP2 DISP ENERGY"], [1776, 9, 1, "psivar-SAPT2-3DMP2-ELST-ENERGY", "SAPT2+3DMP2 ELST ENERGY"], [1776, 9, 1, "psivar-SAPT2-3DMP2-EXCH-ENERGY", "SAPT2+3DMP2 EXCH ENERGY"], [1776, 9, 1, "psivar-SAPT2-3DMP2-IND-ENERGY", "SAPT2+3DMP2 IND ENERGY"], [1776, 9, 1, "psivar-SAPT2-3DMP2-TOTAL-ENERGY", "SAPT2+3DMP2 TOTAL ENERGY"], [1776, 9, 1, "psivar-SAPT2-DMP2-DISP-ENERGY", "SAPT2+DMP2 DISP ENERGY"], [1776, 9, 1, "psivar-SAPT2-DMP2-ELST-ENERGY", "SAPT2+DMP2 ELST ENERGY"], [1776, 9, 1, "psivar-SAPT2-DMP2-EXCH-ENERGY", "SAPT2+DMP2 EXCH ENERGY"], [1776, 9, 1, "psivar-SAPT2-DMP2-IND-ENERGY", "SAPT2+DMP2 IND ENERGY"], [1776, 9, 1, "psivar-SAPT2-DMP2-TOTAL-ENERGY", "SAPT2+DMP2 TOTAL ENERGY"], [1776, 9, 1, "psivar-SCF-DIPOLE", "SCF DIPOLE"], [1776, 9, 1, "psivar-SCF-DIPOLE-GRADIENT", "SCF DIPOLE GRADIENT"], [1776, 9, 1, "psivar-SCF-ITERATIONS", "SCF ITERATIONS"], [1776, 9, 1, "psivar-SCF-QUADRUPOLE", "SCF QUADRUPOLE"], [1776, 9, 1, "psivar-SCF-STABILITY-EIGENVALUES", "SCF STABILITY EIGENVALUES"], [1776, 9, 1, "psivar-SCF-TOTAL-ENERGY", "SCF TOTAL ENERGY"], [1776, 9, 1, "psivar-SCF-TOTAL-GRADIENT", "SCF TOTAL GRADIENT"], [1776, 9, 1, "psivar-SCF-TOTAL-HESSIAN", "SCF TOTAL HESSIAN"], [1776, 9, 1, "psivar-SCS-N-MP2-CORRELATION-ENERGY", "SCS(N)-MP2 CORRELATION ENERGY"], [1776, 9, 1, "psivar-SCS-N-MP2-TOTAL-ENERGY", "SCS(N)-MP2 TOTAL ENERGY"], [1776, 9, 1, "psivar-SCS-N-OMP2-CORRELATION-ENERGY", "SCS(N)-OMP2 CORRELATION ENERGY"], [1776, 9, 1, "psivar-SCS-N-OMP2-TOTAL-ENERGY", "SCS(N)-OMP2 TOTAL ENERGY"], [1776, 9, 1, "psivar-SCS-CCSD-CORRELATION-ENERGY", "SCS-CCSD CORRELATION ENERGY"], [1776, 9, 1, "psivar-SCS-CCSD-TOTAL-ENERGY", "SCS-CCSD TOTAL ENERGY"], [1776, 9, 1, "psivar-SCS-MP2-CORRELATION-ENERGY", "SCS-MP2 CORRELATION ENERGY"], [1776, 9, 1, "psivar-SCS-MP2-TOTAL-ENERGY", "SCS-MP2 TOTAL ENERGY"], [1776, 9, 1, "psivar-SCS-MP2-VDW-CORRELATION-ENERGY", "SCS-MP2-VDW CORRELATION ENERGY"], [1776, 9, 1, "psivar-SCS-MP2-VDW-TOTAL-ENERGY", "SCS-MP2-VDW TOTAL ENERGY"], [1776, 9, 1, "psivar-SCS-MP3-CORRELATION-ENERGY", "SCS-MP3 CORRELATION ENERGY"], [1776, 9, 1, "psivar-SCS-MP3-TOTAL-ENERGY", "SCS-MP3 TOTAL ENERGY"], [1776, 9, 1, "psivar-SCS-OMP2-CORRELATION-ENERGY", "SCS-OMP2 CORRELATION ENERGY"], [1776, 9, 1, "psivar-SCS-OMP2-TOTAL-ENERGY", "SCS-OMP2 TOTAL ENERGY"], [1776, 9, 1, "psivar-SCS-OMP3-CORRELATION-ENERGY", "SCS-OMP3 CORRELATION ENERGY"], [1776, 9, 1, "psivar-SCS-OMP3-TOTAL-ENERGY", "SCS-OMP3 TOTAL ENERGY"], [1776, 9, 1, "psivar-SCSN-OMP2-CORRELATION-ENERGY", "SCSN-OMP2 CORRELATION ENERGY"], [1776, 9, 1, "psivar-SCSN-OMP2-TOTAL-ENERGY", "SCSN-OMP2 TOTAL ENERGY"], [1776, 9, 1, "psivar-SOS-MP2-CORRELATION-ENERGY", "SOS-MP2 CORRELATION ENERGY"], [1776, 9, 1, "psivar-SOS-MP2-TOTAL-ENERGY", "SOS-MP2 TOTAL ENERGY"], [1776, 9, 1, "psivar-SOS-OMP2-CORRELATION-ENERGY", "SOS-OMP2 CORRELATION ENERGY"], [1776, 9, 1, "psivar-SOS-OMP2-TOTAL-ENERGY", "SOS-OMP2 TOTAL ENERGY"], [1776, 9, 1, "psivar-SOS-OMP3-CORRELATION-ENERGY", "SOS-OMP3 CORRELATION ENERGY"], [1776, 9, 1, "psivar-SOS-OMP3-TOTAL-ENERGY", "SOS-OMP3 TOTAL ENERGY"], [1776, 9, 1, "psivar-SOS-PI-MP2-CORRELATION-ENERGY", "SOS-PI-MP2 CORRELATION ENERGY"], [1776, 9, 1, "psivar-SOS-PI-MP2-TOTAL-ENERGY", "SOS-PI-MP2 TOTAL ENERGY"], [1776, 9, 1, "psivar-SSAPT0-DISP-ENERGY", "SSAPT0 DISP ENERGY"], [1776, 9, 1, "psivar-SSAPT0-ELST-ENERGY", "SSAPT0 ELST ENERGY"], [1776, 9, 1, "psivar-SSAPT0-EXCH-ENERGY", "SSAPT0 EXCH ENERGY"], [1776, 9, 1, "psivar-SSAPT0-IND-ENERGY", "SSAPT0 IND ENERGY"], [1776, 9, 1, "psivar-SSAPT0-TOTAL-ENERGY", "SSAPT0 TOTAL ENERGY"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-IN-h-ROOT-n-IN-i-ELECTRIC-TRANSITION-DIPOLE-MOMENT-LEN", "TD-fctl ROOT 0 (IN h) -&gt; ROOT n (IN i) ELECTRIC TRANSITION DIPOLE MOMENT (LEN)"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-IN-h-ROOT-n-IN-i-ELECTRIC-TRANSITION-DIPOLE-MOMENT-VEL", "TD-fctl ROOT 0 (IN h) -&gt; ROOT n (IN i) ELECTRIC TRANSITION DIPOLE MOMENT (VEL)"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-IN-h-ROOT-n-IN-i-EXCITATION-ENERGY", "TD-fctl ROOT 0 (IN h) -&gt; ROOT n (IN i) EXCITATION ENERGY"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-IN-h-ROOT-n-IN-i-LEFT-EIGENVECTOR-ALPHA", "TD-fctl ROOT 0 (IN h) -&gt; ROOT n (IN i) LEFT EIGENVECTOR ALPHA"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-IN-h-ROOT-n-IN-i-LEFT-EIGENVECTOR-BETA", "TD-fctl ROOT 0 (IN h) -&gt; ROOT n (IN i) LEFT EIGENVECTOR BETA"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-IN-h-ROOT-n-IN-i-MAGNETIC-TRANSITION-DIPOLE-MOMENT", "TD-fctl ROOT 0 (IN h) -&gt; ROOT n (IN i) MAGNETIC TRANSITION DIPOLE MOMENT"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-IN-h-ROOT-n-IN-i-OSCILLATOR-STRENGTH-LEN", "TD-fctl ROOT 0 (IN h) -&gt; ROOT n (IN i) OSCILLATOR STRENGTH (LEN)"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-IN-h-ROOT-n-IN-i-OSCILLATOR-STRENGTH-VEL", "TD-fctl ROOT 0 (IN h) -&gt; ROOT n (IN i) OSCILLATOR STRENGTH (VEL)"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-IN-h-ROOT-n-IN-i-RIGHT-EIGENVECTOR-ALPHA", "TD-fctl ROOT 0 (IN h) -&gt; ROOT n (IN i) RIGHT EIGENVECTOR ALPHA"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-IN-h-ROOT-n-IN-i-RIGHT-EIGENVECTOR-BETA", "TD-fctl ROOT 0 (IN h) -&gt; ROOT n (IN i) RIGHT EIGENVECTOR BETA"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-IN-h-ROOT-n-IN-i-ROTATORY-STRENGTH-LEN", "TD-fctl ROOT 0 (IN h) -&gt; ROOT n (IN i) ROTATORY STRENGTH (LEN)"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-IN-h-ROOT-n-IN-i-ROTATORY-STRENGTH-VEL", "TD-fctl ROOT 0 (IN h) -&gt; ROOT n (IN i) ROTATORY STRENGTH (VEL)"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-h-ROOT-n-i-ELECTRIC-TRANSITION-DIPOLE-MOMENT-LEN", "TD-fctl ROOT 0 (h) -&gt; ROOT n (i) ELECTRIC TRANSITION DIPOLE MOMENT (LEN)"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-h-ROOT-n-i-ELECTRIC-TRANSITION-DIPOLE-MOMENT-VEL", "TD-fctl ROOT 0 (h) -&gt; ROOT n (i) ELECTRIC TRANSITION DIPOLE MOMENT (VEL)"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-h-ROOT-n-i-EXCITATION-ENERGY", "TD-fctl ROOT 0 (h) -&gt; ROOT n (i) EXCITATION ENERGY"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-h-ROOT-n-i-LEFT-EIGENVECTOR-ALPHA", "TD-fctl ROOT 0 (h) -&gt; ROOT n (i) LEFT EIGENVECTOR ALPHA"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-h-ROOT-n-i-LEFT-EIGENVECTOR-BETA", "TD-fctl ROOT 0 (h) -&gt; ROOT n (i) LEFT EIGENVECTOR BETA"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-h-ROOT-n-i-MAGNETIC-TRANSITION-DIPOLE-MOMENT", "TD-fctl ROOT 0 (h) -&gt; ROOT n (i) MAGNETIC TRANSITION DIPOLE MOMENT"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-h-ROOT-n-i-OSCILLATOR-STRENGTH-LEN", "TD-fctl ROOT 0 (h) -&gt; ROOT n (i) OSCILLATOR STRENGTH (LEN)"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-h-ROOT-n-i-OSCILLATOR-STRENGTH-VEL", "TD-fctl ROOT 0 (h) -&gt; ROOT n (i) OSCILLATOR STRENGTH (VEL)"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-h-ROOT-n-i-RIGHT-EIGENVECTOR-ALPHA", "TD-fctl ROOT 0 (h) -&gt; ROOT n (i) RIGHT EIGENVECTOR ALPHA"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-h-ROOT-n-i-RIGHT-EIGENVECTOR-BETA", "TD-fctl ROOT 0 (h) -&gt; ROOT n (i) RIGHT EIGENVECTOR BETA"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-h-ROOT-n-i-ROTATORY-STRENGTH-LEN", "TD-fctl ROOT 0 (h) -&gt; ROOT n (i) ROTATORY STRENGTH (LEN)"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-h-ROOT-n-i-ROTATORY-STRENGTH-VEL", "TD-fctl ROOT 0 (h) -&gt; ROOT n (i) ROTATORY STRENGTH (VEL)"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-ROOT-n-ELECTRIC-TRANSITION-DIPOLE-MOMENT-LEN", "TD-fctl ROOT 0 -&gt; ROOT n ELECTRIC TRANSITION DIPOLE MOMENT (LEN)"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-ROOT-n-ELECTRIC-TRANSITION-DIPOLE-MOMENT-LEN-h-TRANSITION", "TD-fctl ROOT 0 -&gt; ROOT n ELECTRIC TRANSITION DIPOLE MOMENT (LEN) - h TRANSITION"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-ROOT-n-ELECTRIC-TRANSITION-DIPOLE-MOMENT-VEL", "TD-fctl ROOT 0 -&gt; ROOT n ELECTRIC TRANSITION DIPOLE MOMENT (VEL)"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-ROOT-n-ELECTRIC-TRANSITION-DIPOLE-MOMENT-VEL-h-TRANSITION", "TD-fctl ROOT 0 -&gt; ROOT n ELECTRIC TRANSITION DIPOLE MOMENT (VEL) - h TRANSITION"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-ROOT-n-EXCITATION-ENERGY", "TD-fctl ROOT 0 -&gt; ROOT n EXCITATION ENERGY"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-ROOT-n-EXCITATION-ENERGY-h-TRANSITION", "TD-fctl ROOT 0 -&gt; ROOT n EXCITATION ENERGY - h TRANSITION"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-ROOT-n-LEFT-EIGENVECTOR-ALPHA", "TD-fctl ROOT 0 -&gt; ROOT n LEFT EIGENVECTOR ALPHA"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-ROOT-n-LEFT-EIGENVECTOR-ALPHA-h-TRANSITION", "TD-fctl ROOT 0 -&gt; ROOT n LEFT EIGENVECTOR ALPHA - h TRANSITION"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-ROOT-n-LEFT-EIGENVECTOR-BETA", "TD-fctl ROOT 0 -&gt; ROOT n LEFT EIGENVECTOR BETA"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-ROOT-n-LEFT-EIGENVECTOR-BETA-h-TRANSITION", "TD-fctl ROOT 0 -&gt; ROOT n LEFT EIGENVECTOR BETA - h TRANSITION"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-ROOT-n-MAGNETIC-TRANSITION-DIPOLE-MOMENT", "TD-fctl ROOT 0 -&gt; ROOT n MAGNETIC TRANSITION DIPOLE MOMENT"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-ROOT-n-MAGNETIC-TRANSITION-DIPOLE-MOMENT-h-TRANSITION", "TD-fctl ROOT 0 -&gt; ROOT n MAGNETIC TRANSITION DIPOLE MOMENT - h TRANSITION"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-ROOT-n-OSCILLATOR-STRENGTH-LEN", "TD-fctl ROOT 0 -&gt; ROOT n OSCILLATOR STRENGTH (LEN)"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-ROOT-n-OSCILLATOR-STRENGTH-LEN-h-TRANSITION", "TD-fctl ROOT 0 -&gt; ROOT n OSCILLATOR STRENGTH (LEN) - h TRANSITION"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-ROOT-n-OSCILLATOR-STRENGTH-VEL", "TD-fctl ROOT 0 -&gt; ROOT n OSCILLATOR STRENGTH (VEL)"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-ROOT-n-OSCILLATOR-STRENGTH-VEL-h-TRANSITION", "TD-fctl ROOT 0 -&gt; ROOT n OSCILLATOR STRENGTH (VEL) - h TRANSITION"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-ROOT-n-RIGHT-EIGENVECTOR-ALPHA", "TD-fctl ROOT 0 -&gt; ROOT n RIGHT EIGENVECTOR ALPHA"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-ROOT-n-RIGHT-EIGENVECTOR-ALPHA-h-TRANSITION", "TD-fctl ROOT 0 -&gt; ROOT n RIGHT EIGENVECTOR ALPHA - h TRANSITION"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-ROOT-n-RIGHT-EIGENVECTOR-BETA", "TD-fctl ROOT 0 -&gt; ROOT n RIGHT EIGENVECTOR BETA"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-ROOT-n-RIGHT-EIGENVECTOR-BETA-h-TRANSITION", "TD-fctl ROOT 0 -&gt; ROOT n RIGHT EIGENVECTOR BETA - h TRANSITION"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-ROOT-n-ROTATORY-STRENGTH-LEN", "TD-fctl ROOT 0 -&gt; ROOT n ROTATORY STRENGTH (LEN)"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-ROOT-n-ROTATORY-STRENGTH-LEN-h-TRANSITION", "TD-fctl ROOT 0 -&gt; ROOT n ROTATORY STRENGTH (LEN) - h TRANSITION"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-ROOT-n-ROTATORY-STRENGTH-VEL", "TD-fctl ROOT 0 -&gt; ROOT n ROTATORY STRENGTH (VEL)"], [1776, 9, 1, "psivar-TD-fctl-ROOT-0-ROOT-n-ROTATORY-STRENGTH-VEL-h-TRANSITION", "TD-fctl ROOT 0 -&gt; ROOT n ROTATORY STRENGTH (VEL) - h TRANSITION"], [1776, 9, 1, "psivar-TD-fctl-ROOT-n-IN-h-TOTAL-ENERGY", "TD-fctl ROOT n (IN h) TOTAL ENERGY"], [1776, 9, 1, "psivar-TD-fctl-ROOT-n-h-TOTAL-ENERGY", "TD-fctl ROOT n (h) TOTAL ENERGY"], [1776, 9, 1, "psivar-TD-fctl-ROOT-n-TOTAL-ENERGY", "TD-fctl ROOT n TOTAL ENERGY"], [1776, 9, 1, "psivar-TD-fctl-ROOT-n-TOTAL-ENERGY-h-TRANSITION", "TD-fctl ROOT n TOTAL ENERGY - h TRANSITION"], [1776, 9, 1, "psivar-THERMAL-ENERGY", "THERMAL ENERGY"], [1776, 9, 1, "psivar-THERMAL-ENERGY-CORRECTION", "THERMAL ENERGY CORRECTION"], [1776, 9, 1, "psivar-TWO-ELECTRON-ENERGY", "TWO-ELECTRON ENERGY"], [1776, 9, 1, "psivar-UNCP-CORRECTED-2-BODY-INTERACTION-ENERGY", "UNCP-CORRECTED 2-BODY INTERACTION ENERGY"], [1750, 10, 1, "-", "VMDPATH"], [1776, 9, 1, "psivar-WIBERG-LOWDIN-INDICES", "WIBERG LOWDIN INDICES"], [1776, 9, 1, "psivar-ZAPTn-CORRELATION-ENERGY", "ZAPTn CORRELATION ENERGY"], [1776, 9, 1, "psivar-ZAPTn-TOTAL-ENERGY", "ZAPTn TOTAL ENERGY"], [1776, 9, 1, "psivar-ZERO-K-ENTHALPY", "ZERO K ENTHALPY"], [1776, 9, 1, "-", "ZPVE"], [1776, 9, 1, "psivar-T-CORRECTION-ENERGY", "[T] CORRECTION ENERGY"], [1776, 9, 1, "psivar-db_name-DATABASE-MEAN-ABSOLUTE-DEVIATION", "db_name DATABASE MEAN ABSOLUTE DEVIATION"], [1776, 9, 1, "psivar-db_name-DATABASE-MEAN-SIGNED-DEVIATION", "db_name DATABASE MEAN SIGNED DEVIATION"], [1776, 9, 1, "psivar-db_name-DATABASE-ROOT-MEAN-SQUARE-DEVIATION", "db_name DATABASE ROOT-MEAN-SQUARE DEVIATION"], [1776, 9, 1, "psivar-fctl-DISPERSION-CORRECTION-ENERGY", "fctl DISPERSION CORRECTION ENERGY"], [1776, 9, 1, "psivar-mtd-128-POLE", "mtd 128-POLE"], [1776, 9, 1, "psivar-mtd-32-POLE", "mtd 32-POLE"], [1776, 9, 1, "psivar-mtd-64-POLE", "mtd 64-POLE"], [1776, 9, 1, "psivar-mtd-DIPOLE", "mtd DIPOLE"], [1776, 9, 1, "psivar-mtd-HEXADECAPOLE", "mtd HEXADECAPOLE"], [1776, 9, 1, "psivar-mtd-OCTUPOLE", "mtd OCTUPOLE"], [1776, 9, 1, "psivar-mtd-QUADRUPOLE", "mtd QUADRUPOLE"]], "CUSTOM SCS-MP2": [[1776, 9, 1, "psivar-CUSTOM-SCS-MP2.5-CORRELATION-ENERGY", "5 CORRELATION ENERGY"], [1776, 9, 1, "psivar-CUSTOM-SCS-MP2.5-TOTAL-ENERGY", "5 TOTAL ENERGY"]], "CUSTOM SCS-OMP2": [[1776, 9, 1, "psivar-CUSTOM-SCS-OMP2.5-CORRELATION-ENERGY", "5 CORRELATION ENERGY"], [1776, 9, 1, "psivar-CUSTOM-SCS-OMP2.5-TOTAL-ENERGY", "5 TOTAL ENERGY"]], "MP2": [[1776, 9, 1, "psivar-MP2.5-CORRELATION-ENERGY", "5 CORRELATION ENERGY"], [1776, 9, 1, "psivar-MP2.5-DOUBLES-ENERGY", "5 DOUBLES ENERGY"], [1776, 9, 1, "psivar-MP2.5-OPPOSITE-SPIN-CORRELATION-ENERGY", "5 OPPOSITE-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-MP2.5-SAME-SPIN-CORRELATION-ENERGY", "5 SAME-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-MP2.5-SINGLES-ENERGY", "5 SINGLES ENERGY"], [1776, 9, 1, "psivar-MP2.5-TOTAL-ENERGY", "5 TOTAL ENERGY"]], "NBODY (i, j, ..., k)@(a, b, ..": [[1776, 9, 1, "psivar-NBODY-i-j-...-k-a-b-...-c-TOTAL-ENERGY", ", c) TOTAL ENERGY"]], "OMP2": [[1776, 9, 1, "psivar-OMP2.5-CORRELATION-ENERGY", "5 CORRELATION ENERGY"], [1776, 9, 1, "psivar-OMP2.5-DOUBLES-ENERGY", "5 DOUBLES ENERGY"], [1776, 9, 1, "psivar-OMP2.5-OPPOSITE-SPIN-CORRELATION-ENERGY", "5 OPPOSITE-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-OMP2.5-REFERENCE-CORRECTION-ENERGY", "5 REFERENCE CORRECTION ENERGY"], [1776, 9, 1, "psivar-OMP2.5-SAME-SPIN-CORRELATION-ENERGY", "5 SAME-SPIN CORRELATION ENERGY"], [1776, 9, 1, "psivar-OMP2.5-TOTAL-ENERGY", "5 TOTAL ENERGY"]], "SAPT EST": [[1776, 9, 1, "psivar-SAPT-EST.DISP22-T-ENERGY", "DISP22(T) ENERGY"], [1776, 9, 1, "psivar-SAPT-EST.DISP22-T-CCD-ENERGY", "DISP22(T)(CCD) ENERGY"]], "The total electronic gradient [E_h/a0] of the MP2 level of theory, ({nat}, 3)": [[1776, 9, 1, "psivar-The-total-electronic-gradient-E_h-a0-of-the-MP2-level-of-theory-nat-3-.", ""]], "psi4": [[2, 0, 1, "", "compare"], [2, 0, 1, "", "compare_cubes"], [2, 0, 1, "", "compare_fchkfiles"], [2, 0, 1, "", "compare_fcidumps"], [2, 0, 1, "", "compare_integers"], [2, 0, 1, "", "compare_matrices"], [2, 0, 1, "", "compare_moldenfiles"], [2, 0, 1, "", "compare_molrecs"], [2, 0, 1, "", "compare_recursive"], [2, 0, 1, "", "compare_values"], [2, 0, 1, "", "compare_vectors"], [2, 0, 1, "", "compare_wavefunctions"], [1827, 1, 0, "-", "core"], [1827, 1, 0, "-", "driver"], [1768, 0, 1, "", "set_output_file"], [1767, 11, 1, "cmdoption-psi4-a", "--append"], [1767, 11, 1, "cmdoption-psi4-h", "--help"], [1767, 11, 1, "cmdoption-psi4-inplace", "--inplace"], [1767, 11, 1, "cmdoption-psi4-i", "--input"], [1767, 11, 1, "cmdoption-psi4-loglevel", "--loglevel"], [1767, 11, 1, "cmdoption-psi4-memory", "--memory"], [1767, 11, 1, "cmdoption-psi4-m", "--messy"], [1767, 11, 1, "cmdoption-psi4-module", "--module"], [1767, 11, 1, "cmdoption-psi4-n", "--nthread"], [1767, 11, 1, "cmdoption-psi4-o", "--output"], [1767, 11, 1, "cmdoption-psi4-psiapi-path", "--psiapi-path"], [1767, 11, 1, "cmdoption-psi4-l", "--psidatadir"], [1767, 11, 1, "cmdoption-psi4-qcschema", "--qcschema"], [1767, 11, 1, "cmdoption-psi4-qcschema", "--schema"], [1767, 11, 1, "cmdoption-psi4-s", "--scratch"], [1767, 11, 1, "cmdoption-psi4-k", "--skip-preprocessor"], [1767, 11, 1, "cmdoption-psi4-t", "--test"], [1767, 11, 1, "cmdoption-psi4-v", "--verbose"], [1767, 11, 1, "cmdoption-psi4-V", "--version"], [1767, 11, 1, "cmdoption-psi4-V", "-V"], [1767, 11, 1, "cmdoption-psi4-a", "-a"], [1767, 11, 1, "cmdoption-psi4-h", "-h"], [1767, 11, 1, "cmdoption-psi4-i", "-i"], [1767, 11, 1, "cmdoption-psi4-k", "-k"], [1767, 11, 1, "cmdoption-psi4-l", "-l"], [1767, 11, 1, "cmdoption-psi4-m", "-m"], [1767, 11, 1, "cmdoption-psi4-n", "-n"], [1767, 11, 1, "cmdoption-psi4-o", "-o"], [1767, 11, 1, "cmdoption-psi4-s", "-s"], [1767, 11, 1, "cmdoption-psi4-t", "-t"], [1767, 11, 1, "cmdoption-psi4-v", "-v"]], "psi4.core": [[3, 2, 1, "", "AOShellCombinationsIterator"], [4, 2, 1, "", "AngularMomentumInt"], [5, 2, 1, "", "BSVec"], [6, 2, 1, "", "BasisExtents"], [7, 2, 1, "", "BasisFunctions"], [8, 2, 1, "", "BasisSet"], [9, 2, 1, "", "BlockOPoints"], [10, 2, 1, "", "BoysLocalizer"], [11, 2, 1, "", "CCWavefunction"], [12, 2, 1, "", "CIVector"], [13, 2, 1, "", "CIWavefunction"], [14, 2, 1, "", "CUHF"], [15, 2, 1, "", "CdSalc"], [16, 2, 1, "", "CdSalcList"], [17, 2, 1, "", "CharacterTable"], [18, 2, 1, "", "CompositeJK"], [19, 2, 1, "", "CorrelationFactor"], [20, 2, 1, "", "CorrelationTable"], [21, 2, 1, "", "CubeProperties"], [22, 0, 1, "", "DASUM"], [23, 0, 1, "", "DAXPY"], [24, 0, 1, "", "DCOPY"], [25, 0, 1, "", "DDOT"], [26, 2, 1, "", "DFEP2Wavefunction"], [27, 2, 1, "", "DFHelper"], [28, 2, 1, "", "DFSOMCSCF"], [29, 2, 1, "", "DFTGrid"], [30, 2, 1, "", "DFTensor"], [31, 0, 1, "", "DGBMV"], [32, 0, 1, "", "DGEEV"], [33, 0, 1, "", "DGEMM"], [34, 0, 1, "", "DGEMV"], [35, 0, 1, "", "DGER"], [36, 0, 1, "", "DGETRF"], [37, 0, 1, "", "DGETRI"], [38, 0, 1, "", "DGETRS"], [39, 0, 1, "", "DNRM2"], [40, 0, 1, "", "DPOTRF"], [41, 0, 1, "", "DPOTRI"], [42, 0, 1, "", "DPOTRS"], [43, 0, 1, "", "DROT"], [44, 0, 1, "", "DSBMV"], [45, 0, 1, "", "DSCAL"], [46, 0, 1, "", "DSWAP"], [47, 0, 1, "", "DSYEV"], [48, 0, 1, "", "DSYMM"], [49, 0, 1, "", "DSYMV"], [50, 0, 1, "", "DSYR"], [51, 0, 1, "", "DSYR2"], [52, 0, 1, "", "DSYR2K"], [53, 0, 1, "", "DSYRK"], [54, 0, 1, "", "DSYSV"], [55, 0, 1, "", "DTBMV"], [56, 0, 1, "", "DTBSV"], [57, 0, 1, "", "DTRMM"], [58, 0, 1, "", "DTRMV"], [59, 0, 1, "", "DTRSM"], [60, 0, 1, "", "DTRSV"], [61, 2, 1, "", "Deriv"], [62, 2, 1, "", "DerivCalcType"], [63, 2, 1, "", "DiagonalizeOrder"], [64, 2, 1, "", "Dimension"], [65, 2, 1, "", "DipoleInt"], [66, 2, 1, "", "DirectJK"], [67, 2, 1, "", "DiskSOMCSCF"], [68, 2, 1, "", "Dispersion"], [69, 2, 1, "", "ERI"], [70, 2, 1, "", "ESPPropCalc"], [71, 2, 1, "", "ElectricFieldInt"], [72, 2, 1, "", "ElectrostaticInt"], [73, 2, 1, "", "ExternalPotential"], [74, 2, 1, "", "FCHKWriter"], [75, 2, 1, "", "FDDS_Dispersion"], [76, 2, 1, "", "FISAPT"], [77, 2, 1, "", "FittedSlaterCorrelationFactor"], [78, 2, 1, "", "FittingMetric"], [79, 2, 1, "", "FragmentType"], [80, 2, 1, "", "Functional"], [81, 2, 1, "", "GaussianShell"], [82, 2, 1, "", "GaussianType"], [83, 2, 1, "", "GeometryUnits"], [84, 2, 1, "", "HF"], [85, 0, 1, "", "IDAMAX"], [86, 2, 1, "", "IO"], [87, 2, 1, "", "IOManager"], [88, 2, 1, "", "IntVector"], [89, 2, 1, "", "IntegralFactory"], [90, 2, 1, "", "IntegralTransform"], [91, 2, 1, "", "IrreducibleRepresentation"], [92, 2, 1, "", "JK"], [93, 2, 1, "", "KineticInt"], [94, 2, 1, "", "LS_THC_Computer"], [95, 2, 1, "", "LaplaceDenominator"], [96, 2, 1, "", "LibXCFunctional"], [97, 2, 1, "", "Localizer"], [98, 2, 1, "", "MOSpace"], [99, 2, 1, "", "MOWriter"], [100, 2, 1, "", "Matrix"], [101, 2, 1, "", "MatrixFactory"], [102, 2, 1, "", "MemDFJK"], [103, 2, 1, "", "MintsHelper"], [104, 2, 1, "", "MoldenWriter"], [105, 2, 1, "", "MolecularGrid"], [106, 2, 1, "", "Molecule"], [107, 2, 1, "", "MultipoleInt"], [108, 2, 1, "", "MultipoleSymmetry"], [109, 2, 1, "", "NablaInt"], [110, 2, 1, "", "NumIntHelper"], [111, 2, 1, "", "OEProp"], [112, 2, 1, "", "OneBodyAOInt"], [113, 2, 1, "", "OneBodySOInt"], [114, 2, 1, "", "Options"], [115, 2, 1, "", "OrbitalSpace"], [116, 2, 1, "", "OverlapInt"], [117, 2, 1, "", "PMLocalizer"], [118, 2, 1, "", "PetiteList"], [119, 2, 1, "", "PointFunctions"], [120, 2, 1, "", "PointGroup"], [121, 2, 1, "", "PotentialInt"], [122, 2, 1, "", "PrimitiveType"], [123, 2, 1, "", "Prop"], [124, 2, 1, "", "ProtoIntVector"], [125, 2, 1, "", "ProtoVector"], [126, 2, 1, "", "PsiReturnType"], [127, 2, 1, "", "QuadrupoleInt"], [128, 2, 1, "", "RHF"], [129, 2, 1, "", "RKSFunctions"], [130, 2, 1, "", "ROHF"], [131, 2, 1, "", "SADGuess"], [132, 2, 1, "", "SOBasisSet"], [133, 2, 1, "", "SOMCSCF"], [134, 2, 1, "", "SalcComponent"], [135, 2, 1, "", "SaveType"], [136, 2, 1, "", "ShellInfo"], [137, 2, 1, "", "Slice"], [138, 2, 1, "", "SuperFunctional"], [139, 2, 1, "", "SymmetryOperation"], [140, 2, 1, "", "TLaplaceDenominator"], [141, 2, 1, "", "ThreeCenterOverlapInt"], [142, 2, 1, "", "TracelessQuadrupoleInt"], [143, 2, 1, "", "TwoBodyAOInt"], [144, 2, 1, "", "TwoElectronInt"], [145, 2, 1, "", "UHF"], [146, 2, 1, "", "UKSFunctions"], [147, 2, 1, "", "VBase"], [148, 2, 1, "", "Vector"], [149, 2, 1, "", "Vector3"], [150, 2, 1, "", "Wavefunction"], [151, 0, 1, "", "array_variable"], [152, 0, 1, "", "array_variables"], [153, 0, 1, "", "be_quiet"], [154, 0, 1, "", "benchmark_blas1"], [155, 0, 1, "", "benchmark_blas2"], [156, 0, 1, "", "benchmark_blas3"], [157, 0, 1, "", "benchmark_disk"], [158, 0, 1, "", "benchmark_integrals"], [159, 0, 1, "", "benchmark_math"], [160, 0, 1, "", "ccdensity"], [161, 0, 1, "", "ccenergy"], [162, 0, 1, "", "cceom"], [163, 0, 1, "", "cchbar"], [164, 0, 1, "", "cclambda"], [165, 0, 1, "", "ccresponse"], [166, 0, 1, "", "cctransort"], [167, 0, 1, "", "cctriples"], [168, 0, 1, "", "clean"], [169, 0, 1, "", "clean_options"], [170, 0, 1, "", "clean_timers"], [171, 0, 1, "", "clean_variables"], [172, 0, 1, "", "close_outfile"], [173, 0, 1, "", "dct"], [174, 0, 1, "", "del_array_variable"], [175, 0, 1, "", "del_scalar_variable"], [176, 0, 1, "", "del_variable"], [177, 0, 1, "", "detci"], [178, 0, 1, "", "dfmp2"], [179, 0, 1, "", "dfocc"], [180, 0, 1, "", "dlpno"], [181, 0, 1, "", "dmrg"], [182, 0, 1, "", "doublet"], [183, 2, 1, "", "dpdbuf4"], [184, 2, 1, "", "dpdfile2"], [185, 0, 1, "", "dummy_einsums"], [186, 0, 1, "", "dummy_integratorxx"], [187, 0, 1, "", "fcidump_tei_helper"], [188, 0, 1, "", "finalize"], [189, 0, 1, "", "flush_outfile"], [190, 0, 1, "", "fnocc"], [191, 0, 1, "", "get_active_molecule"], [192, 0, 1, "", "get_array_variable"], [193, 0, 1, "", "get_array_variables"], [194, 0, 1, "", "get_datadir"], [195, 0, 1, "", "get_global_option"], [196, 0, 1, "", "get_global_option_list"], [197, 0, 1, "", "get_local_option"], [198, 0, 1, "", "get_memory"], [199, 0, 1, "", "get_num_threads"], [200, 0, 1, "", "get_option"], [201, 0, 1, "", "get_options"], [202, 0, 1, "", "get_output_file"], [203, 0, 1, "", "get_variable"], [204, 0, 1, "", "get_variables"], [205, 0, 1, "", "get_writer_file_prefix"], [206, 0, 1, "", "git_version"], [207, 0, 1, "", "has_array_variable"], [208, 0, 1, "", "has_global_option_changed"], [209, 0, 1, "", "has_local_option_changed"], [210, 0, 1, "", "has_option_changed"], [211, 0, 1, "", "has_scalar_variable"], [212, 0, 1, "", "has_variable"], [213, 0, 1, "", "initialize"], [214, 0, 1, "", "libint2_solid_harmonics_ordering"], [215, 0, 1, "", "mcscf"], [216, 0, 1, "", "mrcc_generate_input"], [217, 0, 1, "", "mrcc_load_densities"], [218, 0, 1, "", "occ"], [219, 0, 1, "", "option_exists_in_module"], [220, 0, 1, "", "options_to_python"], [221, 0, 1, "", "outfile_name"], [222, 0, 1, "", "plugin"], [223, 0, 1, "", "plugin_close"], [224, 0, 1, "", "plugin_close_all"], [225, 0, 1, "", "plugin_load"], [226, 0, 1, "", "prepare_options_for_module"], [227, 0, 1, "", "print_global_options"], [228, 0, 1, "", "print_options"], [229, 0, 1, "", "print_out"], [230, 0, 1, "", "print_variables"], [231, 0, 1, "", "psi_top_srcdir"], [232, 0, 1, "", "psimrcc"], [233, 2, 1, "", "psio_entry"], [234, 0, 1, "", "reopen_outfile"], [235, 0, 1, "", "revoke_global_option_changed"], [236, 0, 1, "", "revoke_local_option_changed"], [237, 0, 1, "", "sapt"], [238, 0, 1, "", "scalar_variable"], [239, 0, 1, "", "scalar_variables"], [240, 0, 1, "", "scatter"], [241, 0, 1, "", "scfgrad"], [242, 0, 1, "", "scfhess"], [243, 0, 1, "", "set_active_molecule"], [244, 0, 1, "", "set_array_variable"], [245, 0, 1, "", "set_datadir"], [246, 0, 1, "", "set_global_option"], [247, 0, 1, "", "set_global_option_python"], [248, 0, 1, "", "set_local_option"], [249, 0, 1, "", "set_local_option_python"], [250, 0, 1, "", "set_memory_bytes"], [251, 0, 1, "", "set_num_threads"], [252, 0, 1, "", "set_output_file"], [253, 0, 1, "", "set_psi_file_prefix"], [254, 0, 1, "", "set_scalar_variable"], [255, 0, 1, "", "set_variable"], [256, 0, 1, "", "test_matrix_dpd_interface"], [257, 0, 1, "", "timer_off"], [258, 0, 1, "", "timer_on"], [259, 0, 1, "", "triplet"], [260, 0, 1, "", "tstart"], [261, 0, 1, "", "tstop"], [262, 0, 1, "", "variable"], [263, 0, 1, "", "variables"], [264, 0, 1, "", "version"]], "psi4.core.AOShellCombinationsIterator": [[3, 3, 1, "", "first"], [3, 3, 1, "", "is_done"], [3, 3, 1, "", "next"], [3, 4, 1, "", "p"], [3, 4, 1, "", "q"], [3, 4, 1, "", "r"], [3, 4, 1, "", "s"]], "psi4.core.BSVec": [[5, 3, 1, "", "append"], [5, 3, 1, "", "clear"], [5, 3, 1, "", "count"], [5, 3, 1, "", "extend"], [5, 3, 1, "", "insert"], [5, 3, 1, "", "pop"], [5, 3, 1, "", "remove"]], "psi4.core.BasisExtents": [[6, 3, 1, "", "basis"], [6, 3, 1, "", "delta"], [6, 3, 1, "", "maxR"], [6, 3, 1, "", "set_delta"], [6, 3, 1, "", "shell_extents"]], "psi4.core.BasisFunctions": [[7, 3, 1, "", "basis_values"], [7, 3, 1, "", "compute_functions"], [7, 3, 1, "", "deriv"], [7, 3, 1, "", "max_functions"], [7, 3, 1, "", "max_points"], [7, 3, 1, "", "set_deriv"]], "psi4.core.BasisSet": [[8, 3, 1, "", "ao_to_shell"], [8, 3, 1, "", "blend"], [8, 3, 1, "", "build"], [8, 3, 1, "", "compute_phi"], [8, 3, 1, "", "construct_from_pydict"], [8, 3, 1, "", "ecp_shell"], [8, 3, 1, "", "ecp_shell_on_center"], [8, 3, 1, "", "function_to_center"], [8, 3, 1, "", "function_to_shell"], [8, 3, 1, "", "genbas"], [8, 3, 1, "", "has_ECP"], [8, 3, 1, "", "has_puream"], [8, 3, 1, "", "make_filename"], [8, 3, 1, "", "max_am"], [8, 3, 1, "", "max_function_per_shell"], [8, 3, 1, "", "max_nprimitive"], [8, 3, 1, "", "molecule"], [8, 3, 1, "", "move_atom"], [8, 3, 1, "", "n_ecp_core"], [8, 3, 1, "", "n_ecp_shell_on_center"], [8, 3, 1, "", "n_frozen_core"], [8, 3, 1, "", "name"], [8, 3, 1, "", "nao"], [8, 3, 1, "", "nbf"], [8, 3, 1, "", "nprimitive"], [8, 3, 1, "", "nshell"], [8, 3, 1, "", "nshell_on_center"], [8, 3, 1, "", "print_detail_out"], [8, 3, 1, "", "print_out"], [8, 3, 1, "", "shell"], [8, 3, 1, "", "shell_on_center"], [8, 3, 1, "", "shell_to_ao_function"], [8, 3, 1, "", "shell_to_basis_function"], [8, 3, 1, "", "shell_to_center"], [8, 3, 1, "", "zero_ao_basis_set"]], "psi4.core.BlockOPoints": [[9, 3, 1, "", "functions_local_to_global"], [9, 3, 1, "", "npoints"], [9, 3, 1, "", "parent_atom"], [9, 3, 1, "", "print_out"], [9, 3, 1, "", "refresh"], [9, 3, 1, "", "shells_local_to_global"], [9, 3, 1, "", "w"], [9, 3, 1, "", "x"], [9, 3, 1, "", "y"], [9, 3, 1, "", "z"]], "psi4.core.CCWavefunction": [[11, 3, 1, "", "get_amplitudes"], [11, 3, 1, "", "total_index"]], "psi4.core.CIVector": [[12, 3, 1, "", "axpy"], [12, 3, 1, "", "close_io_files"], [12, 3, 1, "", "copy"], [12, 3, 1, "", "dcalc"], [12, 3, 1, "", "divide"], [12, 3, 1, "", "init_io_files"], [12, 3, 1, "", "norm"], [12, 4, 1, "", "np"], [12, 3, 1, "", "read"], [12, 3, 1, "", "scale"], [12, 3, 1, "", "set_nvec"], [12, 3, 1, "", "shift"], [12, 3, 1, "", "symnormalize"], [12, 3, 1, "", "vdot"], [12, 3, 1, "", "vector_multiply"], [12, 3, 1, "", "write"], [12, 3, 1, "", "zero"]], "psi4.core.CIWavefunction": [[13, 3, 1, "", "D_vector"], [13, 3, 1, "", "Hd_vector"], [13, 3, 1, "", "ci_nat_orbs"], [13, 3, 1, "", "cleanup_ci"], [13, 3, 1, "", "cleanup_dpd"], [13, 3, 1, "", "compute_state_transfer"], [13, 3, 1, "", "diag_h"], [13, 3, 1, "", "form_opdm"], [13, 3, 1, "", "form_tpdm"], [13, 3, 1, "", "get_dimension"], [13, 3, 1, "", "get_opdm"], [13, 3, 1, "", "get_orbitals"], [13, 3, 1, "", "get_tpdm"], [13, 3, 1, "", "hamiltonian"], [13, 3, 1, "", "mcscf_object"], [13, 3, 1, "", "ndet"], [13, 3, 1, "", "new_civector"], [13, 3, 1, "", "opdm"], [13, 3, 1, "", "pitzer_to_ci_order_onel"], [13, 3, 1, "", "pitzer_to_ci_order_twoel"], [13, 3, 1, "", "print_vector"], [13, 3, 1, "", "reset_ci_H0block"], [13, 3, 1, "", "rotate_mcscf_integrals"], [13, 3, 1, "", "semicanonical_orbs"], [13, 3, 1, "", "set_ci_guess"], [13, 3, 1, "", "set_orbitals"], [13, 3, 1, "", "sigma"], [13, 3, 1, "", "tpdm"], [13, 3, 1, "", "transform_ci_integrals"], [13, 3, 1, "", "transform_mcscf_integrals"]], "psi4.core.CUHF": [[14, 3, 1, "", "c1_deep_copy"], [14, 3, 1, "", "compute_orbital_gradient"], [14, 3, 1, "", "diis"], [14, 3, 1, "", "mintshelper"]], "psi4.core.CdSalc": [[15, 3, 1, "", "irrep"], [15, 3, 1, "", "irrep_index"], [15, 3, 1, "", "print_out"]], "psi4.core.CdSalcList": [[16, 3, 1, "", "create_matrices"], [16, 3, 1, "", "matrix"], [16, 3, 1, "", "matrix_irrep"], [16, 3, 1, "", "ncd"], [16, 3, 1, "", "nirrep"], [16, 3, 1, "", "print_out"], [16, 3, 1, "", "salc_name"]], "psi4.core.CharacterTable": [[17, 3, 1, "", "gamma"], [17, 3, 1, "", "order"], [17, 3, 1, "", "symm_operation"]], "psi4.core.CompositeJK": [[18, 3, 1, "", "clear_D_prev"], [18, 3, 1, "", "do_incfock_iter"], [18, 3, 1, "", "get_COSX_grid"], [18, 3, 1, "", "get_snLinK_max_am"], [18, 3, 1, "", "set_COSX_grid"]], "psi4.core.CorrelationFactor": [[19, 3, 1, "", "set_params"]], "psi4.core.CorrelationTable": [[20, 3, 1, "", "degen"], [20, 3, 1, "", "group"], [20, 3, 1, "", "n"], [20, 3, 1, "", "ngamma"], [20, 3, 1, "", "subdegen"], [20, 3, 1, "", "subgroup"], [20, 3, 1, "", "subn"]], "psi4.core.CubeProperties": [[21, 3, 1, "", "basisset"], [21, 3, 1, "", "compute_density"], [21, 3, 1, "", "compute_orbitals"], [21, 3, 1, "", "compute_properties"], [21, 3, 1, "", "raw_compute_properties"]], "psi4.core.DFEP2Wavefunction": [[26, 3, 1, "", "compute"]], "psi4.core.DFHelper": [[27, 3, 1, "", "add_space"], [27, 3, 1, "", "add_transformation"], [27, 3, 1, "", "clear_all"], [27, 3, 1, "", "clear_spaces"], [27, 3, 1, "", "get_AO_core"], [27, 3, 1, "", "get_AO_size"], [27, 3, 1, "", "get_MO_core"], [27, 3, 1, "", "get_memory"], [27, 3, 1, "", "get_method"], [27, 3, 1, "", "get_schwarz_cutoff"], [27, 3, 1, "", "get_space_size"], [27, 3, 1, "", "get_tensor"], [27, 3, 1, "", "get_tensor_shape"], [27, 3, 1, "", "get_tensor_size"], [27, 3, 1, "", "hold_met"], [27, 3, 1, "", "initialize"], [27, 3, 1, "", "print_header"], [27, 3, 1, "", "set_AO_core"], [27, 3, 1, "", "set_MO_core"], [27, 3, 1, "", "set_memory"], [27, 3, 1, "", "set_method"], [27, 3, 1, "", "set_nthreads"], [27, 3, 1, "", "set_schwarz_cutoff"], [27, 3, 1, "", "set_subalgo"], [27, 3, 1, "", "transform"], [27, 3, 1, "", "transpose"]], "psi4.core.DFTGrid": [[29, 3, 1, "", "build"]], "psi4.core.DFTensor": [[30, 3, 1, "", "Idfmo"], [30, 3, 1, "", "Imo"], [30, 3, 1, "", "Qmo"], [30, 3, 1, "", "Qoo"], [30, 3, 1, "", "Qov"], [30, 3, 1, "", "Qso"], [30, 3, 1, "", "Qvv"]], "psi4.core.Deriv": [[61, 3, 1, "", "compute"], [61, 3, 1, "", "compute_df"], [61, 3, 1, "", "set_deriv_density_backtransformed"], [61, 3, 1, "", "set_ignore_reference"], [61, 3, 1, "", "set_tpdm_presorted"]], "psi4.core.DerivCalcType": [[62, 4, 1, "", "Correlated"], [62, 4, 1, "", "Default"], [62, 4, 1, "", "name"], [62, 4, 1, "", "value"]], "psi4.core.DiagonalizeOrder": [[63, 4, 1, "", "Ascending"], [63, 4, 1, "", "Descending"], [63, 4, 1, "", "name"], [63, 4, 1, "", "value"]], "psi4.core.Dimension": [[64, 3, 1, "", "fill"], [64, 3, 1, "", "from_list"], [64, 3, 1, "", "init"], [64, 3, 1, "", "max"], [64, 3, 1, "", "n"], [64, 4, 1, "", "name"], [64, 3, 1, "", "print_out"], [64, 3, 1, "", "sum"], [64, 3, 1, "", "to_tuple"], [64, 3, 1, "", "zero"]], "psi4.core.DirectJK": [[66, 3, 1, "", "do_incfock_iter"]], "psi4.core.Dispersion": [[68, 3, 1, "", "a1"], [68, 3, 1, "", "a2"], [68, 3, 1, "", "bibtex"], [68, 3, 1, "", "build"], [68, 3, 1, "", "citation"], [68, 3, 1, "", "compute_energy"], [68, 3, 1, "", "compute_gradient"], [68, 3, 1, "", "compute_hessian"], [68, 3, 1, "", "d"], [68, 3, 1, "", "description"], [68, 3, 1, "", "name"], [68, 3, 1, "", "print_energy"], [68, 3, 1, "", "print_gradient"], [68, 3, 1, "", "print_hessian"], [68, 3, 1, "", "print_out"], [68, 3, 1, "", "s6"], [68, 3, 1, "", "s8"], [68, 3, 1, "", "set_bibtex"], [68, 3, 1, "", "set_citation"], [68, 3, 1, "", "set_description"], [68, 3, 1, "", "set_name"], [68, 3, 1, "", "sr6"]], "psi4.core.ESPPropCalc": [[70, 3, 1, "", "compute_esp_over_grid_in_memory"], [70, 3, 1, "", "compute_field_over_grid_in_memory"]], "psi4.core.ExternalPotential": [[73, 3, 1, "", "addBasis"], [73, 3, 1, "", "addCharge"], [73, 3, 1, "", "appendCharges"], [73, 3, 1, "", "clear"], [73, 3, 1, "", "computeExternExternInteraction"], [73, 3, 1, "", "computeNuclearEnergy"], [73, 3, 1, "", "computePotentialMatrix"], [73, 3, 1, "", "getCharges"], [73, 3, 1, "", "gradient_on_charges"], [73, 3, 1, "", "print_out"], [73, 3, 1, "", "setName"]], "psi4.core.FCHKWriter": [[74, 3, 1, "", "SCF_Dtot"], [74, 3, 1, "", "set_postscf_density_label"], [74, 3, 1, "", "write"]], "psi4.core.FDDS_Dispersion": [[75, 3, 1, "", "R_A"], [75, 3, 1, "", "R_B"], [75, 3, 1, "", "aux_overlap"], [75, 3, 1, "", "form_aux_matrices"], [75, 3, 1, "", "form_unc_amplitude"], [75, 3, 1, "", "get_tensor_pqQ"], [75, 3, 1, "", "metric"], [75, 3, 1, "", "metric_inv"], [75, 3, 1, "", "print_tensor_pqQ"], [75, 3, 1, "", "project_densities"]], "psi4.core.FISAPT": [[76, 3, 1, "", "coulomb"], [76, 3, 1, "", "dHF"], [76, 3, 1, "", "disp"], [76, 3, 1, "", "do_cubes"], [76, 3, 1, "", "elst"], [76, 3, 1, "", "exch"], [76, 3, 1, "", "fdisp"], [76, 3, 1, "", "felst"], [76, 3, 1, "", "fexch"], [76, 3, 1, "", "find"], [76, 3, 1, "", "flocalize"], [76, 3, 1, "", "freeze_core"], [76, 3, 1, "", "ind"], [76, 3, 1, "", "kinetic"], [76, 3, 1, "", "localize"], [76, 3, 1, "", "matrices"], [76, 3, 1, "", "molecule"], [76, 3, 1, "", "nuclear"], [76, 3, 1, "", "overlap"], [76, 3, 1, "", "partition"], [76, 3, 1, "", "print_header"], [76, 3, 1, "", "print_trailer"], [76, 3, 1, "", "raw_plot"], [76, 3, 1, "", "scalars"], [76, 3, 1, "", "scf"], [76, 3, 1, "", "sinf_disp"], [76, 3, 1, "", "unify"], [76, 3, 1, "", "unify_part2"], [76, 3, 1, "", "vectors"]], "psi4.core.FittedSlaterCorrelationFactor": [[77, 3, 1, "", "exponent"]], "psi4.core.FittingMetric": [[78, 3, 1, "", "form_QR_inverse"], [78, 3, 1, "", "form_cholesky_inverse"], [78, 3, 1, "", "form_eig_inverse"], [78, 3, 1, "", "form_fitting_metric"], [78, 3, 1, "", "form_full_inverse"], [78, 3, 1, "", "get_algorithm"], [78, 3, 1, "", "get_metric"], [78, 3, 1, "", "get_pivots"], [78, 3, 1, "", "get_reverse_pivots"], [78, 3, 1, "", "is_inverted"], [78, 3, 1, "", "is_poisson"]], "psi4.core.FragmentType": [[79, 4, 1, "", "Absent"], [79, 4, 1, "", "Ghost"], [79, 4, 1, "", "Real"], [79, 4, 1, "", "name"], [79, 4, 1, "", "value"]], "psi4.core.Functional": [[80, 3, 1, "", "alpha"], [80, 3, 1, "", "build_base"], [80, 3, 1, "", "citation"], [80, 3, 1, "", "compute_functional"], [80, 3, 1, "", "density_cutoff"], [80, 3, 1, "", "description"], [80, 3, 1, "", "is_gga"], [80, 3, 1, "", "is_lrc"], [80, 3, 1, "", "is_meta"], [80, 3, 1, "", "lsda_cutoff"], [80, 3, 1, "", "meta_cutoff"], [80, 3, 1, "", "name"], [80, 3, 1, "", "omega"], [80, 3, 1, "", "print_detail"], [80, 3, 1, "", "print_out"], [80, 3, 1, "", "set_alpha"], [80, 3, 1, "", "set_citation"], [80, 3, 1, "", "set_density_cutoff"], [80, 3, 1, "", "set_description"], [80, 3, 1, "", "set_gga"], [80, 3, 1, "", "set_lsda_cutoff"], [80, 3, 1, "", "set_meta"], [80, 3, 1, "", "set_meta_cutoff"], [80, 3, 1, "", "set_name"], [80, 3, 1, "", "set_omega"], [80, 3, 1, "", "set_parameter"]], "psi4.core.GaussianShell": [[81, 4, 1, "", "AMCHAR"], [81, 4, 1, "", "am"], [81, 4, 1, "", "amchar"], [81, 3, 1, "", "coef"], [81, 3, 1, "", "coord"], [81, 3, 1, "", "erd_coef"], [81, 3, 1, "", "exp"], [81, 4, 1, "", "function_index"], [81, 3, 1, "", "is_cartesian"], [81, 3, 1, "", "is_pure"], [81, 4, 1, "", "ncartesian"], [81, 4, 1, "", "ncenter"], [81, 4, 1, "", "nfunction"], [81, 4, 1, "", "nprimitive"], [81, 3, 1, "", "original_coef"]], "psi4.core.GaussianType": [[82, 4, 1, "", "Cartesian"], [82, 4, 1, "", "Pure"], [82, 4, 1, "", "name"], [82, 4, 1, "", "value"]], "psi4.core.GeometryUnits": [[83, 4, 1, "", "Angstrom"], [83, 4, 1, "", "Bohr"], [83, 4, 1, "", "name"], [83, 4, 1, "", "value"]], "psi4.core.HF": [[84, 4, 1, "", "MOM_excited_"], [84, 4, 1, "", "MOM_performed_"], [84, 3, 1, "", "V_potential"], [84, 3, 1, "", "Va"], [84, 3, 1, "", "Vb"], [84, 4, 1, "", "attempt_number_"], [84, 3, 1, "", "check_phases"], [84, 3, 1, "", "clear_external_cpscf_perturbations"], [84, 3, 1, "", "clear_external_potentials"], [84, 3, 1, "", "compute_E"], [84, 3, 1, "", "compute_energy"], [84, 3, 1, "", "compute_fvpi"], [84, 3, 1, "", "compute_initial_E"], [84, 3, 1, "", "compute_orbital_gradient"], [84, 3, 1, "", "compute_spin_contamination"], [84, 3, 1, "", "cphf_Hx"], [84, 3, 1, "", "cphf_converged"], [84, 3, 1, "", "cphf_solve"], [84, 3, 1, "", "damping_update"], [84, 3, 1, "", "diis"], [84, 4, 1, "", "diis_enabled_"], [84, 4, 1, "", "diis_manager_"], [84, 4, 1, "", "diis_start_"], [84, 3, 1, "", "finalize"], [84, 3, 1, "", "finalize_energy"], [84, 3, 1, "", "find_occupation"], [84, 3, 1, "", "form_C"], [84, 3, 1, "", "form_D"], [84, 3, 1, "", "form_F"], [84, 3, 1, "", "form_FDSmSDF"], [84, 3, 1, "", "form_G"], [84, 3, 1, "", "form_H"], [84, 3, 1, "", "form_Shalf"], [84, 3, 1, "", "form_V"], [84, 3, 1, "", "form_initial_C"], [84, 3, 1, "", "form_initial_F"], [84, 4, 1, "", "frac_performed_"], [84, 3, 1, "", "frac_renormalize"], [84, 3, 1, "", "functional"], [84, 3, 1, "", "get_energies"], [84, 3, 1, "", "guess"], [84, 3, 1, "", "guess_Ca"], [84, 3, 1, "", "guess_Cb"], [84, 3, 1, "", "initialize"], [84, 3, 1, "", "initialize_gtfock_jk"], [84, 3, 1, "", "initialize_jk"], [84, 4, 1, "", "initialized_diis_manager_"], [84, 4, 1, "", "iteration_"], [84, 4, 1, "", "iteration_energies"], [84, 3, 1, "", "iterations"], [84, 3, 1, "", "jk"], [84, 3, 1, "", "occupation_a"], [84, 3, 1, "", "occupation_b"], [84, 3, 1, "", "onel_Hx"], [84, 3, 1, "", "print_energies"], [84, 3, 1, "", "print_header"], [84, 3, 1, "", "print_orbitals"], [84, 3, 1, "", "print_preiterations"], [84, 3, 1, "", "print_stability_analysis"], [84, 3, 1, "", "push_back_external_potential"], [84, 4, 1, "", "reset_occ_"], [84, 3, 1, "", "reset_occupation"], [84, 3, 1, "", "rotate_orbitals"], [84, 4, 1, "", "sad_"], [84, 3, 1, "", "save_density_and_energy"], [84, 3, 1, "", "scf_type"], [84, 3, 1, "", "semicanonicalize"], [84, 3, 1, "", "set_energies"], [84, 3, 1, "", "set_external_cpscf_perturbation"], [84, 3, 1, "", "set_jk"], [84, 3, 1, "", "set_sad_basissets"], [84, 3, 1, "", "set_sad_fitting_basissets"], [84, 3, 1, "", "soscf_update"], [84, 3, 1, "", "stability_analysis"], [84, 3, 1, "", "twoel_Hx"], [84, 3, 1, "", "validate_diis"]], "psi4.core.IO": [[86, 3, 1, "", "change_file_namespace"], [86, 3, 1, "", "close"], [86, 3, 1, "", "exists"], [86, 3, 1, "", "get_default_namespace"], [86, 3, 1, "", "getpid"], [86, 3, 1, "", "open"], [86, 3, 1, "", "open_check"], [86, 3, 1, "", "rehash"], [86, 3, 1, "", "set_default_namespace"], [86, 3, 1, "", "set_pid"], [86, 3, 1, "", "shared_object"], [86, 3, 1, "", "state"], [86, 3, 1, "", "tocclean"], [86, 3, 1, "", "tocentry_exists"], [86, 3, 1, "", "tocprint"], [86, 3, 1, "", "tocscan"], [86, 3, 1, "", "tocwrite"]], "psi4.core.IOManager": [[87, 3, 1, "", "crashclean"], [87, 3, 1, "", "get_default_path"], [87, 3, 1, "", "get_file_path"], [87, 3, 1, "", "mark_file_for_retention"], [87, 3, 1, "", "print_out"], [87, 3, 1, "", "psiclean"], [87, 3, 1, "", "set_default_path"], [87, 3, 1, "", "set_specific_path"], [87, 3, 1, "", "set_specific_retention"], [87, 3, 1, "", "shared_object"], [87, 3, 1, "", "write_scratch_file"]], "psi4.core.IntVector": [[88, 3, 1, "", "add"], [88, 3, 1, "", "clone"], [88, 3, 1, "", "copy"], [88, 3, 1, "", "dim"], [88, 3, 1, "", "dimpi"], [88, 3, 1, "", "get"], [88, 3, 1, "", "get_block"], [88, 3, 1, "", "init"], [88, 3, 1, "", "iota"], [88, 4, 1, "", "name"], [88, 3, 1, "", "nirrep"], [88, 3, 1, "", "print_out"], [88, 3, 1, "", "set"], [88, 3, 1, "", "set_block"], [88, 3, 1, "", "zero"]], "psi4.core.IntegralFactory": [[89, 3, 1, "", "ao_angular_momentum"], [89, 3, 1, "", "ao_dipole"], [89, 3, 1, "", "ao_kinetic"], [89, 3, 1, "", "ao_multipole_potential"], [89, 3, 1, "", "ao_multipoles"], [89, 3, 1, "", "ao_nabla"], [89, 3, 1, "", "ao_overlap"], [89, 3, 1, "", "ao_potential"], [89, 3, 1, "", "ao_quadrupole"], [89, 3, 1, "", "ao_traceless_quadrupole"], [89, 3, 1, "", "electric_field"], [89, 3, 1, "", "electrostatic"], [89, 3, 1, "", "erf_complement_eri"], [89, 3, 1, "", "erf_eri"], [89, 3, 1, "", "eri"], [89, 3, 1, "", "f12"], [89, 3, 1, "", "f12_double_commutator"], [89, 3, 1, "", "f12_squared"], [89, 3, 1, "", "f12g12"], [89, 3, 1, "", "overlap_3c"], [89, 3, 1, "", "shells_iterator"], [89, 3, 1, "", "so_angular_momentum"], [89, 3, 1, "", "so_dipole"], [89, 3, 1, "", "so_kinetic"], [89, 3, 1, "", "so_multipoles"], [89, 3, 1, "", "so_nabla"], [89, 3, 1, "", "so_overlap"], [89, 3, 1, "", "so_potential"], [89, 3, 1, "", "so_quadrupole"], [89, 3, 1, "", "so_traceless_quadrupole"]], "psi4.core.IntegralTransform": [[90, 3, 1, "", "DPD_ID"], [90, 3, 1, "", "alpha_corr_to_pitzer"], [90, 3, 1, "", "backtransform_density"], [90, 3, 1, "", "backtransform_tpdm_restricted"], [90, 3, 1, "", "backtransform_tpdm_unrestricted"], [90, 3, 1, "", "beta_corr_to_pitzer"], [90, 3, 1, "", "compute_fock_like_matrices"], [90, 3, 1, "", "get_dpd_id"], [90, 3, 1, "", "get_frozen_core_energy"], [90, 3, 1, "", "get_keep_dpd_so_ints"], [90, 3, 1, "", "get_keep_ht_ints"], [90, 3, 1, "", "get_keep_iwl_so_ints"], [90, 3, 1, "", "get_memory"], [90, 3, 1, "", "get_print"], [90, 3, 1, "", "get_psio"], [90, 3, 1, "", "get_tei_already_presorted"], [90, 3, 1, "", "initialize"], [90, 3, 1, "", "nirrep"], [90, 3, 1, "", "presort_so_tei"], [90, 3, 1, "", "print_dpd_lookup"], [90, 3, 1, "", "reset_so_int"], [90, 3, 1, "", "set_aa_int_name"], [90, 3, 1, "", "set_ab_int_name"], [90, 3, 1, "", "set_bb_int_name"], [90, 3, 1, "", "set_dpd_id"], [90, 3, 1, "", "set_dpd_int_file"], [90, 3, 1, "", "set_keep_dpd_so_ints"], [90, 3, 1, "", "set_keep_ht_ints"], [90, 3, 1, "", "set_keep_iwl_so_ints"], [90, 3, 1, "", "set_memory"], [90, 3, 1, "", "set_orbitals"], [90, 3, 1, "", "set_print"], [90, 3, 1, "", "set_psio"], [90, 3, 1, "", "set_so_tei_file"], [90, 3, 1, "", "set_tei_already_presorted"], [90, 3, 1, "", "set_tpdm_already_presorted"], [90, 3, 1, "", "set_write_dpd_so_tpdm"], [90, 3, 1, "", "transform_tei"], [90, 3, 1, "", "transform_tei_first_half"], [90, 3, 1, "", "transform_tei_second_half"], [90, 3, 1, "", "update_orbitals"]], "psi4.core.IrreducibleRepresentation": [[91, 3, 1, "", "character"], [91, 3, 1, "", "symbol"]], "psi4.core.JK": [[92, 3, 1, "", "C_add"], [92, 3, 1, "", "C_clear"], [92, 3, 1, "", "C_left_add"], [92, 3, 1, "", "C_right_add"], [92, 3, 1, "", "D"], [92, 3, 1, "", "J"], [92, 3, 1, "", "K"], [92, 3, 1, "", "basisset"], [92, 3, 1, "", "build"], [92, 3, 1, "", "build_JK"], [92, 3, 1, "", "compute"], [92, 3, 1, "", "computed_shells_per_iter"], [92, 3, 1, "", "finalize"], [92, 3, 1, "", "get_omega"], [92, 3, 1, "", "get_omega_alpha"], [92, 3, 1, "", "get_omega_beta"], [92, 3, 1, "", "get_wcombine"], [92, 3, 1, "", "initialize"], [92, 3, 1, "", "memory_estimate"], [92, 3, 1, "", "name"], [92, 3, 1, "", "print_header"], [92, 3, 1, "", "set_cutoff"], [92, 3, 1, "", "set_do_J"], [92, 3, 1, "", "set_do_K"], [92, 3, 1, "", "set_do_wK"], [92, 3, 1, "", "set_memory"], [92, 3, 1, "", "set_omega"], [92, 3, 1, "", "set_omega_alpha"], [92, 3, 1, "", "set_omega_beta"], [92, 3, 1, "", "set_omp_nthread"], [92, 3, 1, "", "set_print"], [92, 3, 1, "", "set_wcombine"], [92, 3, 1, "", "wK"]], "psi4.core.LS_THC_Computer": [[94, 3, 1, "", "compute_thc_factorization"], [94, 3, 1, "", "get_Z"], [94, 3, 1, "", "get_x1"], [94, 3, 1, "", "get_x2"], [94, 3, 1, "", "get_x3"], [94, 3, 1, "", "get_x4"]], "psi4.core.LaplaceDenominator": [[95, 3, 1, "", "denominator_occ"], [95, 3, 1, "", "denominator_vir"]], "psi4.core.LibXCFunctional": [[96, 3, 1, "", "density_cutoff"], [96, 3, 1, "", "get_mix_data"], [96, 3, 1, "", "query_libxc"], [96, 3, 1, "", "set_density_cutoff"], [96, 3, 1, "", "set_omega"], [96, 3, 1, "", "set_tweak"], [96, 3, 1, "", "xclib_description"]], "psi4.core.Localizer": [[97, 4, 1, "", "L"], [97, 4, 1, "", "U"], [97, 3, 1, "", "build"], [97, 4, 1, "", "converged"], [97, 3, 1, "", "localize"]], "psi4.core.MOSpace": [[98, 3, 1, "", "aIndex"], [98, 3, 1, "", "aOrbs"], [98, 3, 1, "", "all"], [98, 3, 1, "", "bIndex"], [98, 3, 1, "", "bOrbs"], [98, 3, 1, "", "dum"], [98, 3, 1, "", "fzc"], [98, 3, 1, "", "fzv"], [98, 3, 1, "", "label"], [98, 3, 1, "", "nil"], [98, 3, 1, "", "occ"], [98, 3, 1, "", "vir"]], "psi4.core.MOWriter": [[99, 3, 1, "", "write"]], "psi4.core.Matrix": [[100, 3, 1, "", "absmax"], [100, 3, 1, "", "accumulate_product"], [100, 3, 1, "", "add"], [100, 3, 1, "", "add_and_orthogonalize_row"], [100, 3, 1, "", "apply_denominator"], [100, 3, 1, "", "array_interface"], [100, 3, 1, "", "axpy"], [100, 3, 1, "", "back_transform"], [100, 3, 1, "", "chain_dot"], [100, 3, 1, "", "cholesky_factorize"], [100, 3, 1, "", "clone"], [100, 3, 1, "", "coldim"], [100, 3, 1, "", "cols"], [100, 3, 1, "", "copy"], [100, 3, 1, "", "copy_lower_to_upper"], [100, 3, 1, "", "copy_upper_to_lower"], [100, 3, 1, "", "diagonalize"], [100, 3, 1, "", "doublet"], [100, 3, 1, "", "from_array"], [100, 3, 1, "", "from_list"], [100, 3, 1, "", "from_serial"], [100, 3, 1, "", "gemm"], [100, 3, 1, "", "general_invert"], [100, 3, 1, "", "get"], [100, 3, 1, "", "get_block"], [100, 3, 1, "", "hermitivitize"], [100, 3, 1, "", "hermitize"], [100, 3, 1, "", "identity"], [100, 3, 1, "", "invert"], [100, 3, 1, "", "load"], [100, 3, 1, "", "load_mpqc"], [100, 4, 1, "", "name"], [100, 3, 1, "", "nirrep"], [100, 4, 1, "", "np"], [100, 3, 1, "", "np_read"], [100, 3, 1, "", "np_write"], [100, 4, 1, "", "nph"], [100, 3, 1, "", "partial_cholesky_factorize"], [100, 3, 1, "", "power"], [100, 3, 1, "", "print_atom_vector"], [100, 3, 1, "", "print_out"], [100, 3, 1, "", "pseudoinverse"], [100, 3, 1, "", "remove_symmetry"], [100, 3, 1, "", "rms"], [100, 3, 1, "", "rotate_columns"], [100, 3, 1, "", "rowdim"], [100, 3, 1, "", "rows"], [100, 3, 1, "", "save"], [100, 3, 1, "", "scale"], [100, 3, 1, "", "scale_column"], [100, 3, 1, "", "scale_row"], [100, 3, 1, "", "schmidt"], [100, 3, 1, "", "set"], [100, 3, 1, "", "set_block"], [100, 4, 1, "", "shape"], [100, 3, 1, "", "subtract"], [100, 3, 1, "", "sum_of_squares"], [100, 3, 1, "", "symmetrize_gradient"], [100, 3, 1, "", "symmetry"], [100, 3, 1, "", "to_array"], [100, 3, 1, "", "to_serial"], [100, 3, 1, "", "trace"], [100, 3, 1, "", "transform"], [100, 3, 1, "", "transpose"], [100, 3, 1, "", "transpose_this"], [100, 3, 1, "", "triplet"], [100, 3, 1, "", "vector_dot"], [100, 3, 1, "", "zero"], [100, 3, 1, "", "zero_diagonal"], [100, 3, 1, "", "zero_lower"], [100, 3, 1, "", "zero_upper"]], "psi4.core.MatrixFactory": [[101, 3, 1, "", "create_matrix"]], "psi4.core.MemDFJK": [[102, 3, 1, "", "dfh"]], "psi4.core.MintsHelper": [[103, 3, 1, "", "ao_3center_deriv1"], [103, 3, 1, "", "ao_3coverlap"], [103, 3, 1, "", "ao_angular_momentum"], [103, 3, 1, "", "ao_dipole"], [103, 3, 1, "", "ao_dkh"], [103, 3, 1, "", "ao_efp_multipole_potential"], [103, 3, 1, "", "ao_elec_dip_deriv1"], [103, 3, 1, "", "ao_erf_eri"], [103, 3, 1, "", "ao_eri"], [103, 3, 1, "", "ao_eri_shell"], [103, 3, 1, "", "ao_f12"], [103, 3, 1, "", "ao_f12_double_commutator"], [103, 3, 1, "", "ao_f12_squared"], [103, 3, 1, "", "ao_f12g12"], [103, 3, 1, "", "ao_kinetic"], [103, 3, 1, "", "ao_metric_deriv1"], [103, 3, 1, "", "ao_multipole_potential"], [103, 3, 1, "", "ao_multipoles"], [103, 3, 1, "", "ao_nabla"], [103, 3, 1, "", "ao_oei_deriv1"], [103, 3, 1, "", "ao_oei_deriv2"], [103, 3, 1, "", "ao_overlap"], [103, 3, 1, "", "ao_overlap_half_deriv1"], [103, 3, 1, "", "ao_potential"], [103, 3, 1, "", "ao_potential_erf"], [103, 3, 1, "", "ao_potential_erf_complement"], [103, 3, 1, "", "ao_pvp"], [103, 3, 1, "", "ao_quadrupole"], [103, 3, 1, "", "ao_tei_deriv1"], [103, 3, 1, "", "ao_tei_deriv2"], [103, 3, 1, "", "ao_traceless_quadrupole"], [103, 3, 1, "", "basisset"], [103, 3, 1, "", "cdsalcs"], [103, 3, 1, "", "core_hamiltonian_grad"], [103, 3, 1, "", "dipole_grad"], [103, 3, 1, "", "electric_field"], [103, 3, 1, "", "electric_field_value"], [103, 3, 1, "", "electrostatic_potential_value"], [103, 3, 1, "", "f12_cgtg"], [103, 3, 1, "", "factory"], [103, 3, 1, "", "induction_operator"], [103, 3, 1, "", "integral"], [103, 3, 1, "", "integrals"], [103, 3, 1, "", "integrals_erf"], [103, 3, 1, "", "integrals_erfc"], [103, 3, 1, "", "kinetic_grad"], [103, 3, 1, "", "mo_elec_dip_deriv1"], [103, 3, 1, "", "mo_erf_eri"], [103, 3, 1, "", "mo_eri"], [103, 3, 1, "", "mo_f12"], [103, 3, 1, "", "mo_f12_double_commutator"], [103, 3, 1, "", "mo_f12_squared"], [103, 3, 1, "", "mo_f12g12"], [103, 3, 1, "", "mo_oei_deriv1"], [103, 3, 1, "", "mo_oei_deriv2"], [103, 3, 1, "", "mo_overlap_half_deriv1"], [103, 3, 1, "", "mo_spin_eri"], [103, 3, 1, "", "mo_tei_deriv1"], [103, 3, 1, "", "mo_tei_deriv2"], [103, 3, 1, "", "mo_transform"], [103, 3, 1, "", "multipole_grad"], [103, 3, 1, "", "nbf"], [103, 3, 1, "", "one_electron_integrals"], [103, 3, 1, "", "overlap_grad"], [103, 3, 1, "", "perturb_grad"], [103, 3, 1, "", "petite_list"], [103, 3, 1, "", "petite_list1"], [103, 3, 1, "", "play"], [103, 3, 1, "", "potential_grad"], [103, 3, 1, "", "set_basisset"], [103, 3, 1, "", "set_print"], [103, 3, 1, "", "so_angular_momentum"], [103, 3, 1, "", "so_dipole"], [103, 3, 1, "", "so_dkh"], [103, 3, 1, "", "so_kinetic"], [103, 3, 1, "", "so_nabla"], [103, 3, 1, "", "so_overlap"], [103, 3, 1, "", "so_potential"], [103, 3, 1, "", "so_quadrupole"], [103, 3, 1, "", "so_traceless_quadrupole"], [103, 3, 1, "", "sobasisset"]], "psi4.core.MoldenWriter": [[104, 3, 1, "", "write"]], "psi4.core.MolecularGrid": [[105, 3, 1, "", "atomic_blocks"], [105, 3, 1, "", "blocks"], [105, 3, 1, "", "collocation_size"], [105, 3, 1, "", "max_functions"], [105, 3, 1, "", "max_points"], [105, 3, 1, "", "npoints"], [105, 3, 1, "", "orientation"], [105, 3, 1, "", "print"]], "psi4.core.Molecule": [[106, 3, 1, "", "B787"], [106, 3, 1, "", "BFS"], [106, 3, 1, "", "Z"], [106, 3, 1, "", "activate_all_fragments"], [106, 3, 1, "", "add_atom"], [106, 3, 1, "", "atom_at_position"], [106, 3, 1, "", "basis_on_atom"], [106, 3, 1, "", "center_of_mass"], [106, 3, 1, "", "charge"], [106, 3, 1, "", "clone"], [106, 3, 1, "", "com_fixed"], [106, 3, 1, "", "comment"], [106, 3, 1, "", "connectivity"], [106, 3, 1, "", "create_psi4_string_from_molecule"], [106, 3, 1, "", "deactivate_all_fragments"], [106, 3, 1, "", "distance_matrix"], [106, 3, 1, "", "extract_subsets"], [106, 3, 1, "", "fZ"], [106, 3, 1, "", "fcharge"], [106, 3, 1, "", "find_highest_point_group"], [106, 3, 1, "", "find_point_group"], [106, 3, 1, "", "fix_com"], [106, 3, 1, "", "fix_orientation"], [106, 3, 1, "", "flabel"], [106, 3, 1, "", "fmass"], [106, 3, 1, "", "form_symmetry_information"], [106, 3, 1, "", "format_molecule_for_mol"], [106, 3, 1, "", "from_arrays"], [106, 3, 1, "", "from_dict"], [106, 3, 1, "", "from_schema"], [106, 3, 1, "", "from_string"], [106, 3, 1, "", "fsymbol"], [106, 3, 1, "", "ftrue_atomic_number"], [106, 3, 1, "", "full_geometry"], [106, 3, 1, "", "full_pg_n"], [106, 3, 1, "", "fx"], [106, 3, 1, "", "fy"], [106, 3, 1, "", "fz"], [106, 3, 1, "", "geometry"], [106, 3, 1, "", "get_fragment_charges"], [106, 3, 1, "", "get_fragment_multiplicities"], [106, 3, 1, "", "get_fragment_types"], [106, 3, 1, "", "get_fragments"], [106, 3, 1, "", "get_full_point_group"], [106, 3, 1, "", "get_full_point_group_with_n"], [106, 3, 1, "", "get_variable"], [106, 3, 1, "", "has_zmatrix"], [106, 3, 1, "", "inertia_tensor"], [106, 3, 1, "", "input_units_to_au"], [106, 3, 1, "", "irrep_labels"], [106, 3, 1, "", "is_variable"], [106, 3, 1, "", "label"], [106, 3, 1, "", "mass"], [106, 3, 1, "", "mass_number"], [106, 3, 1, "", "molecular_charge"], [106, 3, 1, "", "move_to_com"], [106, 3, 1, "", "multiplicity"], [106, 3, 1, "", "nallatom"], [106, 3, 1, "", "name"], [106, 3, 1, "", "natom"], [106, 3, 1, "", "nfragments"], [106, 3, 1, "", "nuclear_dipole"], [106, 3, 1, "", "nuclear_repulsion_energy"], [106, 3, 1, "", "nuclear_repulsion_energy_deriv1"], [106, 3, 1, "", "nuclear_repulsion_energy_deriv2"], [106, 3, 1, "", "orientation_fixed"], [106, 3, 1, "", "point_group"], [106, 3, 1, "", "print_bond_angles"], [106, 3, 1, "", "print_cluster"], [106, 3, 1, "", "print_distances"], [106, 3, 1, "", "print_in_input_format"], [106, 3, 1, "", "print_out"], [106, 3, 1, "", "print_out_in_angstrom"], [106, 3, 1, "", "print_out_in_bohr"], [106, 3, 1, "", "print_out_of_planes"], [106, 3, 1, "", "print_rotational_constants"], [106, 3, 1, "", "provenance"], [106, 3, 1, "", "reinterpret_coordentry"], [106, 3, 1, "", "reset_point_group"], [106, 3, 1, "", "rotational_constants"], [106, 3, 1, "", "rotational_symmetry_number"], [106, 3, 1, "", "rotor_type"], [106, 3, 1, "", "run_dftd3"], [106, 3, 1, "", "run_dftd4"], [106, 3, 1, "", "run_gcp"], [106, 3, 1, "", "save_string_xyz"], [106, 3, 1, "", "save_string_xyz_file"], [106, 3, 1, "", "save_xyz_file"], [106, 3, 1, "", "schoenflies_symbol"], [106, 3, 1, "", "scramble"], [106, 3, 1, "", "set_active_fragment"], [106, 3, 1, "", "set_active_fragments"], [106, 3, 1, "", "set_basis_all_atoms"], [106, 3, 1, "", "set_basis_by_label"], [106, 3, 1, "", "set_basis_by_number"], [106, 3, 1, "", "set_basis_by_symbol"], [106, 3, 1, "", "set_comment"], [106, 3, 1, "", "set_connectivity"], [106, 3, 1, "", "set_full_geometry"], [106, 3, 1, "", "set_geometry"], [106, 3, 1, "", "set_ghost_fragment"], [106, 3, 1, "", "set_ghost_fragments"], [106, 3, 1, "", "set_input_units_to_au"], [106, 3, 1, "", "set_mass"], [106, 3, 1, "", "set_molecular_charge"], [106, 3, 1, "", "set_multiplicity"], [106, 3, 1, "", "set_name"], [106, 3, 1, "", "set_nuclear_charge"], [106, 3, 1, "", "set_point_group"], [106, 3, 1, "", "set_provenance"], [106, 3, 1, "", "set_units"], [106, 3, 1, "", "set_variable"], [106, 3, 1, "", "symbol"], [106, 3, 1, "", "symmetrize"], [106, 3, 1, "", "symmetry_from_input"], [106, 3, 1, "", "to_arrays"], [106, 3, 1, "", "to_dict"], [106, 3, 1, "", "to_schema"], [106, 3, 1, "", "to_string"], [106, 3, 1, "", "translate"], [106, 3, 1, "", "true_atomic_number"], [106, 3, 1, "", "units"], [106, 3, 1, "", "update_geometry"], [106, 3, 1, "", "x"], [106, 3, 1, "", "xyz"], [106, 3, 1, "", "y"], [106, 3, 1, "", "z"]], "psi4.core.MultipoleSymmetry": [[108, 3, 1, "", "create_matrices"]], "psi4.core.NumIntHelper": [[110, 3, 1, "", "dd_density_integral"], [110, 3, 1, "", "density_integral"], [110, 3, 1, "", "numint_grid"], [110, 3, 1, "", "potential_integral"]], "psi4.core.OEProp": [[111, 3, 1, "", "Exvals"], [111, 3, 1, "", "Eyvals"], [111, 3, 1, "", "Ezvals"], [111, 3, 1, "", "Vvals"], [111, 3, 1, "", "add"], [111, 3, 1, "", "clear"], [111, 3, 1, "", "compute"], [111, 3, 1, "", "set_Da_ao"], [111, 3, 1, "", "set_Da_mo"], [111, 3, 1, "", "set_Da_so"], [111, 3, 1, "", "set_Db_ao"], [111, 3, 1, "", "set_Db_mo"], [111, 3, 1, "", "set_Db_so"], [111, 3, 1, "", "set_names"], [111, 3, 1, "", "set_title"], [111, 4, 1, "", "valid_methods"]], "psi4.core.OneBodyAOInt": [[112, 4, 1, "", "basis"], [112, 4, 1, "", "basis1"], [112, 4, 1, "", "basis2"], [112, 3, 1, "", "compute"], [112, 3, 1, "", "compute_shell"], [112, 4, 1, "", "origin"]], "psi4.core.OneBodySOInt": [[113, 4, 1, "", "basis"], [113, 4, 1, "", "basis1"], [113, 4, 1, "", "basis2"]], "psi4.core.Options": [[114, 3, 1, "", "add_array"], [114, 3, 1, "", "add_bool"], [114, 3, 1, "", "add_int"], [114, 3, 1, "", "add_str"], [114, 3, 1, "", "add_str_i"], [114, 3, 1, "", "get_bool"], [114, 3, 1, "", "get_current_module"], [114, 3, 1, "", "get_double"], [114, 3, 1, "", "get_int"], [114, 3, 1, "", "get_int_vector"], [114, 3, 1, "", "get_str"], [114, 3, 1, "", "print_global_options"], [114, 3, 1, "", "print_module_options"], [114, 3, 1, "", "read_globals"], [114, 3, 1, "", "set_array"], [114, 3, 1, "", "set_bool"], [114, 3, 1, "", "set_current_module"], [114, 3, 1, "", "set_double"], [114, 3, 1, "", "set_int"], [114, 3, 1, "", "set_read_globals"], [114, 3, 1, "", "set_str"], [114, 3, 1, "", "set_str_i"], [114, 3, 1, "", "validate_options"]], "psi4.core.OrbitalSpace": [[115, 3, 1, "", "C"], [115, 3, 1, "", "basisset"], [115, 3, 1, "", "build_cabs_space"], [115, 3, 1, "", "build_ri_space"], [115, 3, 1, "", "dim"], [115, 3, 1, "", "evals"], [115, 3, 1, "", "id"], [115, 3, 1, "", "integral"], [115, 3, 1, "", "name"], [115, 3, 1, "", "nirrep"], [115, 3, 1, "", "print_out"]], "psi4.core.PetiteList": [[118, 3, 1, "", "aotoso"], [118, 3, 1, "", "print"], [118, 3, 1, "", "sotoao"]], "psi4.core.PointFunctions": [[119, 3, 1, "", "ansatz"], [119, 3, 1, "", "compute_points"], [119, 3, 1, "", "orbital_values"], [119, 3, 1, "", "point_values"], [119, 3, 1, "", "print_out"], [119, 3, 1, "", "set_ansatz"], [119, 3, 1, "", "set_pointers"]], "psi4.core.PointGroup": [[120, 3, 1, "", "bits"], [120, 3, 1, "", "char_table"], [120, 3, 1, "", "full_name"], [120, 3, 1, "", "order"], [120, 3, 1, "", "symbol"]], "psi4.core.PrimitiveType": [[122, 4, 1, "", "Normalized"], [122, 4, 1, "", "Unnormalized"], [122, 4, 1, "", "name"], [122, 4, 1, "", "value"]], "psi4.core.PsiReturnType": [[126, 4, 1, "", "Failure"], [126, 4, 1, "", "Success"], [126, 4, 1, "", "name"], [126, 4, 1, "", "value"]], "psi4.core.RHF": [[128, 3, 1, "", "c1_deep_copy"], [128, 3, 1, "", "compute_orbital_gradient"], [128, 3, 1, "", "diis"], [128, 3, 1, "", "mintshelper"], [128, 3, 1, "", "twoel_Hx_full"]], "psi4.core.ROHF": [[130, 3, 1, "", "Ct"], [130, 3, 1, "", "c1_deep_copy"], [130, 3, 1, "", "compute_orbital_gradient"], [130, 3, 1, "", "diis"], [130, 3, 1, "", "mintshelper"], [130, 3, 1, "", "moFa"], [130, 3, 1, "", "moFb"], [130, 3, 1, "", "moFeff"], [130, 3, 1, "", "soFeff"]], "psi4.core.SADGuess": [[131, 3, 1, "", "Ca"], [131, 3, 1, "", "Cb"], [131, 3, 1, "", "Da"], [131, 3, 1, "", "Db"], [131, 3, 1, "", "build_SAD"], [131, 3, 1, "", "compute_guess"], [131, 3, 1, "", "set_atomic_fit_bases"], [131, 3, 1, "", "set_debug"], [131, 3, 1, "", "set_print"]], "psi4.core.SOBasisSet": [[132, 3, 1, "", "petite_list"]], "psi4.core.SOMCSCF": [[133, 3, 1, "", "Ck"], [133, 3, 1, "", "H_approx_diag"], [133, 3, 1, "", "approx_solve"], [133, 3, 1, "", "compute_AFock"], [133, 3, 1, "", "compute_Hk"], [133, 3, 1, "", "compute_Q"], [133, 3, 1, "", "compute_Qk"], [133, 3, 1, "", "current_AFock"], [133, 3, 1, "", "current_IFock"], [133, 3, 1, "", "current_ci_energy"], [133, 3, 1, "", "current_docc_energy"], [133, 3, 1, "", "current_total_energy"], [133, 3, 1, "", "form_rotation_matrix"], [133, 3, 1, "", "gradient"], [133, 3, 1, "", "gradient_rms"], [133, 3, 1, "", "rhf_energy"], [133, 3, 1, "", "solve"], [133, 3, 1, "", "update"], [133, 3, 1, "", "zero_redundant"]], "psi4.core.SalcComponent": [[134, 4, 1, "", "atom"], [134, 4, 1, "", "coef"], [134, 4, 1, "", "xyz"]], "psi4.core.SaveType": [[135, 4, 1, "", "Full"], [135, 4, 1, "", "LowerTriangle"], [135, 4, 1, "", "SubBlocks"], [135, 4, 1, "", "name"], [135, 4, 1, "", "value"]], "psi4.core.Slice": [[137, 3, 1, "", "begin"], [137, 3, 1, "", "end"]], "psi4.core.SuperFunctional": [[138, 3, 1, "", "XC_build"], [138, 3, 1, "", "add_c_functional"], [138, 3, 1, "", "add_x_functional"], [138, 3, 1, "", "allocate"], [138, 3, 1, "", "ansatz"], [138, 3, 1, "", "blank"], [138, 3, 1, "", "c_alpha"], [138, 3, 1, "", "c_functional"], [138, 3, 1, "", "c_functionals"], [138, 3, 1, "", "c_omega"], [138, 3, 1, "", "c_os_alpha"], [138, 3, 1, "", "c_ss_alpha"], [138, 3, 1, "", "citation"], [138, 3, 1, "", "compute_functional"], [138, 3, 1, "", "density_tolerance"], [138, 3, 1, "", "deriv"], [138, 3, 1, "", "description"], [138, 3, 1, "", "grac_alpha"], [138, 3, 1, "", "grac_beta"], [138, 3, 1, "", "grac_shift"], [138, 3, 1, "", "is_c_hybrid"], [138, 3, 1, "", "is_c_lrc"], [138, 3, 1, "", "is_c_scs_hybrid"], [138, 3, 1, "", "is_gga"], [138, 3, 1, "", "is_libxc_func"], [138, 3, 1, "", "is_meta"], [138, 3, 1, "", "is_x_hybrid"], [138, 3, 1, "", "is_x_lrc"], [138, 3, 1, "", "max_points"], [138, 3, 1, "", "name"], [138, 3, 1, "", "needs_grac"], [138, 3, 1, "", "needs_vv10"], [138, 3, 1, "", "needs_xc"], [138, 3, 1, "", "print_density_threshold"], [138, 3, 1, "", "print_detail"], [138, 3, 1, "", "print_out"], [138, 3, 1, "", "set_c_alpha"], [138, 3, 1, "", "set_c_omega"], [138, 3, 1, "", "set_c_os_alpha"], [138, 3, 1, "", "set_c_ss_alpha"], [138, 3, 1, "", "set_citation"], [138, 3, 1, "", "set_density_tolerance"], [138, 3, 1, "", "set_deriv"], [138, 3, 1, "", "set_description"], [138, 3, 1, "", "set_do_vv10"], [138, 3, 1, "", "set_grac_alpha"], [138, 3, 1, "", "set_grac_beta"], [138, 3, 1, "", "set_grac_shift"], [138, 3, 1, "", "set_lock"], [138, 3, 1, "", "set_max_points"], [138, 3, 1, "", "set_name"], [138, 3, 1, "", "set_vv10_b"], [138, 3, 1, "", "set_vv10_c"], [138, 3, 1, "", "set_x_alpha"], [138, 3, 1, "", "set_x_beta"], [138, 3, 1, "", "set_x_omega"], [138, 3, 1, "", "set_xclib_description"], [138, 3, 1, "", "test_functional"], [138, 3, 1, "", "value"], [138, 3, 1, "", "values"], [138, 3, 1, "", "vv10_b"], [138, 3, 1, "", "vv10_c"], [138, 3, 1, "", "x_alpha"], [138, 3, 1, "", "x_beta"], [138, 3, 1, "", "x_functional"], [138, 3, 1, "", "x_functionals"], [138, 3, 1, "", "x_omega"], [138, 3, 1, "", "xclib_description"]], "psi4.core.SymmetryOperation": [[139, 3, 1, "", "E"], [139, 3, 1, "", "c2_x"], [139, 3, 1, "", "c2_y"], [139, 3, 1, "", "c2_z"], [139, 3, 1, "", "i"], [139, 3, 1, "", "matrix"], [139, 3, 1, "", "operate"], [139, 3, 1, "", "rotate_n"], [139, 3, 1, "", "rotate_theta"], [139, 3, 1, "", "sigma_xy"], [139, 3, 1, "", "sigma_xz"], [139, 3, 1, "", "sigma_yz"], [139, 3, 1, "", "trace"], [139, 3, 1, "", "transform"], [139, 3, 1, "", "transpose"], [139, 3, 1, "", "unit"], [139, 3, 1, "", "zero"]], "psi4.core.TLaplaceDenominator": [[140, 3, 1, "", "denominator_occ"], [140, 3, 1, "", "denominator_vir"]], "psi4.core.ThreeCenterOverlapInt": [[141, 3, 1, "", "compute_shell"]], "psi4.core.TwoBodyAOInt": [[143, 3, 1, "", "compute_shell"], [143, 3, 1, "", "shell_significant"], [143, 3, 1, "", "update_density"]], "psi4.core.TwoElectronInt": [[144, 3, 1, "", "compute_shell"], [144, 3, 1, "", "shell_significant"]], "psi4.core.UHF": [[145, 3, 1, "", "c1_deep_copy"], [145, 3, 1, "", "compute_orbital_gradient"], [145, 3, 1, "", "diis"], [145, 3, 1, "", "mintshelper"], [145, 3, 1, "", "stability_analysis"]], "psi4.core.VBase": [[147, 3, 1, "", "Dao"], [147, 3, 1, "", "basis"], [147, 3, 1, "", "build"], [147, 3, 1, "", "build_collocation_cache"], [147, 3, 1, "", "clear_collocation_cache"], [147, 3, 1, "", "compute_V"], [147, 3, 1, "", "compute_Vx"], [147, 3, 1, "", "compute_gradient"], [147, 3, 1, "", "compute_hessain"], [147, 3, 1, "", "finalize"], [147, 3, 1, "", "functional"], [147, 3, 1, "", "get_block"], [147, 3, 1, "", "get_np_xyzw"], [147, 3, 1, "", "grid"], [147, 3, 1, "", "initialize"], [147, 3, 1, "", "nblocks"], [147, 3, 1, "", "print_header"], [147, 3, 1, "", "properties"], [147, 3, 1, "", "quadrature_values"], [147, 3, 1, "", "set_D"], [147, 3, 1, "", "set_debug"], [147, 3, 1, "", "set_print"]], "psi4.core.Vector": [[148, 3, 1, "", "add"], [148, 3, 1, "", "array_interface"], [148, 3, 1, "", "axpby"], [148, 3, 1, "", "axpy"], [148, 3, 1, "", "clone"], [148, 3, 1, "", "copy"], [148, 3, 1, "", "dim"], [148, 3, 1, "", "dimpi"], [148, 3, 1, "", "from_array"], [148, 3, 1, "", "from_list"], [148, 3, 1, "", "from_serial"], [148, 3, 1, "", "get"], [148, 3, 1, "", "get_block"], [148, 3, 1, "", "init"], [148, 3, 1, "", "load"], [148, 4, 1, "", "name"], [148, 3, 1, "", "nirrep"], [148, 4, 1, "", "np"], [148, 3, 1, "", "np_read"], [148, 3, 1, "", "np_write"], [148, 4, 1, "", "nph"], [148, 3, 1, "", "print_out"], [148, 3, 1, "", "save"], [148, 3, 1, "", "scale"], [148, 3, 1, "", "set"], [148, 3, 1, "", "set_block"], [148, 4, 1, "", "shape"], [148, 3, 1, "", "to_array"], [148, 3, 1, "", "to_serial"], [148, 3, 1, "", "vector_dot"], [148, 3, 1, "", "zero"]], "psi4.core.Vector3": [[149, 3, 1, "", "cross"], [149, 3, 1, "", "distance"], [149, 3, 1, "", "dot"], [149, 3, 1, "", "norm"], [149, 3, 1, "", "normalize"]], "psi4.core.Wavefunction": [[150, 3, 1, "", "Ca"], [150, 3, 1, "", "Ca_subset"], [150, 3, 1, "", "Cb"], [150, 3, 1, "", "Cb_subset"], [150, 3, 1, "", "Da"], [150, 3, 1, "", "Da_subset"], [150, 3, 1, "", "Db"], [150, 3, 1, "", "Db_subset"], [150, 3, 1, "", "Fa"], [150, 3, 1, "", "Fa_subset"], [150, 3, 1, "", "Fb"], [150, 3, 1, "", "Fb_subset"], [150, 3, 1, "", "H"], [150, 3, 1, "", "PCM_enabled"], [150, 3, 1, "", "S"], [150, 3, 1, "", "alpha_orbital_space"], [150, 3, 1, "", "aotoso"], [150, 3, 1, "", "array_variable"], [150, 3, 1, "", "array_variables"], [150, 3, 1, "", "arrays"], [150, 3, 1, "", "atomic_point_charges"], [150, 3, 1, "", "basis_projection"], [150, 3, 1, "", "basisset"], [150, 3, 1, "", "beta_orbital_space"], [150, 3, 1, "", "build"], [150, 3, 1, "", "c1_deep_copy"], [150, 3, 1, "", "compute_energy"], [150, 3, 1, "", "compute_gradient"], [150, 3, 1, "", "compute_hessian"], [150, 3, 1, "", "deep_copy"], [150, 3, 1, "", "del_array_variable"], [150, 3, 1, "", "del_potential_variable"], [150, 3, 1, "", "del_scalar_variable"], [150, 3, 1, "", "del_variable"], [150, 3, 1, "", "doccpi"], [150, 3, 1, "", "efzc"], [150, 3, 1, "", "energy"], [150, 3, 1, "", "epsilon_a"], [150, 3, 1, "", "epsilon_a_subset"], [150, 3, 1, "", "epsilon_b"], [150, 3, 1, "", "epsilon_b_subset"], [150, 3, 1, "", "esp_at_nuclei"], [150, 3, 1, "", "external_pot"], [150, 3, 1, "", "force_occpi"], [150, 3, 1, "", "frequencies"], [150, 3, 1, "", "from_file"], [150, 3, 1, "", "frzcpi"], [150, 3, 1, "", "frzvpi"], [150, 3, 1, "", "get_array"], [150, 3, 1, "", "get_basisset"], [150, 3, 1, "", "get_density"], [150, 3, 1, "", "get_dipole_field_strength"], [150, 3, 1, "", "get_print"], [150, 3, 1, "", "get_scratch_filename"], [150, 3, 1, "", "get_variable"], [150, 3, 1, "", "gradient"], [150, 3, 1, "", "has_array_variable"], [150, 3, 1, "", "has_potential_variable"], [150, 3, 1, "", "has_scalar_variable"], [150, 3, 1, "", "has_variable"], [150, 3, 1, "", "hessian"], [150, 3, 1, "", "lagrangian"], [150, 3, 1, "", "mintshelper"], [150, 3, 1, "", "mo_extents"], [150, 3, 1, "", "module"], [150, 3, 1, "", "molecule"], [150, 3, 1, "", "nalpha"], [150, 3, 1, "", "nalphapi"], [150, 3, 1, "", "name"], [150, 3, 1, "", "nbeta"], [150, 3, 1, "", "nbetapi"], [150, 3, 1, "", "nfrzc"], [150, 3, 1, "", "nirrep"], [150, 3, 1, "", "nmo"], [150, 3, 1, "", "nmopi"], [150, 3, 1, "", "no_occupations"], [150, 3, 1, "", "nso"], [150, 3, 1, "", "nsopi"], [150, 3, 1, "", "options"], [150, 3, 1, "", "potential_variable"], [150, 3, 1, "", "potential_variables"], [150, 3, 1, "", "reference_wavefunction"], [150, 3, 1, "", "same_a_b_dens"], [150, 3, 1, "", "same_a_b_orbs"], [150, 3, 1, "", "scalar_variable"], [150, 3, 1, "", "scalar_variables"], [150, 3, 1, "", "set_array"], [150, 3, 1, "", "set_array_variable"], [150, 3, 1, "", "set_basisset"], [150, 3, 1, "", "set_energy"], [150, 3, 1, "", "set_external_potential"], [150, 3, 1, "", "set_gradient"], [150, 3, 1, "", "set_hessian"], [150, 3, 1, "", "set_lagrangian"], [150, 3, 1, "", "set_module"], [150, 3, 1, "", "set_name"], [150, 3, 1, "", "set_potential_variable"], [150, 3, 1, "", "set_print"], [150, 3, 1, "", "set_reference_wavefunction"], [150, 3, 1, "", "set_scalar_variable"], [150, 3, 1, "", "set_variable"], [150, 3, 1, "", "shallow_copy"], [150, 3, 1, "", "sobasisset"], [150, 3, 1, "", "soccpi"], [150, 3, 1, "", "to_file"], [150, 3, 1, "", "variable"], [150, 3, 1, "", "variables"], [150, 3, 1, "", "write_molden"], [150, 3, 1, "", "write_nbo"]], "psi4.core.dpdbuf4": [[183, 3, 1, "", "axpy_matrix"], [183, 3, 1, "", "coldim"], [183, 3, 1, "", "rowdim"], [183, 3, 1, "", "zero"]], "psi4.core.dpdfile2": [[184, 3, 1, "", "axpy_matrix"], [184, 3, 1, "", "coldim"], [184, 3, 1, "", "rowdim"], [184, 3, 1, "", "zero"]], "psi4.driver": [[265, 5, 1, "", "AtomicComputer"], [266, 8, 1, "", "ConvergenceError"], [267, 2, 1, "", "EmpiricalDispersion"], [268, 8, 1, "", "ManagedMethodError"], [269, 8, 1, "", "MissingMethodError"], [270, 8, 1, "", "OptimizationConvergenceError"], [271, 8, 1, "", "ParsingError"], [272, 8, 1, "", "PastureRequiredError"], [273, 8, 1, "", "PsiException"], [274, 2, 1, "", "QMMM"], [275, 2, 1, "", "QMMMbohr"], [276, 8, 1, "", "SCFConvergenceError"], [277, 8, 1, "", "TDSCFConvergenceError"], [278, 8, 1, "", "TestComparisonError"], [279, 8, 1, "", "UpgradeHelper"], [280, 8, 1, "", "ValidationError"], [281, 0, 1, "", "activate"], [282, 0, 1, "", "banner"], [283, 0, 1, "", "basis_helper"], [284, 0, 1, "", "cbs"], [285, 0, 1, "", "compare_fchkfiles"], [286, 0, 1, "", "compare_fcidumps"], [287, 0, 1, "", "compare_moldenfiles"], [288, 0, 1, "", "copy_file_from_scratch"], [289, 0, 1, "", "copy_file_to_scratch"], [290, 0, 1, "", "create_plugin"], [291, 0, 1, "", "cubeprop"], [292, 0, 1, "", "docs_table_link"], [293, 0, 1, "", "dynamic_variable_bind"], [294, 0, 1, "", "energies_from_fcidump"], [295, 0, 1, "", "energy"], [296, 0, 1, "", "fchk"], [297, 0, 1, "", "fcidump"], [298, 0, 1, "", "fcidump_from_file"], [299, 0, 1, "", "find_approximate_string_matches"], [300, 0, 1, "", "freq"], [301, 0, 1, "", "frequencies"], [302, 0, 1, "", "frequency"], [303, 0, 1, "", "gdma"], [304, 0, 1, "", "geometry"], [305, 0, 1, "", "get_memory"], [306, 0, 1, "", "gradient"], [307, 0, 1, "", "hessian"], [308, 0, 1, "", "ipi_broker"], [309, 0, 1, "", "levenshtein"], [310, 0, 1, "", "libint2_configuration"], [311, 0, 1, "", "libint2_print_out"], [312, 0, 1, "", "mdi_run"], [313, 0, 1, "", "message_box"], [314, 0, 1, "", "molden"], [315, 0, 1, "", "molecule_get_attr"], [316, 0, 1, "", "molecule_set_attr"], [317, 0, 1, "", "oeprop"], [318, 0, 1, "", "opt"], [319, 0, 1, "", "optimize"], [320, 0, 1, "", "optimize_geometric"], [1827, 1, 0, "-", "p4util"], [379, 0, 1, "", "pcm_helper"], [380, 0, 1, "", "process_input"], [381, 0, 1, "", "prop"], [382, 0, 1, "", "properties"], [391, 0, 1, "", "sanitize_method"], [392, 0, 1, "", "sanitize_name"], [393, 0, 1, "", "scf_helper"], [394, 0, 1, "", "scf_wavefunction_factory"], [395, 0, 1, "", "set_memory"], [396, 0, 1, "", "set_module_options"], [397, 0, 1, "", "set_options"], [398, 0, 1, "", "tdscf"], [399, 0, 1, "", "vibanal_wfn"]], "psi4.driver.AtomicComputer": [[265, 6, 1, "", "basis"], [265, 3, 1, "", "compute"], [265, 6, 1, "", "computed"], [265, 6, 1, "", "driver"], [265, 3, 1, "", "get_results"], [265, 6, 1, "", "keywords"], [265, 6, 1, "", "method"], [265, 6, 1, "", "molecule"], [265, 6, 1, "", "owner_group"], [265, 3, 1, "", "plan"], [265, 6, 1, "", "priority"], [265, 6, 1, "", "protocols"], [265, 6, 1, "", "result"], [265, 6, 1, "", "result_id"], [265, 7, 1, "", "set_basis"], [265, 7, 1, "", "set_keywords"], [265, 7, 1, "", "set_method"], [265, 6, 1, "", "tag"]], "psi4.driver.ConvergenceError": [[266, 4, 1, "", "iteration"], [266, 4, 1, "", "message"]], "psi4.driver.EmpiricalDispersion": [[267, 3, 1, "", "compute_energy"], [267, 3, 1, "", "compute_gradient"], [267, 3, 1, "", "compute_hessian"], [267, 4, 1, "", "dashcoeff_supplement"], [267, 4, 1, "", "dashlevel"], [267, 4, 1, "", "dashlevel_citation"], [267, 4, 1, "", "dashparams"], [267, 4, 1, "", "dashparams_citation"], [267, 4, 1, "", "description"], [267, 4, 1, "", "disp"], [267, 4, 1, "", "engine"], [267, 4, 1, "", "fctldash"], [267, 4, 1, "", "ordered_params"], [267, 3, 1, "", "print_out"]], "psi4.driver.ManagedMethodError": [[268, 4, 1, "", "message"], [268, 4, 1, "", "stats"]], "psi4.driver.MissingMethodError": [[269, 4, 1, "", "message"]], "psi4.driver.OptimizationConvergenceError": [[270, 4, 1, "", "iteration"], [270, 4, 1, "", "message"], [270, 4, 1, "", "wfn"]], "psi4.driver.QMMMbohr": [[275, 3, 1, "", "addChargeAngstrom"], [275, 3, 1, "", "addChargeBohr"], [275, 3, 1, "", "addDiffuse"], [275, 3, 1, "", "populateExtern"]], "psi4.driver.SCFConvergenceError": [[276, 4, 1, "", "d_conv"], [276, 4, 1, "", "e_conv"], [276, 4, 1, "", "iteration"], [276, 4, 1, "", "message"], [276, 4, 1, "", "wfn"]], "psi4.driver.TDSCFConvergenceError": [[277, 4, 1, "", "iteration"], [277, 4, 1, "", "message"], [277, 4, 1, "", "stats"], [277, 4, 1, "", "wfn"], [277, 4, 1, "", "what"]], "psi4.driver.TestComparisonError": [[278, 4, 1, "", "message"]], "psi4.driver.ValidationError": [[280, 4, 1, "", "message"]], "psi4.driver.aliases": [[1740, 0, 1, "", "allen_focal_point"], [1740, 0, 1, "", "sherrill_gold_standard"]], "psi4.driver.diatomic": [[1761, 0, 1, "", "anharmonicity"]], "psi4.driver.driver_cbs": [[1740, 5, 1, "", "CompositeComputer"], [1740, 0, 1, "", "_get_default_xtpl"]], "psi4.driver.driver_cbs.CompositeComputer": [[1740, 6, 1, "", "basis"], [1740, 3, 1, "", "build_tasks"], [1740, 6, 1, "", "cbsrec"], [1740, 3, 1, "", "compute"], [1740, 6, 1, "", "compute_list"], [1740, 6, 1, "", "driver"], [1740, 3, 1, "", "get_psi_results"], [1740, 3, 1, "", "get_results"], [1740, 6, 1, "", "keywords"], [1740, 6, 1, "", "metadata"], [1740, 6, 1, "", "metameta"], [1740, 6, 1, "", "method"], [1740, 6, 1, "", "molecule"], [1740, 3, 1, "", "plan"], [1740, 6, 1, "", "results_list"], [1740, 7, 1, "", "set_molecule"], [1740, 6, 1, "", "task_list"], [1740, 6, 1, "", "trove"], [1740, 6, 1, "", "verbose"]], "psi4.driver.driver_cbs_helper": [[1740, 0, 1, "", "corl_xtpl_helgaker_2"], [1740, 0, 1, "", "register_composite_function"], [1740, 0, 1, "", "register_xtpl_function"], [1740, 0, 1, "", "scf_xtpl_helgaker_2"], [1740, 0, 1, "", "scf_xtpl_helgaker_3"], [1740, 0, 1, "", "scf_xtpl_karton_2"], [1740, 0, 1, "", "scf_xtpl_truhlar_2"], [1740, 0, 1, "", "xtpl_highest_1"]], "psi4.driver.driver_findif": [[1772, 5, 1, "", "FiniteDifferenceComputer"]], "psi4.driver.driver_findif.FiniteDifferenceComputer": [[1772, 3, 1, "", "build_tasks"], [1772, 3, 1, "", "compute"], [1772, 4, 1, "", "computer"], [1772, 6, 1, "", "driver"], [1772, 6, 1, "", "findifrec"], [1772, 3, 1, "", "get_psi_results"], [1772, 3, 1, "", "get_results"], [1772, 6, 1, "", "metameta"], [1772, 6, 1, "", "method"], [1772, 6, 1, "", "molecule"], [1772, 3, 1, "", "plan"], [1772, 7, 1, "", "set_driver"], [1772, 7, 1, "", "set_molecule"], [1772, 6, 1, "", "task_list"]], "psi4.driver.driver_nbody": [[1794, 2, 1, "", "BsseEnum"], [1794, 5, 1, "", "ManyBodyComputer"], [1768, 4, 1, "", "SubTaskComputers"], [1794, 0, 1, "", "nbody"]], "psi4.driver.driver_nbody.BsseEnum": [[1794, 4, 1, "", "cp"], [1794, 4, 1, "", "nocp"], [1794, 4, 1, "", "vmfc"]], "psi4.driver.driver_nbody.ManyBodyComputer": [[1794, 6, 1, "", "basis"], [1794, 6, 1, "", "bsse_type"], [1794, 3, 1, "", "build_tasks"], [1794, 3, 1, "", "compute"], [1794, 6, 1, "", "driver"], [1794, 6, 1, "", "embedding_charges"], [1794, 3, 1, "", "get_psi_results"], [1794, 3, 1, "", "get_results"], [1794, 6, 1, "", "keywords"], [1794, 6, 1, "", "max_nbody"], [1794, 6, 1, "", "method"], [1794, 6, 1, "", "molecule"], [1794, 6, 1, "", "nbodies_per_mc_level"], [1794, 6, 1, "", "nfragments"], [1794, 3, 1, "", "plan"], [1794, 3, 1, "", "prepare_results"], [1794, 6, 1, "", "quiet"], [1794, 6, 1, "", "return_total_data"], [1794, 7, 1, "", "set_bsse_type"], [1794, 7, 1, "", "set_embedding_charges"], [1794, 7, 1, "", "set_max_nbody"], [1794, 7, 1, "", "set_molecule"], [1794, 7, 1, "", "set_nfragments"], [1794, 7, 1, "", "set_return_total_data"], [1794, 6, 1, "", "task_list"]], "psi4.driver.frac": [[1768, 0, 1, "", "frac_nuke"], [1768, 0, 1, "", "frac_traverse"], [1768, 0, 1, "", "ip_fitting"]], "psi4.driver.inputparser": [[1768, 0, 1, "", "process_input"]], "psi4.driver.ipi_broker": [[1768, 2, 1, "", "IPIBroker"]], "psi4.driver.p4util": [[321, 2, 1, "", "DIIS"], [322, 2, 1, "", "Gaussian"], [323, 2, 1, "", "InPsight"], [324, 2, 1, "", "Lineshape"], [325, 2, 1, "", "Lorentzian"], [326, 2, 1, "", "OptionState"], [327, 2, 1, "", "OptionsState"], [328, 0, 1, "", "OptionsStateCM"], [329, 2, 1, "", "SolverEngine"], [330, 0, 1, "", "all_casings"], [331, 0, 1, "", "array_to_matrix"], [332, 0, 1, "", "banner"], [333, 0, 1, "", "basis_helper"], [334, 0, 1, "", "block_diagonal_array"], [335, 0, 1, "", "cg_solver"], [336, 0, 1, "", "compare_fchkfiles"], [337, 0, 1, "", "compare_fcidumps"], [338, 0, 1, "", "compare_moldenfiles"], [339, 0, 1, "", "copy_file_from_scratch"], [340, 0, 1, "", "copy_file_to_scratch"], [341, 0, 1, "", "cubeprop"], [342, 0, 1, "", "davidson_solver"], [343, 0, 1, "", "docs_table_link"], [344, 0, 1, "", "drop_duplicates"], [345, 0, 1, "", "energies_from_fcidump"], [346, 0, 1, "", "expand_psivars"], [347, 0, 1, "", "fcidump"], [348, 0, 1, "", "fcidump_from_file"], [349, 0, 1, "", "find_approximate_string_matches"], [350, 0, 1, "", "format_molecule_for_input"], [351, 0, 1, "", "format_options_for_input"], [352, 0, 1, "", "free_atom_volumes"], [353, 0, 1, "", "get_memory"], [354, 0, 1, "", "get_psifile"], [355, 0, 1, "", "getattr_ignorecase"], [356, 0, 1, "", "hamiltonian_solver"], [357, 0, 1, "", "hold_options_state"], [358, 0, 1, "", "import_ignorecase"], [359, 0, 1, "", "kwargs_lower"], [360, 0, 1, "", "levenshtein"], [361, 0, 1, "", "libint2_configuration"], [362, 0, 1, "", "libint2_print_out"], [363, 0, 1, "", "mat2arr"], [364, 0, 1, "", "message_box"], [365, 0, 1, "", "oeprop"], [366, 0, 1, "", "pcm_helper"], [367, 0, 1, "", "plump_qcvar"], [368, 0, 1, "", "prefactor_ecd"], [369, 0, 1, "", "prefactor_opa"], [370, 0, 1, "", "prepare_options_for_modules"], [371, 0, 1, "", "prepare_options_for_set_options"], [372, 0, 1, "", "provenance_stamp"], [373, 0, 1, "", "sanitize_method"], [374, 0, 1, "", "set_memory"], [375, 0, 1, "", "set_module_options"], [376, 0, 1, "", "set_options"], [377, 0, 1, "", "spectrum"], [378, 0, 1, "", "state_to_atomicinput"]], "psi4.driver.p4util.DIIS": [[321, 3, 1, "", "add"], [321, 3, 1, "", "extrapolate"]], "psi4.driver.p4util.Gaussian": [[322, 3, 1, "", "lineshape"], [322, 3, 1, "", "maximum"]], "psi4.driver.p4util.InPsight": [[323, 4, 1, "", "atoms"], [323, 4, 1, "", "azimuth"], [323, 4, 1, "", "bohr_per_ang"], [323, 4, 1, "", "bond_width"], [323, 4, 1, "", "bonding_alpha"], [323, 4, 1, "", "bonds"], [323, 4, 1, "", "colors"], [323, 4, 1, "", "defines"], [323, 4, 1, "", "elevation"], [323, 4, 1, "", "height"], [323, 4, 1, "", "light"], [323, 4, 1, "", "light_color"], [323, 4, 1, "", "location"], [323, 4, 1, "", "look_at"], [323, 3, 1, "", "position_camera"], [323, 4, 1, "", "radial_scale"], [323, 4, 1, "", "radii"], [323, 4, 1, "", "right"], [323, 3, 1, "", "save_density"], [323, 3, 1, "", "save_molecule"], [323, 3, 1, "", "set_camera"], [323, 3, 1, "", "set_color"], [323, 3, 1, "", "set_define"], [323, 3, 1, "", "set_radius"], [323, 3, 1, "", "set_size"], [323, 3, 1, "", "set_view"], [323, 4, 1, "", "sky"], [323, 4, 1, "", "up"], [323, 3, 1, "", "update_geometry"], [323, 4, 1, "", "width"], [323, 4, 1, "", "zoom"]], "psi4.driver.p4util.Lineshape": [[324, 4, 1, "", "domain"], [324, 4, 1, "", "gamma"], [324, 3, 1, "", "lineshape"], [324, 3, 1, "", "maximum"]], "psi4.driver.p4util.Lorentzian": [[325, 3, 1, "", "lineshape"], [325, 3, 1, "", "maximum"]], "psi4.driver.p4util.OptionState": [[326, 3, 1, "", "restore"]], "psi4.driver.p4util.OptionsState": [[327, 3, 1, "", "add_option"], [327, 3, 1, "", "restore"]], "psi4.driver.p4util.SolverEngine": [[329, 3, 1, "", "compute_products"], [329, 3, 1, "", "new_vector"], [329, 3, 1, "", "precondition"], [329, 3, 1, "", "residue"], [329, 3, 1, "", "vector_axpy"], [329, 3, 1, "", "vector_copy"], [329, 3, 1, "", "vector_dot"], [329, 3, 1, "", "vector_scale"]], "psi4.driver.p4util.numpy_helper": [[1797, 0, 1, "", "_to_array"], [1797, 0, 1, "", "array_to_matrix"]], "psi4.driver.procrouting.empirical_dispersion": [[1759, 2, 1, "", "EmpiricalDispersion"]], "psi4.driver.procrouting.empirical_dispersion.EmpiricalDispersion": [[1759, 4, 1, "", "dashcoeff_supplement"], [1759, 4, 1, "", "dashlevel"], [1759, 4, 1, "", "dashlevel_citation"], [1759, 4, 1, "", "dashparams"], [1759, 4, 1, "", "dashparams_citation"], [1759, 4, 1, "", "description"], [1759, 4, 1, "", "disp"], [1759, 4, 1, "", "engine"], [1759, 4, 1, "", "fctldash"], [1759, 4, 1, "", "ordered_params"]], "psi4.driver.procrouting.interface_cfour": [[1743, 0, 1, "", "run_cfour"]], "psi4.driver.qcdb": [[1768, 2, 1, "", "Molecule"], [1772, 1, 0, "-", "vib"]], "psi4.driver.qcdb.vib": [[383, 0, 1, "", "compare_vibinfos"], [384, 0, 1, "", "filter_nonvib"], [385, 0, 1, "", "filter_omega_to_real"], [386, 0, 1, "", "harmonic_analysis"], [387, 0, 1, "", "hessian_symmetrize"], [388, 0, 1, "", "print_molden_vibs"], [389, 0, 1, "", "print_vibs"], [390, 0, 1, "", "thermo"]], "psi4.driver.task_base": [[1768, 5, 1, "", "BaseComputer"]], "psi4.driver.task_base.BaseComputer": [[1768, 3, 1, "", "compute"], [1768, 3, 1, "", "plan"]], "psi4.driver.task_planner": [[1768, 4, 1, "", "TaskComputers"], [1768, 0, 1, "", "expand_cbs_methods"], [1768, 0, 1, "", "task_planner"]], "psi4.driver.wrapper_autofrag": [[1768, 0, 1, "", "auto_fragments"]], "psi4.driver.wrapper_database": [[1752, 0, 1, "", "database"]], "qcdb": [[2, 0, 1, "", "compare_vibinfos"]], "qcdb.Molecule": [[1759, 0, 1, "", "run_dftd3"], [1759, 0, 1, "", "run_dftd4"], [1774, 0, 1, "", "run_gcp"]]}, "objnames": {"0": ["py", "function", "Python function"], "1": ["py", "module", "Python module"], "2": ["py", "class", "Python class"], "3": ["py", "method", "Python method"], "4": ["py", "attribute", "Python attribute"], "5": ["py", "pydantic_model", "Python model"], "6": ["py", "pydantic_field", "Python field"], "7": ["py", "pydantic_validator", "Python validator"], "8": ["py", "exception", "Python exception"], "9": ["std", "psivar", "psivar"], "10": ["std", "envvar", "environment variable"], "11": ["std", "cmdoption", "program option"]}, "objtypes": {"0": "py:function", "1": "py:module", "2": "py:class", "3": "py:method", "4": "py:attribute", "5": "py:pydantic_model", "6": "py:pydantic_field", "7": "py:pydantic_validator", "8": "py:exception", "9": "std:psivar", "10": "std:envvar", "11": "std:cmdoption"}, "terms": {"": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1736, 1737, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1828, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "0": [0, 1, 2, 8, 11, 13, 15, 17, 61, 62, 68, 79, 82, 83, 84, 86, 88, 89, 91, 100, 103, 106, 111, 122, 126, 134, 135, 148, 150, 225, 262, 265, 268, 278, 284, 285, 287, 291, 295, 296, 300, 301, 302, 303, 314, 318, 319, 323, 331, 336, 338, 341, 342, 346, 356, 368, 369, 374, 377, 380, 381, 382, 384, 386, 390, 395, 401, 406, 413, 433, 442, 443, 450, 466, 479, 489, 507, 514, 518, 519, 542, 543, 568, 570, 573, 575, 577, 579, 584, 586, 587, 590, 592, 596, 597, 598, 599, 600, 602, 608, 609, 610, 611, 612, 613, 614, 615, 617, 619, 621, 622, 623, 625, 626, 627, 635, 637, 639, 640, 641, 642, 643, 644, 647, 648, 652, 656, 658, 660, 664, 667, 668, 669, 674, 675, 676, 678, 679, 681, 682, 683, 688, 690, 691, 696, 697, 698, 699, 700, 701, 702, 703, 705, 706, 707, 708, 709, 711, 712, 714, 716, 729, 738, 744, 752, 759, 761, 774, 779, 780, 781, 783, 800, 819, 828, 832, 833, 835, 837, 842, 852, 855, 862, 865, 870, 873, 884, 890, 895, 901, 902, 903, 904, 905, 906, 907, 908, 923, 928, 933, 936, 939, 943, 955, 957, 987, 988, 992, 993, 1023, 1032, 1033, 1034, 1051, 1053, 1058, 1070, 1078, 1082, 1084, 1101, 1104, 1110, 1115, 1116, 1118, 1125, 1126, 1148, 1149, 1184, 1188, 1193, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1215, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1228, 1229, 1230, 1231, 1237, 1238, 1239, 1241, 1242, 1256, 1265, 1269, 1271, 1272, 1275, 1289, 1302, 1304, 1305, 1323, 1332, 1333, 1335, 1340, 1343, 1344, 1345, 1348, 1352, 1353, 1363, 1396, 1400, 1405, 1425, 1427, 1463, 1469, 1473, 1474, 1476, 1481, 1482, 1485, 1490, 1499, 1503, 1504, 1508, 1511, 1512, 1513, 1516, 1519, 1520, 1522, 1523, 1525, 1529, 1530, 1531, 1538, 1539, 1540, 1545, 1555, 1556, 1561, 1562, 1570, 1576, 1580, 1588, 1598, 1608, 1618, 1650, 1660, 1668, 1679, 1680, 1690, 1692, 1694, 1695, 1696, 1697, 1698, 1700, 1701, 1702, 1703, 1704, 1706, 1707, 1714, 1730, 1731, 1732, 1738, 1739, 1740, 1742, 1743, 1746, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1763, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1774, 1775, 1776, 1779, 1781, 1782, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1796, 1797, 1798, 1800, 1801, 1802, 1803, 1805, 1806, 1808, 1810, 1814, 1817, 1819, 1826, 1828, 1829, 1832, 1833, 1834, 1836, 1837, 1838, 1841, 1842, 1844], "00": [284, 1226, 1331, 1704, 1730, 1740, 1789], "000": [651, 1206, 1704, 1706, 1763, 1802, 1828, 1844], "0000": [278, 1833, 1841], "000000": [1695, 1696, 1697, 1700, 1702, 1758, 1828, 1833, 1837, 1841, 1844], "0000000": 1743, "00000000": 1833, "0000000000": [1743, 1754, 1803], "000000000000": [1743, 1828, 1844], "00000000000000": 1833, "0000000000000001": 1756, "0000000000e": 1838, "0000000001": [1743, 1754, 1803], "000000004262": 1743, "000000439070": 1743, "00000064": 1752, "00000066": 1743, "00000098": 1743, "000001": 1795, "0000012398419739": 1706, "0000012566370614": 1706, "0000031668105": 1706, "00000371": 1743, "00000622": 1743, "000010060942": 1844, "000010063363": 1828, "000011663787": 1706, "00001205883214": 1706, "00001495e": 1706, "000018117284": 1743, "000025691": 1706, "00003577": 1743, "00004307": 1743, "00004802": 1752, "000057883818012": 1706, "000077480917310": 1706, "00008485": 1844, "00008488": 1828, "000086173303": 1706, "00008926": 1743, "000092278158": 1771, "00009889": 1743, "0000e": 1841, "0001": [342, 356, 1838], "0001134289257": 1706, "0001370933554798": 1706, "00014016": 1844, "00014019": 1828, "0001819200062203": 1706, "0001819543074854": 1706, "0002": 1841, "00024762": 1759, "0002623068456699684": 1752, "0002724437107484": 1706, "000287592": 1706, "00036369475486": 1706, "00036582690": 1706, "000389931104": 1828, "000389933562": 1844, "0004": 1752, "00040256": 1743, "0004046": 1734, "00044621": 1844, "00044738": 1828, "0004664345535": 1706, "0004669754554": 1706, "00048446": 1743, "00054386734428": 1706, "000544617021352": 1706, "000548579909070": 1706, "0006": 1706, "0006002": [1734, 1781], "0006910051439986686": 1752, "0007": 1841, "00070447": 1743, "00072738950972": 1706, "00077146": 1743, "00077279": 1844, "00077463": 1828, "000819116338": 1771, "0009": 1734, "000911394496": 1771, "001": [106, 323, 1226, 1345, 1704, 1706, 1768, 1785, 1802], "0010": [297, 347, 1706], "001007276466879": 1706, "00100866491588": 1706, "00104066882": 1706, "00104187563": 1706, "0011": 1706, "001158671471": 1706, "001158740958": 1706, "00115965218091": 1706, "00116592089": 1706, "0012": [1706, 1841], "0013": 1706, "00137841898": 1706, "00138844900": 1706, "0014": 1706, "00142923": 1844, "00142946": 1828, "0014825844040612934": 1752, "0015": 1706, "001506179127": 1706, "001520993128": 1706, "0015210322053": 1706, "0016": [1706, 1841], "00160359": 1743, "0016223936616": 1706, "0017": [1706, 1841], "00178749": 1844, "00178779": 1828, "00179": 1740, "0018": 1706, "0019": [1706, 1841], "00190749": 1706, "002": [1757, 1781], "0020": 1706, "002013553212745": 1706, "00207697e": 1706, "00209952e": 1706, "0021": 1706, "0022355825227244703": 1828, "00231930436182": 1706, "0023318418": 1706, "0024": 1706, "00241281": 1743, "0024741470062974724": 1752, "0025": 1706, "0026": 1706, "00268970802641242": 1776, "00268976": [1734, 1781], "00269": 1770, "0027": 1706, "0028": [1706, 1740], "0028977729": 1706, "0029": 1706, "0030": 1706, "00301493224673": 1706, "00301550071632": 1706, "0031": 1706, "0032": 1706, "0033": 1706, "0034": 1706, "0035470557928363178": 1752, "0035811": 1734, "0036": 1706, "0037": 1706, "0040": 1841, "004001506179127": 1706, "0040021": 1734, "0040992802": 1743, "0040993": 1743, "0042": 1706, "0043793": [1692, 1752], "0046": 1706, "0048": 1706, "00483633170": 1706, "00484197048": 1706, "005": [1023, 1217, 1704, 1740], "0050": 1706, "005063183e": 1706, "0051191833": 1743, "0051192": 1743, "00516e": 1838, "0053": 1706, "0057": 1706, "0058": 1706, "0059": 1706, "00594840": 1844, "00594928": 1828, "0061": 1706, "006412700e": 1706, "0064609": 1770, "0066": 1706, "006623618183": 1706, "0067": 1706, "0069": 1706, "007": [295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1758, 1766, 1770, 1800], "0070": 1752, "0071056": 1770, "0072": [1706, 1837], "007200": 1837, "007263598030": 1743, "007276466879": 1706, "0072973525664": 1706, "007356665e": 1706, "0075": 1752, "0076": 1706, "007825": [1828, 1833, 1844], "007a9b6": 1786, "008": [1714, 1743, 1842], "0081285": 1734, "00817094": 1837, "0082": 1841, "00839486625709": 1833, "0085": 1706, "00866": 1740, "00866491588": 1706, "00869851": 1740, "00881949": 1743, "0088666856": 1743, "0088667": 1743, "0089": 1706, "0090": 1706, "00901553": 1837, "0092": 1706, "0093": 1760, "0096": 1841, "0097": [1706, 1841], "0098": 1706, "00985995185668": [150, 262], "00e": [1743, 1802], "01": [0, 1, 2, 278, 285, 287, 336, 338, 401, 543, 943, 1197, 1203, 1213, 1226, 1335, 1704, 1743, 1781, 1802, 1837, 1838, 1841], "010": 1706, "01007985": 1844, "01008137": 1828, "0102383666": 1743, "0102384": 1743, "01036": 1734, "0105313323529": 1833, "011": 1706, "01144207": 1837, "0115002693348": 1752, "011500269334817403": 1752, "01152445": 1837, "012": [323, 1706, 1781], "012097": 1802, "0122978": 1743, "0122978407": 1743, "01234": 1733, "0123456789": 1730, "01245744": 1844, "01245755": 1828, "01247162": 1837, "012516": [1734, 1838], "0129": 1743, "013": 1706, "0133026": [295, 1695, 1698, 1700, 1701, 1734, 1758, 1766], "0135": 1841, "013553212745": 1706, "014": [1706, 1743, 1833], "014000": 1833, "014101": [1734, 1781, 1828, 1837, 1844], "014101779": 1833, "014103": [1734, 1774], "014306": 1740, "01436394": 1833, "0143877736": 1706, "0144": 1841, "0145": 1752, "01493224673": 1706, "015": 1706, "01507630": 1743, "0151070": 1734, "01523505": 1844, "01523518": 1828, "01550071632": 1706, "015687": 1844, "0158": 1841, "015968": 1828, "016": 1706, "016033": 1802, "01604927": 1833, "0161": 1752, "016215": 1828, "016264": 1844, "016265984132": [1828, 1844], "017": 1706, "0170834423405521": 1756, "0175": 1841, "018": 1706, "01800": 1749, "01823410": 1837, "018305": 1802, "01836538": 1837, "0188": 1743, "019": [1706, 1781], "0192889141131474": 1836, "01928891411315": 1836, "0195357736": 1734, "0197": 1841, "02": [150, 262, 443, 479, 519, 928, 1199, 1200, 1202, 1213, 1225, 1265, 1704, 1714, 1743, 1757, 1802, 1838, 1841, 1842], "020": 1706, "020680": 1832, "02099": 1770, "021": 1706, "0212": 1841, "021264": 1832, "021305": 1832, "0213974638823942": 1756, "021460": 1832, "0215": 1752, "0219": 1752, "022140857e": 1706, "022413962": 1706, "02263015": 1837, "0227": 1841, "022710947": 1706, "02277500": 1844, "02277530": 1828, "023": 1706, "0235": 1841, "024": 1706, "02400": 1770, "024102": 1781, "024103": [1734, 1837], "024107": 1781, "0243": 1841, "024801": [1734, 1837], "02481": 1770, "025": 1706, "02500": 1749, "02542623432": 1706, "026": 1706, "02663273410671": 1844, "026632734857": 1844, "02663273486682": 1828, "02663273488399": 1828, "026632734908": 1828, "027": 1706, "027022666011": 1828, "027022668419": 1844, "027032729361": 1844, "027032729374": 1828, "02703272937504": 1828, "02742199": 1844, "02742222": 1828, "028": 1706, "02817737": 1837, "02860757": 1837, "02881355": 1837, "02881480": 1740, "029": 1706, "0293": 1752, "03": [1743, 1788, 1802, 1838, 1841], "030": [1706, 1743], "0301": 1752, "03030": 1770, "031": 1706, "0310": [295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "03100": 1749, "0312": [1743, 1752], "031900": 1833, "032": 1706, "0321": 1743, "0321452": 1770, "032504": [1734, 1838], "03288936": 1740, "033": [1706, 1770], "0331513": 1730, "034": 1706, "03407997": 1740, "034108": [1714, 1734, 1763, 1842], "034116651e": 1706, "03460497": 1740, "03494879": 1740, "03507767": 1743, "0352": 1841, "03535": 1770, "035503": 1802, "03561890": 1743, "035800": 1841, "035999139": 1706, "036402": [295, 318, 319, 1695, 1697, 1698, 1702, 1703, 1758, 1766, 1800], "036671": 1841, "03674932248": 1706, "0369747": 1770, "037": 1706, "03739944": 1837, "0376": 1752, "03771": 1770, "038": 1706, "03893812": 1740, "039": 1706, "039475": 1841, "03954147": 1837, "03e": 1743, "04": [2, 285, 287, 336, 338, 1743, 1802, 1804, 1838, 1841], "040": [1706, 1770], "040712": 1837, "041": 1706, "042": 1706, "04201004": 1740, "042559": 1833, "043": 1706, "04330347": 1740, "04400": 1749, "044104": [1734, 1781], "044115": [1734, 1770], "0442": 1841, "04490350": 1837, "045": 1706, "04558907": 1837, "04591732": 1837, "046": 1706, "047": 1706, "04787362": 1837, "0479": 1743, "048": 1706, "04821832": 1837, "0486691861": 1734, "048798468084": 1771, "048976": 1802, "049180": 1802, "0497": 1841, "049853548145": 1771, "04e": [1743, 1802], "05": [1692, 1743, 1750, 1752, 1759, 1768, 1788, 1802, 1838, 1841], "050": 1706, "0500": 1743, "050000": [1695, 1700, 1758], "050783699e": 1706, "05098402733282": 2, "051": 1706, "051103": [1734, 1770, 1781], "0512503270216563": 1756, "051387722248": 1771, "052": 1706, "05362": 1770, "05367e": 1838, "054": 1706, "054028401038": 1771, "054101": [1734, 1754], "054104": [1734, 1781], "054105": 1781, "054107": [1734, 1774], "054111": [1734, 1754, 1803], "05436": 1770, "054571800e": 1706, "0546": 1841, "054892": 1802, "055": [1706, 1802], "05500": 1749, "0553": 1743, "056": 1706, "0566569": 1770, "056669079827": 1771, "0567": 1841, "05786571": 1833, "058224": 1802, "058257": 1706, "0587": 1841, "05893": 1770, "059": 1706, "0594649": 1706, "0595": 1841, "05959979": 1837, "059754": 1802, "05e": 1802, "06": [2, 115, 335, 730, 742, 750, 1208, 1704, 1714, 1743, 1753, 1757, 1781, 1802, 1838, 1841, 1842], "060": 1706, "0605": 1752, "061249": 1841, "061485823e": 1706, "062": [1706, 1770], "062748460180": 1743, "063": 1706, "0640": 1841, "064103": [1734, 1774], "064104": 1734, "065": 1706, "0650": 1841, "06509118": 1837, "065301311104": 1743, "06634e": 1838, "0673": 1752, "067403": 1802, "067833831e": 1706, "068": 1828, "0690": 1743, "0696860": 1770, "07": [2, 287, 338, 1734, 1738, 1743, 1786, 1802, 1838], "07038252": 1837, "071": 1706, "072": 1770, "07214637e": 1706, "0729": 1841, "073": 1706, "0735441105e": 1706, "074": [1706, 1770], "074107": [1734, 1781, 1829], "074111": 1781, "074465": 1841, "07455": 1770, "074553080e": 1706, "074617522e": 1706, "0747": 1743, "075": [1757, 1828, 1844], "07500": 1749, "075844098953": 1833, "07606823017188": 1752, "076806": 1841, "077": 1706, "0787495": 1750, "07949567": 1833, "0799": 1841, "079900": [1695, 1700, 1701, 1758], "08": [106, 1781, 1833, 1838, 1841], "0800": 1743, "08095438e": 1706, "081": [1706, 1734], "0812023770e": 1706, "082": 1706, "0823309159": 1802, "08339310458383": 1833, "0836612e": 1706, "084": 1706, "084107": [1692, 1752], "084114": [1734, 1781, 1836], "08555675": 1837, "086": [1706, 1802], "088": 1706, "0880964705": 1743, "0883677": 1770, "0890": 1841, "08900": 1749, "0890958457": 1743, "089590304723": 1833, "0899": 1752, "09": 1743, "090000": [1695, 1696, 1697, 1700, 1702, 1758], "091": 1706, "092486": 1841, "0933": 1743, "094106": [1734, 1781, 1837], "094107": [1230, 1469, 1704, 1734, 1837], "0948": 1841, "0949": 1743, "095": 1770, "096": 1706, "0961": 1743, "097": 1706, "0970": 1837, "09700": 1749, "097806": 1841, "09996723": 1730, "0_0": 1775, "0a": 1817, "0c02405": [295, 318, 319, 1695, 1698, 1702, 1703, 1758, 1766, 1800], "0e": [722, 916, 967, 973, 1030, 1054, 1055, 1072, 1079, 1085, 1086, 1113, 1131, 1135, 1137, 1140, 1207, 1213, 1214, 1218, 1219, 1221, 1224, 1226, 1230, 1231, 1234, 1350, 1351, 1365, 1444, 1455, 1462, 1487, 1488, 1489, 1498, 1506, 1514, 1545, 1567, 1572, 1616, 1617, 1621, 1622, 1627, 1638, 1644, 1648, 1704, 1757, 1771, 1795, 1837, 1838, 1844], "0e9": [374, 395], "0th": [295, 1766, 1796], "0x12d884fc0": [150, 262], "1": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1828, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1839, 1840, 1841, 1842, 1843, 1844], "10": [0, 2, 295, 297, 318, 319, 323, 347, 368, 369, 377, 442, 452, 504, 518, 525, 542, 572, 580, 582, 588, 594, 601, 606, 614, 618, 622, 632, 645, 684, 690, 709, 710, 711, 712, 737, 747, 868, 967, 1131, 1134, 1135, 1199, 1200, 1202, 1203, 1206, 1208, 1210, 1214, 1221, 1230, 1231, 1456, 1477, 1487, 1488, 1506, 1547, 1598, 1616, 1617, 1621, 1622, 1692, 1695, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1706, 1714, 1729, 1730, 1733, 1734, 1738, 1740, 1742, 1743, 1749, 1752, 1753, 1757, 1758, 1759, 1761, 1762, 1764, 1766, 1767, 1768, 1770, 1776, 1781, 1788, 1795, 1800, 1802, 1828, 1837, 1838, 1841, 1842, 1844], "100": [150, 262, 342, 356, 580, 651, 723, 729, 768, 774, 932, 1003, 1080, 1185, 1206, 1207, 1208, 1209, 1213, 1215, 1219, 1222, 1226, 1229, 1231, 1362, 1405, 1416, 1499, 1517, 1577, 1597, 1639, 1704, 1706, 1708, 1734, 1746, 1748, 1754, 1757, 1771, 1788, 1798, 1802, 1808, 1810, 1832, 1836, 1841], "1000": [368, 369, 377, 685, 833, 834, 974, 1031, 1060, 1114, 1206, 1210, 1214, 1218, 1221, 1704, 1821, 1832], "100000": [300, 301, 302, 390, 1232, 1665, 1695, 1697, 1700, 1702, 1704, 1706, 1758, 1772, 1843], "100000000": [651, 1206, 1704, 1743], "1000000000": [374, 395], "100000000000": [374, 395], "100000000kb": [374, 395], "10007984692388": 1836, "1000798469238902": 1836, "1001941536e": 1706, "1002": [377, 1734, 1781], "100644": 1786, "1007": [295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1738, 1740, 1758, 1766, 1781, 1800], "1009": 1738, "100gb": 1767, "101": [1706, 1708, 1734, 1757], "101325": [390, 1232, 1665, 1704, 1706, 1843], "10146": [1692, 1752], "1015": 1743, "1016": [297, 347, 1714, 1734, 1740, 1781, 1842], "102": [323, 1708, 1734, 1832], "1021": [295, 318, 319, 1692, 1695, 1697, 1698, 1700, 1701, 1702, 1703, 1714, 1734, 1752, 1758, 1766, 1776, 1781, 1800, 1842], "1024": [1821, 1832], "10245974": 1743, "102833": 1802, "103": [1708, 1714, 1734, 1789, 1802, 1832, 1842], "10300098": 1743, "10308910109e": 1706, "1039": [1734, 1781], "104": [2, 443, 479, 519, 543, 1199, 1200, 1202, 1203, 1704, 1708, 1714, 1734, 1743, 1750, 1756, 1757, 1759, 1763, 1771, 1788, 1792, 1802, 1828, 1832, 1838, 1842, 1844], "1040380466": [1754, 1803], "104103": [1734, 1781], "104105": [1734, 1754], "104107": [1734, 1781, 1837], "104116": [1734, 1781], "105": [323, 1706, 1708, 1734, 1743, 1802], "106": [1708, 1832], "106066": [1695, 1697, 1700, 1701, 1758], "10626": 1734, "1063": [295, 318, 319, 1231, 1616, 1617, 1692, 1695, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1714, 1734, 1740, 1752, 1758, 1761, 1762, 1766, 1776, 1781, 1800, 1842], "1069765": 1770, "107": [323, 1708, 1734, 1757, 1802], "10715266": 1833, "1073": [295, 318, 319, 1695, 1698, 1702, 1703, 1758, 1766, 1800], "108": [1708, 1833], "1080": [1734, 1776, 1781], "1083509": 1770, "108401996052": 1833, "1085": [1692, 1752], "109": [356, 1692, 1708, 1734, 1752, 1802, 1833], "1092635": 1770, "10938356e": 1706, "10973731": 1706, "10f": [691, 1206, 1704, 1707, 1730, 1731, 1802, 1810], "10mb": 1767, "10x": 1810, "11": [710, 1206, 1231, 1489, 1627, 1692, 1704, 1706, 1708, 1714, 1715, 1734, 1738, 1752, 1757, 1759, 1768, 1770, 1771, 1781, 1788, 1802, 1817, 1821, 1832, 1837, 1838, 1841, 1842], "110": [776, 1209, 1231, 1495, 1704, 1708, 1710, 1734, 1754, 1757, 1802], "11000": 1749, "110000": [1695, 1697, 1700, 1701, 1702, 1758], "1103": [295, 318, 319, 1695, 1697, 1698, 1702, 1703, 1734, 1758, 1766, 1800], "11056e": 1706, "111": [1708, 1734, 1781], "111469": 1837, "111625": 1802, "111984": 1802, "112": [323, 1708, 1714, 1734, 1842], "11216169": 1837, "11227502": 1837, "1124545167": 1706, "1126095262": 1706, "112650056e": 1706, "113": [1692, 1708, 1734, 1752, 1757], "1134289257": 1706, "11362": [1734, 1781], "11373": 1734, "114": [1708, 1734, 1754, 1770], "1140": 1781, "1143863257": 1802, "11449": 1781, "114520": 1837, "11464": 1781, "115": [295, 318, 319, 323, 1695, 1697, 1698, 1702, 1703, 1708, 1740, 1758, 1766, 1800], "1155": 1743, "1155773223": 1802, "1157": 1841, "116": [1708, 1734], "11604": 1706, "116100": [1695, 1697, 1700, 1758], "11659": 354, "11662884": 1740, "117": [323, 1692, 1708, 1734, 1752, 1762], "11719087": 1837, "11789413": 1837, "1179": [1734, 1781], "118": [885, 1210, 1692, 1704, 1708, 1752], "1188": 1734, "11881134": 1740, "1189": 1841, "119": [1708, 1734, 1757, 1802], "11916375": 1740, "1193": [1828, 1844], "119626565582": 1706, "11969410": 1837, "119764": 1802, "11e": 1802, "12": [100, 106, 472, 505, 594, 730, 742, 973, 1030, 1054, 1113, 1137, 1200, 1206, 1208, 1214, 1218, 1221, 1224, 1230, 1231, 1234, 1455, 1514, 1569, 1572, 1573, 1692, 1704, 1706, 1708, 1714, 1734, 1743, 1752, 1753, 1757, 1759, 1767, 1770, 1781, 1802, 1817, 1828, 1833, 1837, 1838, 1841, 1842, 1844], "120": [323, 1708, 1781, 1802, 1833, 1841], "1200": 323, "1202": 1757, "120432": 1802, "12055592": 1837, "121": 1708, "12178201232889": 1833, "122": [323, 1708, 1714, 1842], "1223": [1734, 1841], "1223155812": 1743, "1224836": 1770, "122781": 1802, "123": 1708, "12345": [288, 289, 339, 340], "1235": [1734, 1781, 1837], "124": [1708, 1714, 1842], "124103": 1734, "124104": [1714, 1734, 1781, 1829, 1842], "1241077": 1734, "1244": 1743, "124659": [1828, 1833, 1844], "12492546": 1837, "125": [323, 1708, 1734, 1757], "125000": [1695, 1696, 1697, 1700, 1758], "12581": 1833, "126": 1708, "126185": [1828, 1833, 1844], "127": [1708, 1734, 1740, 1781], "127497720": 1706, "127625308": 1706, "128": [323, 1685, 1708, 1734, 1776, 1781, 1828, 1844], "129": [1708, 1734, 1802], "12900": 1749, "12906": 1706, "12932": 1833, "12e": 1802, "13": [295, 318, 319, 323, 437, 730, 1068, 1199, 1208, 1219, 1224, 1225, 1237, 1247, 1692, 1695, 1698, 1700, 1703, 1704, 1706, 1714, 1752, 1753, 1757, 1758, 1766, 1770, 1771, 1776, 1781, 1800, 1802, 1837, 1841, 1842], "130": [323, 1229, 1427, 1704, 1708, 1730, 1802], "1300": 1743, "130000": [1695, 1696, 1697, 1700, 1758], "1304": [1228, 1387, 1388, 1704], "1307": 1837, "131": [1708, 1734, 1757, 1781], "1313": 1788, "132": [1692, 1708, 1734, 1752, 1781], "1327625515": 1802, "133": [323, 1708, 1734, 1757, 1781, 1828, 1844], "134": [1692, 1708, 1752], "134106": [1692, 1734, 1752, 1837], "134108": [1734, 1838], "135": [323, 1692, 1708, 1734, 1752, 1781], "135060": 1802, "135667662e": 1706, "136": [1734, 1757, 1781], "137": [1706, 1708, 1781], "13702": 1706, "138": [323, 1708, 1734, 1770, 1781], "13802706": 1837, "1387": 1743, "139": [1708, 1734, 1781], "1396": 1837, "13996245042": 1706, "13_seq": 1738, "14": [415, 443, 479, 519, 543, 740, 1198, 1199, 1200, 1202, 1203, 1208, 1225, 1249, 1692, 1704, 1706, 1734, 1743, 1752, 1757, 1759, 1770, 1781, 1802, 1829, 1837, 1841], "140": [323, 1708, 1734, 1770, 1781, 1802, 1838], "1403": 1743, "141": [1230, 1469, 1704, 1708, 1734, 1781, 1837], "1413e": 1706, "14185962536715097": 1752, "14185962536715307": 1752, "142": [1708, 1838], "142206707e": 1706, "143": [323, 1708, 1734, 1781], "1430": 1743, "14344": 1770, "143507": 1802, "144": [323, 1708, 1734, 1781, 1838], "144101": [1734, 1792, 1838], "144104": [1692, 1752], "144105": [1734, 1838], "144108": [1734, 1781], "144112": [1229, 1427, 1704], "145": [1708, 1734, 1838], "1452": [1692, 1734, 1752, 1781], "1454": 1757, "1456": [1734, 1759, 1838], "146": [1231, 1544, 1704, 1708, 1757], "1460": [1692, 1752], "1462": [1734, 1781], "1463": [1734, 1759], "1468": 1734, "147": [1708, 1734, 1770, 1781, 1802], "1470195": [1714, 1842], "1473": 1734, "1475789": 1770, "148": [323, 1708, 1734, 1771], "148460": 1841, "149": [1708, 1734, 1802, 1838], "1495491": 1770, "15": [2, 300, 301, 302, 390, 659, 1206, 1231, 1232, 1545, 1667, 1692, 1704, 1706, 1734, 1738, 1750, 1752, 1754, 1757, 1770, 1771, 1772, 1781, 1788, 1802, 1810, 1828, 1841, 1843, 1844], "150": [323, 689, 1206, 1704, 1708, 1734, 1802, 1836, 1841], "1500": 1838, "150000": [1695, 1697, 1700, 1701, 1702, 1758], "1501": 1781, "151": [1708, 1734], "1514": 1781, "15142168": 1837, "1515314": 1762, "1517084": 1706, "1519120": 1770, "15195886530135": 1833, "152": [1708, 1734, 1752], "152133": 1841, "1524512550e": 1706, "1525": [1734, 1743, 1763], "15267389": 1706, "1529": [1225, 1256, 1704], "153": [323, 1708, 1734], "1534098175176923": 1756, "1535440": 1776, "153725": 1841, "15387002": 1837, "154": [1692, 1708, 1734, 1752], "154104": [1734, 1759], "154105": 1781, "154113": [1734, 1829], "154122": [1734, 1759], "15432897": 1730, "155": [1708, 1752], "15591627": 1730, "156": [323, 1708, 1734], "15647926": 1837, "157": [1708, 1734], "157706": [1695, 1697, 1700, 1701, 1758], "158": [323, 1708, 1734], "159": [1708, 1734], "1593": [1734, 1781, 1838], "159324": 1802, "15e0": [957, 1213, 1225, 1289, 1704], "15g": [691, 1206, 1704, 1810], "16": [2, 368, 377, 1224, 1233, 1692, 1704, 1706, 1708, 1714, 1734, 1742, 1752, 1770, 1771, 1788, 1802, 1810, 1828, 1829, 1834, 1842, 1844], "160": [323, 1708, 1802], "160000": [1695, 1700, 1758], "161": [323, 1708], "1611084524": 1802, "161725": [1734, 1806], "162": [1708, 1802], "1625": 1743, "16281105": 1740, "16297582e": [150, 262], "163": [323, 1708], "1633": 1743, "16382": 1770, "1638694922": 1802, "1639": 1743, "164": 1708, "16400": 1749, "164104": [1734, 1742, 1749, 1754, 1803], "164110": [1734, 1837], "1646305764": 1802, "1646933": 1706, "1648714": 1706, "165": 1708, "1659": 1743, "166": 323, "1663": [1734, 1838], "166478414245": 1771, "16656305": 1837, "166667": [1695, 1700, 1758], "1668": [1734, 1829], "1669340785": 1802, "167": [1770, 1802], "167000": [1695, 1697, 1700, 1701, 1758], "1672": [1734, 1774], "16747e": 1706, "1677": 1837, "1680": 1743, "16885540": 1730, "16937828": 1837, "169500": [1695, 1700, 1758], "1695961": 1730, "16dbd3e": 1788, "17": [106, 1692, 1706, 1734, 1738, 1752, 1757, 1770, 1802, 1837], "170": 1757, "1701843": 1770, "1705670114": [295, 318, 319, 1695, 1698, 1702, 1703, 1758, 1766, 1800], "171": 323, "1712": 1743, "171225850256": 1771, "17293e": 1841, "173": 1734, "1730": 1757, "1733": 1743, "173444111e": 1706, "17386": [1734, 1770], "174017": 1781, "174102": [1734, 1781, 1837], "174103": [1734, 1781], "174107": [1734, 1837], "174122": 1781, "174705953194": 1833, "1752875": 1781, "175973286267": 1771, "176": 323, "176470e": 1706, "1767335622934780": 1836, "1775": [1828, 1844], "1776": [1706, 1828, 1844], "1787": [1734, 1759], "17892163": 1837, "179": 323, "179872325e": 1706, "1799": 1734, "17e": 1802, "18": [1231, 1498, 1692, 1704, 1706, 1714, 1734, 1752, 1770, 1781, 1802, 1837, 1842], "180": [1708, 1838], "180324322304": 1771, "18054663": 1837, "1809087569358e": 1759, "18090932": 1837, "181": [323, 1708], "1814": 1828, "181578117924": 1771, "182": 1708, "1823": [693, 1206, 1704], "1826": 1844, "18300": 1749, "183247172": 1706, "1833": [693, 1206, 1704], "183345142": 1706, "1836": 1706, "1838": 1706, "184": [323, 1706, 1802], "1840917810212307": 1756, "184103": [1734, 1781], "1841068002": 1743, "184108": [1734, 1754, 1837], "184111": [1734, 1781, 1828, 1837, 1844], "185": 1781, "1850101": 1770, "186": 323, "187": 1770, "18710565e": 1706, "187331653300": 1743, "1875": 1706, "18757e": 1838, "18857384937354635": 1752, "1887": [1734, 1781, 1828, 1837, 1844], "1887118848315123": 1752, "189": [323, 1770], "18902e": 1838, "18e": 1802, "19": [1692, 1706, 1714, 1752, 1757, 1770, 1837, 1842], "190": 1708, "190000": [1695, 1697, 1700, 1701, 1758], "1904642137": 1802, "19059785": 1837, "1907": 1743, "191": [323, 1708, 1770, 1782], "1910": 1734, "191042953e": 1706, "1918": 1734, "192": [323, 1708], "1923374156": 1802, "192416": [1695, 1700, 1758], "19285e": 1838, "193": 1708, "1930": [1734, 1763, 1781], "19319632": 1837, "194": [323, 1708, 1757], "194102": [1692, 1752], "1942": 1841, "194300": [1695, 1700, 1758], "195": 1708, "1950": [1734, 1836], "195728": [1695, 1697, 1700, 1701, 1758], "196": 1708, "1964": [1734, 1754, 1757], "1965": [1734, 1757], "197": [1706, 1708], "1978": [1734, 1838], "198": 1708, "1980": [1734, 1755, 1757, 1789], "19803293": 1837, "1981": [1734, 1829], "1982": [0, 1734, 1742, 1757, 1771, 1781], "19825": 1770, "1984": [1734, 1802, 1836], "19846883": 1837, "1985": [1692, 1752], "1986": [1734, 1763], "1987": [1225, 1271, 1704, 1734, 1771, 1802], "1988": [1734, 1755, 1757], "1989": [297, 347, 1734, 1742, 1757, 1771, 1838], "199": 323, "1990": [811, 1210, 1704, 1734, 1755, 1757, 1789], "19902978067739": 1752, "19905879745446": 1752, "1991": [1734, 1771], "19917038": 1837, "1992": [1734, 1754, 1802], "1992967152": 1802, "1993": [443, 479, 519, 543, 1199, 1200, 1202, 1203, 1692, 1704, 1734, 1752, 1754], "199352": [1695, 1700, 1758], "1994": [1734, 1781, 1802, 1828, 1837, 1844], "1995": [1734, 1805, 1810], "1996": [443, 479, 519, 543, 1199, 1200, 1202, 1203, 1692, 1704, 1714, 1734, 1752, 1802, 1842], "199699": 1802, "1997": [1734, 1789, 1798], "1998": [356, 1714, 1734, 1740, 1754, 1798, 1802, 1803, 1838, 1841, 1842], "1999": [1734, 1740, 1755, 1781, 1798], "19e": 1802, "1_": [1775, 1794], "1_0": 1775, "1a": [295, 318, 319, 1683, 1695, 1698, 1700, 1703, 1758, 1766, 1776, 1792, 1793, 1800, 1838], "1a1": [1714, 1786, 1838, 1842], "1a2": 1786, "1a2dev42": 1828, "1a_1": [1714, 1842], "1b": [295, 318, 319, 1683, 1695, 1698, 1700, 1703, 1758, 1766, 1776, 1792, 1793, 1800], "1b1": 1838, "1b2": [1714, 1838, 1842], "1c": [295, 318, 319, 1695, 1698, 1700, 1703, 1758, 1766, 1775, 1800], "1c00280": 1734, "1cp": 1794, "1e": [0, 1, 2, 100, 106, 115, 287, 335, 338, 408, 415, 432, 439, 455, 472, 473, 491, 496, 499, 500, 529, 552, 677, 736, 737, 739, 740, 747, 754, 777, 818, 850, 854, 856, 857, 876, 924, 930, 949, 953, 958, 971, 972, 976, 977, 978, 979, 980, 981, 983, 984, 985, 1001, 1029, 1174, 1178, 1197, 1198, 1199, 1200, 1202, 1203, 1206, 1208, 1209, 1210, 1213, 1214, 1215, 1218, 1222, 1224, 1225, 1226, 1228, 1229, 1230, 1231, 1233, 1257, 1266, 1285, 1287, 1290, 1301, 1328, 1389, 1410, 1424, 1438, 1440, 1442, 1486, 1497, 1552, 1569, 1571, 1573, 1600, 1602, 1603, 1604, 1605, 1654, 1704, 1714, 1742, 1746, 1749, 1754, 1755, 1757, 1771, 1776, 1789, 1798, 1828, 1837, 1838, 1841, 1842], "1e5": [374, 395], "1e8": [1226, 1366, 1704], "1f": [1743, 1802, 1828, 1844], "1g": 1833, "1nocp": 1794, "1p": [295, 318, 319, 1695, 1698, 1700, 1703, 1758, 1766, 1800], "1rc1": [1786, 1788], "1rc2": 1786, "1rdm": [314, 1776, 1791], "1st": [106, 295, 1706, 1766, 1794, 1796], "1tb": 1767, "1u": 1833, "1vmfc": 1794, "1x1": [615, 1206, 1704], "2": [0, 1, 2, 8, 9, 11, 76, 79, 82, 84, 90, 100, 103, 106, 119, 133, 134, 135, 148, 155, 225, 265, 268, 278, 282, 284, 285, 287, 288, 289, 291, 295, 296, 297, 300, 301, 302, 307, 318, 319, 322, 323, 331, 332, 336, 338, 339, 340, 341, 342, 346, 347, 356, 368, 369, 374, 376, 377, 386, 389, 395, 397, 407, 412, 433, 466, 476, 507, 514, 537, 558, 568, 569, 574, 575, 584, 586, 590, 592, 593, 599, 601, 603, 608, 609, 615, 618, 635, 637, 640, 641, 652, 655, 656, 660, 662, 666, 669, 671, 673, 676, 677, 696, 700, 701, 707, 708, 722, 728, 787, 791, 813, 815, 820, 837, 862, 884, 903, 904, 912, 917, 938, 978, 980, 982, 993, 997, 1001, 1004, 1033, 1042, 1097, 1116, 1122, 1125, 1126, 1147, 1182, 1191, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1206, 1207, 1208, 1210, 1212, 1213, 1214, 1215, 1218, 1220, 1221, 1222, 1224, 1225, 1226, 1228, 1229, 1230, 1231, 1235, 1238, 1241, 1242, 1251, 1274, 1299, 1348, 1382, 1387, 1388, 1409, 1453, 1548, 1555, 1556, 1571, 1638, 1648, 1658, 1679, 1680, 1689, 1692, 1694, 1695, 1696, 1697, 1698, 1700, 1703, 1704, 1706, 1707, 1708, 1711, 1714, 1722, 1730, 1731, 1732, 1733, 1734, 1735, 1738, 1739, 1740, 1741, 1742, 1743, 1746, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1762, 1763, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1774, 1775, 1776, 1781, 1782, 1785, 1787, 1789, 1790, 1792, 1794, 1795, 1796, 1797, 1798, 1800, 1802, 1806, 1807, 1808, 1810, 1814, 1821, 1828, 1829, 1832, 1833, 1836, 1837, 1838, 1840, 1841, 1842, 1844], "20": [1, 100, 148, 331, 335, 404, 449, 607, 729, 751, 757, 760, 869, 894, 1029, 1066, 1081, 1196, 1197, 1199, 1206, 1208, 1209, 1210, 1211, 1218, 1219, 1223, 1226, 1229, 1230, 1231, 1347, 1405, 1442, 1444, 1454, 1499, 1660, 1692, 1704, 1706, 1738, 1750, 1752, 1754, 1759, 1767, 1768, 1770, 1771, 1781, 1797, 1802, 1837], "200": [323, 755, 1208, 1231, 1574, 1704, 1743, 1750, 1837], "2000": [374, 395, 693, 1206, 1704, 1714, 1734, 1755, 1781, 1798, 1832, 1837, 1841, 1842], "200000": [1695, 1697, 1700, 1701, 1758], "2000000": 1832, "20000000": 1743, "2000000000": 1832, "2000000000000000": 1756, "2000000000000000000": [374, 395], "2001": [1734, 1805], "2002": [0, 1692, 1734, 1752, 1759, 1762, 1802, 1838], "2003": [885, 1210, 1692, 1704, 1752], "200389": 1802, "2004": [1734, 1759, 1781], "2004088624": [374, 395], "2005": [1692, 1714, 1734, 1750, 1752, 1754, 1803, 1842], "2006": [0, 1692, 1714, 1734, 1740, 1752, 1759, 1781, 1798, 1829, 1837, 1842], "2007": [1692, 1752, 1781, 1788], "2008": [1734, 1754, 1771, 1781, 1792, 1829], "2009": [1229, 1427, 1692, 1704, 1714, 1734, 1742, 1749, 1752, 1754, 1759, 1781, 1798, 1803, 1829, 1837, 1838, 1842], "201": [323, 1734, 1837], "2010": [1692, 1714, 1734, 1749, 1752, 1759, 1781, 1828, 1829, 1837, 1842, 1844], "2011": [1692, 1730, 1733, 1734, 1752, 1759, 1781, 1798, 1828, 1837, 1838, 1844], "2011752233617829": 1756, "2012": [94, 1135, 1221, 1692, 1704, 1734, 1752, 1781, 1798, 1804, 1828, 1837, 1844], "2013": [1692, 1734, 1738, 1752, 1754, 1771, 1774, 1781, 1798, 1803, 1837], "2014": [0, 106, 1230, 1469, 1704, 1714, 1734, 1743, 1754, 1770, 1781, 1792, 1798, 1832, 1837, 1842], "201498": 1832, "2015": [1714, 1715, 1734, 1750, 1763, 1770, 1774, 1781, 1836, 1842], "20150623": 1738, "2016": [1734, 1738, 1746, 1754, 1759, 1781, 1798, 1799, 1802, 1828, 1837], "2017": [1734, 1748, 1757, 1781, 1782, 1786, 1788, 1798, 1806, 1838], "2018": [1692, 1734, 1740, 1752, 1757, 1770, 1774, 1781, 1788, 1798, 1824, 1837, 1839], "201891": 1832, "2019": [1734, 1738, 1754, 1759, 1781, 1798, 1805, 1838], "2020": [1095, 1219, 1704, 1730, 1734, 1738, 1771, 1781, 1783, 1798, 1837, 1838], "2021": [1692, 1734, 1752, 1774, 1798, 1837], "2022": [2, 267, 1230, 1469, 1470, 1704, 1734, 1738, 1740, 1759, 1770, 1792, 1798, 1837, 1838], "2023": [1734, 1754, 1770, 1774, 1788, 1838], "2030": 1757, "203789458": 1706, "20393": 1781, "204": 323, "2041": 1781, "204105": 1781, "204110": 1781, "204111": [1734, 1757], "204114": 1734, "20411857": 1837, "2046601445393486": 1756, "204676": 1832, "2048": [620, 1206, 1231, 1625, 1704], "204890356651": 1743, "205": [1734, 1750], "205087": 1832, "206": 1706, "206361329e": 1706, "206824": 1802, "2074914566": 1802, "207655674855": 1833, "208": [323, 1770], "209": [323, 1734, 1763], "20e": [1743, 1802], "20e5c7": 1788, "21": [1692, 1706, 1752, 1757, 1770, 1821, 1828, 1837, 1838, 1844], "210000": [1695, 1697, 1700, 1758], "210219057e": 1706, "21028": 1841, "2106866": 1706, "2110247636": 1802, "2111": 1734, "21138602": 1706, "212": 323, "2120": 1767, "2120mb": 1767, "212218": 1841, "212288": 1802, "2126": [1714, 1715, 1842], "2126975": [295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "2129": [1714, 1842], "213": 1782, "2134345": 1770, "2136": [1714, 1715, 1842], "214": 323, "2140": [1714, 1842], "214108": [1734, 1802], "214210": 1841, "2143": 1706, "215671574613": 1833, "216": [1734, 1755, 1770], "217": [323, 1734, 1771], "2170": 1743, "217006": 1832, "217439": 1832, "218000": [1695, 1697, 1700, 1758], "21822294": 1837, "21825": 1841, "2185": 1734, "2187691": 1706, "218981": 1833, "21902130": 1837, "219474": 1706, "21947463": 1706, "2197": [1734, 1759], "219847": [1695, 1700, 1758], "21e": 1802, "21g": [1231, 1485, 1694, 1704, 1707, 1730, 1731, 1732, 1733, 1740, 1838], "22": [669, 1206, 1692, 1704, 1706, 1752, 1770, 1788, 1837], "220": [1706, 1708], "220000": [1695, 1696, 1697, 1700, 1702, 1758], "2203": 1734, "220910e": 1706, "221": [1708, 1802], "221189": 1832, "221605": 1832, "221781602033": 1833, "222": [1708, 1770], "222036": [1695, 1697, 1700, 1701, 1758], "222105": 1802, "2223": 1706, "2225726872441811": 1756, "223": [1708, 1788], "223147494072": 1771, "22321549": 1837, "2235996493": 1802, "224": [323, 1708], "224103": [1734, 1781], "2248": 1743, "224946": 1832, "224987": 1832, "225": 1708, "225254251294": 1771, "226": 1708, "2260576084217405": 1756, "226173": 1802, "227": [323, 1708, 1770], "227361008515": 1771, "2275971": 1706, "2278": [1734, 1805], "228": 1708, "22812415": 1837, "228668": 1832, "228727": 1832, "229": [1708, 1770], "2290": 1734, "229015": [1695, 1700, 1758], "2297110": 1770, "22e": 1743, "23": [323, 669, 1206, 1692, 1704, 1706, 1730, 1734, 1750, 1752, 1757, 1770], "230": [323, 1708, 1734, 1757], "230995119324": 1771, "231431666069": 1771, "232055": [1695, 1700, 1758], "232253": [1828, 1833, 1844], "234103": 1734, "234104": [1734, 1838], "234107": [1734, 1837], "234567": 1733, "235": 323, "235051": 1706, "235380085e": 1706, "2354": 1757, "2365": [1692, 1752], "2370496": 1770, "2371": 1781, "237978": [1695, 1700, 1758], "23872336e": 1706, "2390": 1743, "239431": 1841, "2395": 1734, "24": [669, 805, 1206, 1210, 1225, 1256, 1692, 1704, 1706, 1734, 1752, 1755, 1770], "240": [323, 1833], "240759": 1802, "241": 1833, "241102": [1734, 1838], "241304": 1802, "241509126e": 1706, "2417367": 1770, "242": 323, "2427": [1692, 1752], "24289005": 1837, "2429731e": 1706, "243": [323, 1740, 1833], "24325177": 1837, "243777": 1802, "244": 1833, "244115": 1734, "245": 323, "246": 1734, "246150": 1802, "24700": 1749, "247849447550": 1833, "248": [323, 1738], "249": 1770, "2491": 1841, "249258": 1841, "24938": 1841, "25": [323, 644, 669, 704, 923, 969, 1206, 1213, 1214, 1225, 1231, 1256, 1494, 1692, 1704, 1706, 1714, 1734, 1743, 1752, 1757, 1768, 1770, 1776, 1842], "250": [323, 1708, 1750, 1832], "250000": [1695, 1697, 1700, 1701, 1702, 1758], "251": 1708, "2510842e": 1706, "25122": 1734, "252": [1708, 1740], "25200": 1749, "25216749": 1837, "252325": 1833, "2523427206e": 1706, "252468": 1833, "253": 1708, "253224": 1802, "254": 1708, "255": [323, 1708], "255250616": 1706, "25554938": 1837, "256": [1231, 1515, 1704, 1708], "257": [1708, 1828, 1844], "2570": [1734, 1781, 1837], "258": 1708, "25812": 1706, "258686": 1802, "258836941658": 1771, "259": 1708, "2594122526144091": 1752, "25945": [1734, 1838], "259958": 1802, "26": [669, 1206, 1704, 1706, 1734, 1757, 1770], "260": 1708, "26092": 1841, "260943698880": 1771, "261": [1708, 1759], "26106": 1770, "2614": [1734, 1740], "262": 1708, "2625": 1706, "26277": 1706, "2629759351596186": 1752, "263": 1708, "263050456101": 1771, "263201": [1714, 1734, 1759, 1842], "264": 1708, "264065": 1802, "2642563": 1770, "265": [1708, 1734, 1802], "265122720724": 1829, "26529903": 1837, "26535": 1770, "26535160": 1837, "26543510": 1837, "2657": 1743, "266": [1708, 1757, 1770], "26601138679877": 1833, "266684566910": 1771, "266705": 1833, "266920": 1802, "267": 1708, "267121113654": 1771, "267515317": 1706, "267522190": 1706, "2687": [1734, 1771, 1781], "269": [1734, 1781], "269000": [1695, 1696, 1697, 1700, 1702, 1758], "269288": [1695, 1700, 1758], "26945": 1841, "2696": [1734, 1781], "26970292": 1837, "26e": 1743, "27": [436, 1067, 1199, 1219, 1225, 1245, 1704, 1706, 1734, 1757, 1771, 1776, 1781], "270": [1708, 1844], "270000": [1695, 1696, 1697, 1700, 1702, 1758], "270191667755": 1743, "2702": 1757, "271": 1708, "27158877": 1837, "272": [1708, 1781], "2720813": 1706, "273": [300, 301, 302, 390, 1232, 1667, 1704, 1706, 1708, 1772, 1843], "27338e": 1838, "273516": 1802, "273896": 1738, "27392413": 1837, "274": [1708, 1734], "274009994e": 1706, "2743014": 1781, "2747241": 1740, "274985": 1802, "275": [1708, 1782, 1802], "27504": 1841, "275705492359": 1743, "276": 1708, "277": 1708, "278": 1708, "279": 1708, "2790": 1743, "28": [1706, 1776, 1786, 1833], "280": [1708, 1734], "2800": 1837, "280000": [1695, 1697, 1700, 1702, 1758], "28024": 1706, "2808": 1706, "281": 1708, "28140": 1770, "281508": 1802, "28197234": 1706, "282": 1708, "28232": 1770, "283": 1708, "2834927": 1781, "284": [1708, 1838], "2842": [1734, 1837], "2844102558783027": 1752, "28451": 1770, "28455969": 1837, "284764620e": 1706, "285": 1708, "2851": 1734, "28558683837122": 1833, "286": [1708, 1740], "286062": 1833, "28660857": 1837, "286988509018": 1833, "287": [323, 1708, 1838], "28722": 1841, "288": 1708, "28808866712e": 1706, "289": [1708, 1833], "289841960355e": 1706, "28th": 1837, "29": [1706, 1734, 1757, 1837], "290": 1708, "290000": [1695, 1700, 1702, 1758], "291": 1708, "291772106700e": 1706, "2917721067e": 1706, "292": 1708, "29200": 1749, "293": [1708, 1734, 1771, 1781], "29333205": 1706, "293712317e": 1706, "294": 1740, "29412053242164": 1752, "29432": 1770, "29448051": 1837, "295": 1770, "29709": 1770, "298": [390, 1232, 1667, 1704, 1714, 1754, 1842, 1843], "299": [1734, 1781], "29927518": 1837, "29954136": 1706, "299792458": 1706, "2999": [1734, 1754, 1803], "2_": [1775, 1794], "2_0": 1775, "2a": [295, 318, 319, 1692, 1695, 1698, 1700, 1703, 1752, 1758, 1766, 1800], "2a1": [1748, 1838], "2a_1": [660, 1206, 1704, 1833], "2b": [295, 318, 319, 1695, 1698, 1700, 1703, 1758, 1766, 1800], "2b1": [1714, 1842], "2b2": [1714, 1842], "2b_1": 1833, "2b_2": 1833, "2c": [295, 318, 319, 1695, 1698, 1700, 1703, 1758, 1766, 1775, 1800, 1836], "2c06465": 1734, "2ce1c29": 1788, "2cp": 1794, "2d": [150, 255, 262, 263, 1694, 1732, 1733], "2df": [1694, 1732, 1733], "2e": [1226, 1349, 1364, 1704, 1776], "2g": 1833, "2h": [698, 1206, 1704, 1757, 1833, 1838], "2l": 1810, "2m": 106, "2n": [82, 862, 1210, 1704, 1755], "2n_": 1837, "2nd": [295, 318, 319, 381, 382, 1695, 1696, 1698, 1700, 1706, 1743, 1744, 1745, 1746, 1758, 1762, 1766, 1777, 1786, 1790, 1794, 1796, 1800, 1806, 1826, 1844], "2nm": [811, 1210, 1704, 1755], "2nocp": 1794, "2nx2n": 356, "2order": 1717, "2ovn_aux": 1837, "2p": [1694, 1732, 1733], "2pd": [1694, 1732, 1733], "2pi": 139, "2q": 1756, "2qov": 1756, "2rc1": 1748, "2sf": 1805, "2t_": 1763, "2t_2": 1771, "2u": 1833, "2v": [1730, 1771, 1833, 1837, 1838], "2vmfc": 1794, "2x": [295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1758, 1766, 1800, 1810], "2x2": [811, 855, 1210, 1704, 1755, 1789], "2zapa": [1694, 1707, 1731, 1732], "3": [0, 63, 75, 89, 100, 103, 106, 139, 148, 150, 156, 267, 278, 284, 288, 289, 295, 300, 301, 302, 310, 318, 319, 331, 339, 340, 346, 361, 368, 369, 377, 381, 382, 386, 387, 388, 389, 390, 399, 496, 574, 584, 586, 601, 608, 609, 613, 616, 635, 637, 652, 655, 660, 662, 671, 676, 696, 735, 736, 739, 756, 840, 841, 848, 896, 937, 954, 979, 983, 993, 1028, 1096, 1106, 1125, 1154, 1156, 1200, 1206, 1208, 1210, 1211, 1213, 1214, 1215, 1217, 1219, 1221, 1224, 1225, 1226, 1230, 1231, 1235, 1239, 1246, 1273, 1303, 1304, 1326, 1349, 1351, 1352, 1364, 1365, 1447, 1449, 1451, 1476, 1479, 1485, 1516, 1644, 1658, 1662, 1680, 1683, 1689, 1692, 1694, 1695, 1698, 1700, 1703, 1704, 1706, 1707, 1708, 1711, 1714, 1717, 1726, 1730, 1731, 1732, 1733, 1734, 1735, 1738, 1739, 1740, 1742, 1743, 1746, 1748, 1749, 1750, 1752, 1753, 1756, 1757, 1758, 1759, 1764, 1766, 1767, 1770, 1771, 1772, 1774, 1776, 1781, 1782, 1787, 1789, 1792, 1793, 1794, 1797, 1798, 1799, 1800, 1802, 1803, 1805, 1808, 1810, 1814, 1817, 1821, 1826, 1828, 1829, 1832, 1833, 1837, 1838, 1841, 1842, 1844], "30": [2, 313, 364, 374, 395, 853, 1135, 1210, 1221, 1225, 1263, 1286, 1704, 1706, 1750, 1767, 1768, 1789, 1828, 1837], "300": [2, 634, 649, 1206, 1704, 1708, 1743], "3000": 1837, "300000": [1695, 1697, 1700, 1701, 1702, 1758], "30000000000l": [374, 395], "30078276": 1822, "301525": 1802, "30193450": 1837, "302": [770, 1144, 1209, 1221, 1231, 1536, 1635, 1704, 1740, 1754, 1757, 1838], "30239689": 1837, "30277": 1770, "3031992532": 1802, "304": [1734, 1781], "304098": 1833, "30557377e": 1706, "3070122077": 1706, "3074": 1757, "309": [1734, 1754, 1803], "30900": 1749, "30957": 1841, "30e": 1802, "31": [323, 1694, 1706, 1730, 1732, 1733, 1757, 1802, 1810], "310": [1748, 1788], "310000": [1695, 1696, 1697, 1700, 1702, 1758], "31030140": 1837, "311": [1694, 1732, 1733, 1788], "311g": [1694, 1707, 1731, 1732, 1733], "311g_2d_": [1694, 1707, 1731, 1732], "311g_2d_2p_": [1694, 1707, 1731, 1732], "311g_2d_p_": [1694, 1707, 1731, 1732], "311g_2df_": [1694, 1707, 1731, 1732], "311g_2df_2p_": [1694, 1707, 1731, 1732], "311g_2df_2pd_": [1694, 1707, 1731, 1732], "311g_2df_p_": [1694, 1707, 1731, 1732], "311g_3df_": [1694, 1707, 1731, 1732], "311g_3df_2p_": [1694, 1707, 1731, 1732], "311g_3df_2pd_": [1694, 1707, 1731, 1732], "311g_3df_3pd_": [1694, 1707, 1731, 1732], "311g_3df_p_": [1694, 1707, 1731, 1732], "311g_d_": [1694, 1707, 1731, 1732], "311g_d_p_": [1694, 1707, 1731, 1732], "311gss": [1707, 1731], "311pg": [1694, 1707, 1731, 1732], "311pg_2d_": [1694, 1707, 1731, 1732], "311pg_2d_2p_": [1694, 1707, 1731, 1732], "311pg_2d_p_": [1694, 1707, 1731, 1732], "311pg_2df_": [1694, 1707, 1731, 1732], "311pg_2df_2p_": [1694, 1707, 1731, 1732], "311pg_2df_2pd_": [1694, 1707, 1731, 1732], "311pg_2df_p_": [1694, 1707, 1731, 1732], "311pg_3df_": [1694, 1707, 1731, 1732], "311pg_3df_2p_": [1694, 1707, 1731, 1732], "311pg_3df_2pd_": [1694, 1707, 1731, 1732], "311pg_3df_3pd_": [1694, 1707, 1731, 1732], "311pg_3df_p_": [1694, 1707, 1731, 1732], "311pg_d_": [1694, 1707, 1731, 1732], "311pg_d_p_": [1694, 1707, 1731, 1732], "311pgss": [1707, 1731], "311ppg": [1694, 1707, 1731, 1732], "311ppg_2d_": [1694, 1707, 1731, 1732], "311ppg_2d_2p_": [1694, 1707, 1731, 1732], "311ppg_2d_p_": [1694, 1707, 1731, 1732], "311ppg_2df_": [1694, 1707, 1731, 1732], "311ppg_2df_2p_": [1694, 1707, 1731, 1732], "311ppg_2df_2pd_": [1694, 1707, 1731, 1732], "311ppg_2df_p_": [1694, 1707, 1731, 1732], "311ppg_3df_": [1694, 1707, 1731, 1732], "311ppg_3df_2p_": [1694, 1707, 1731, 1732], "311ppg_3df_2pd_": [1694, 1707, 1731, 1732], "311ppg_3df_3pd_": [1694, 1707, 1731, 1732], "311ppg_3df_p_": [1694, 1707, 1731, 1732], "311ppg_d_": [1694, 1707, 1731, 1732], "311ppg_d_p_": [1694, 1707, 1731, 1732], "311ppgss": [1707, 1731], "3128110": 1770, "3141": 1743, "3144598": 1706, "314577": 1802, "3150": 1743, "31533": 1770, "31534": 1841, "315775": 1706, "315852": 1841, "3159": 1837, "3185": 1781, "31959090481e": 1706, "3197": 1781, "31e": 1743, "31g": [265, 284, 1694, 1707, 1711, 1714, 1731, 1732, 1733, 1740, 1743, 1752, 1757, 1782, 1789, 1794, 1828, 1842, 1844], "31g_d_": [1694, 1707, 1731, 1732], "31g_d_p_": [1694, 1707, 1731, 1732], "31gss": [1707, 1731], "31pg": [1694, 1707, 1731, 1732], "31pg_d_": [1694, 1707, 1731, 1732], "31pg_d_p_": [1694, 1707, 1731, 1732], "31pgss": [1707, 1731], "31pm": 1786, "31ppg": [1694, 1707, 1731, 1732], "31ppg_d_": [1694, 1707, 1731, 1732], "31ppg_d_p_": [1694, 1707, 1731, 1732], "31ppgss": [1707, 1730, 1731], "32": [288, 289, 295, 339, 340, 354, 575, 651, 1206, 1685, 1704, 1706, 1734, 1766, 1776, 1799], "321": 1734, "32140985396e": 1706, "322226": 1802, "325": 1706, "32500": 1749, "3251": 1706, "325106": 1841, "3259": 1734, "326": [1734, 1781], "3269788": 1706, "3271056135": 1802, "3276": 1781, "329": 1734, "3292990446": 1802, "3295094": 1770, "33": [150, 262, 323, 1706, 1708, 1781], "330": 1740, "330000": [1695, 1697, 1700, 1701, 1758], "33048": 1770, "3304922": [1714, 1842], "3305335": 1781, "330735040e": 1706, "33100": 1749, "33102504900e": 1706, "3315674": 1770, "33199": 1841, "332242848098": 1743, "33224285": 1743, "332260965382": 1743, "33226097": 1743, "33226140": 1743, "332261404452": 1743, "332261408714": 1743, "33226141": 1743, "33289": 1706, "332940127935": 1743, "333": [1734, 1740, 1802], "333333": [1695, 1700, 1701, 1758], "3333333333333333": 1756, "33405042": 1837, "335640951e": 1706, "336952636980364": 1752, "336952636980506": 1752, "336987": 1802, "3383498": 1770, "33843": 1770, "338453952539": 1743, "33865984413460": 1833, "33916119": 1837, "33981720": 1837, "34": [1706, 1708, 1734, 1781, 1788, 1837], "3407": 1743, "34127251": 1837, "34146e": 1841, "342": 323, "34231776": 1706, "3426316": 1781, "343": [1734, 1782], "343127": 1802, "343583719e": 1706, "34395089": 1837, "34500": 1749, "3451077": 1781, "3451968428": 1833, "345717550569": 1743, "34656": 1841, "3470": 1757, "3477": 1706, "3479400": 1781, "348": 1770, "3487495": 1770, "349": 1706, "349093": 1802, "35": [282, 323, 332, 775, 1209, 1231, 1493, 1704, 1706, 1708, 1754, 1757, 1837], "350": [804, 1210, 1704, 1708, 1734, 1757], "3503657": 1781, "3504": [1734, 1824], "350625": 1837, "3509": 1743, "351": [1708, 1734], "3511": 1734, "351261319421": 1833, "35157390": 1837, "352": 1708, "353": 1708, "3531168": 1770, "354": [804, 1210, 1704], "3540": 1743, "355": [1714, 1842], "355311": 1802, "356": [1734, 1770], "356023604706": 1838, "356392512e": 1706, "357": [1734, 1763], "35760": 1841, "35909265": 1837, "359744650": 1706, "359744650e": 1706, "35e": 1802, "36": [323, 1706, 1708, 1734, 1757], "360": [1231, 1590, 1659, 1704, 1734], "360000": [1695, 1696, 1697, 1700, 1758], "36130548": 1837, "362": 1770, "36243": 1770, "3624397": 1781, "3629": [1734, 1805], "3631129": 1781, "364": [323, 1770], "36406353": 1743, "36407122": 1743, "36408021": 1743, "36408563": 1743, "36409177": 1743, "36409932": 1743, "36410422": 1743, "36411044": 1743, "36411859": 1743, "36412938": 1743, "36414365": 1743, "36416227": 1743, "36418623": 1743, "36421659": 1743, "36425461": 1743, "36430165": 1743, "36435916": 1743, "36442840": 1743, "3656681": 1781, "365860": 1802, "365913941094": 1833, "3665134": 1781, "3670": 1706, "368443": 1802, "3686": [1734, 1838], "36962": 1770, "37": 1708, "370000": [1695, 1696, 1697, 1700, 1758], "37040396": 1837, "371180": 1833, "3720": 1743, "3721": [1734, 1749], "37212939": 1837, "372497201e": 1706, "3727": 1706, "3734": 1734, "37373581838636": 1752, "373741": 1837, "3743208": 1770, "375000": [1695, 1696, 1697, 1700, 1702, 1758], "37522": 1841, "37542977": 1837, "376": 1706, "376787": 1802, "3768100495": 1802, "377": 1734, "379": 1802, "37905": 1770, "379378": 1706, "3794": 1844, "3795": 1828, "3797598812113561": 1752, "37e": 1802, "38": [323, 1708, 1757, 1788, 1802, 1828, 1833, 1844], "3803890": 1730, "38060": 1770, "38064852e": 1706, "381": [651, 1206, 1704, 1802], "38332109": 1837, "38368112": 1837, "38426": 1841, "385": 1781, "386": 1802, "38659740": 1837, "3866": [1734, 1759], "387673": 1802, "388": 1717, "388142": 1841, "3885044": 1770, "3890": 1757, "38900": 1749, "38e": 1802, "39": [1706, 1708, 1734, 1748, 1788, 1802], "391": 1738, "39116e": 1706, "391586": 1706, "39195739": 1730, "392": 1770, "39246770": 1837, "393": 1734, "39320925": 1837, "395442": 1802, "3960": 1743, "39600": 1749, "396608": 1802, "397": 323, "397780": 1802, "398": 1734, "39822383": 1837, "39876776": 1833, "39951283": 1730, "39987": 1770, "39e": 1743, "3a1": 1838, "3b1": [1714, 1842], "3c": [106, 267, 295, 318, 319, 1695, 1698, 1699, 1700, 1701, 1703, 1718, 1757, 1758, 1766, 1774, 1781, 1800], "3d": 106, "3d4s4p4d4f": [1714, 1842], "3df": [1694, 1732, 1733], "3dmp2": [295, 1689, 1766, 1776, 1837], "3e": [982, 1214, 1704], "3f": [1743, 1821], "3g": [284, 386, 1694, 1707, 1710, 1713, 1714, 1724, 1729, 1730, 1731, 1732, 1733, 1740, 1749, 1752, 1754, 1757, 1803, 1832, 1833, 1838, 1842], "3o": 1837, "3pd": [1694, 1732, 1733], "3rc1": [1787, 1814], "3rc2": 1788, "3rc3": 1788, "3rd": [295, 318, 319, 1225, 1256, 1704, 1743, 1744, 1745, 1766, 1794, 1800], "3s3p": [1714, 1842], "3u": 1833, "3v": 1771, "3zapa": [1694, 1707, 1731, 1732], "4": [84, 96, 100, 103, 143, 144, 148, 150, 192, 193, 203, 204, 206, 253, 264, 284, 288, 289, 295, 300, 301, 302, 310, 318, 319, 331, 339, 340, 346, 361, 368, 369, 377, 389, 578, 591, 601, 607, 613, 616, 618, 628, 641, 652, 665, 671, 676, 696, 754, 856, 857, 876, 888, 916, 930, 955, 958, 993, 1032, 1056, 1072, 1096, 1101, 1115, 1139, 1147, 1206, 1208, 1210, 1213, 1215, 1218, 1219, 1220, 1221, 1224, 1225, 1226, 1229, 1230, 1231, 1235, 1241, 1245, 1246, 1247, 1253, 1254, 1255, 1265, 1266, 1272, 1273, 1274, 1275, 1290, 1326, 1333, 1351, 1365, 1421, 1422, 1458, 1459, 1461, 1486, 1616, 1654, 1692, 1704, 1711, 1714, 1725, 1729, 1734, 1740, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1760, 1761, 1763, 1766, 1767, 1770, 1771, 1772, 1775, 1776, 1782, 1783, 1792, 1794, 1798, 1800, 1828, 1829, 1837, 1841, 1842], "40": [323, 741, 1208, 1231, 1523, 1704, 1706, 1708, 1743, 1750, 1752, 1802, 1841], "400": [1708, 1734, 1770, 1837], "4000": 1837, "400000": [1695, 1696, 1697, 1700, 1701, 1758], "4005": 1706, "4009": 1734, "400kb": 1788, "401": 1708, "40100": 1749, "401500": [1695, 1697, 1700, 1758], "40217026": 1837, "4037278": 1706, "40386": 1841, "404": 1802, "40502969": 1837, "4057590": 1770, "40794598": 1837, "408": 323, "4080144050": 1743, "40807e": 1841, "4091028": 1770, "40958884746667": 1752, "41": [323, 1706, 1708, 1757], "41037138e": [150, 262], "410570547e": 1706, "4106067873e": 1706, "41065224": 1837, "4113": [1828, 1844], "41169e": 1838, "41246": 1770, "414": 1746, "41407": 1841, "414895": 1841, "416": 1828, "416808e": 1706, "417": [1786, 1794, 1838, 1844], "4170": 1743, "4171": 1734, "41768202": 1837, "417989262e": 1706, "418": 1786, "418648109779": [1828, 1844], "418674031273": [1828, 1844], "41867403127321": [1828, 1844], "418884326509e": 1706, "41972294": 1837, "41e": 1743, "42": 1706, "420000": [1695, 1697, 1700, 1702, 1758], "4212": [1828, 1844], "42148": 1841, "42333": 1770, "424295": 1788, "424700": 1837, "425": 1770, "42525091": 1730, "42552e": 1841, "4263102367e": 1706, "42788430": 1837, "428": 1734, "428000": [1695, 1697, 1700, 1701, 1702, 1758], "4285": [1734, 1838], "4291": 1734, "429560656538": 1833, "42966050": 1837, "42e": 1802, "43": [1706, 1708], "43000": 1749, "430000": [1695, 1700, 1702, 1758], "431020504e": 1706, "431500": 1837, "43239563": 1837, "43252": 1841, "4334": 1757, "43351854": 1837, "434": 1757, "43409966": 1706, "435": 1770, "4367983": 1770, "436840": 1802, "437": 1740, "43813": 1770, "4389": [1734, 1781], "4390": 1743, "4396": 1841, "4398216616e": 1706, "4399": 1734, "44": [1706, 1708], "440000": [1695, 1697, 1700, 1702, 1758], "441": [1734, 1754], "4417": [1734, 1770, 1781], "4429": 1743, "4431206": 1770, "4436083": 1730, "44463454": 1730, "4449979205": 1802, "4459192939": 1802, "446": 1740, "447": 1782, "44820652": 1706, "45": [1706, 1708, 1740, 1833, 1836], "450000": [1695, 1701, 1758], "45023975": 1837, "451": [1734, 1750], "452": 323, "453": 1802, "45315cb": 1788, "45344432": 1837, "45347471": 1837, "45347768": 1837, "45552656": 1837, "4557": 1841, "456": 1770, "45673981": 1837, "4598161475": 1743, "4598854": 1770, "45989805": 1706, "46": [323, 1706, 1708], "460000": [1695, 1696, 1697, 1700, 1702, 1758], "461": 1734, "4630807": 1770, "46375": 1841, "46454628": 1833, "465272": 1802, "4655": [297, 347], "466": 1802, "46600": 1749, "4676": 1743, "468": 1802, "4685031765008461": 1836, "46952": 1841, "46975875": 1837, "46e": 1802, "47": 1757, "470000": [1695, 1696, 1697, 1700, 1701, 1758], "47226565": 1788, "47226573": 1788, "4723133": 1770, "4728": [1734, 1781, 1829], "473": 1734, "47320": 1770, "4739423": 1781, "474": [323, 1802], "4740249": [1231, 1616, 1617, 1704], "4741": 1781, "47449560": 1837, "475": 1802, "47550008": 1837, "476741": 1734, "47692534": 1837, "4772692868": 1802, "4773580": 1781, "477483": 1734, "47801205": 1837, "47828501": 1837, "478353552e": 1706, "479": 1734, "47979303": 1833, "47996433": 1837, "48": [323, 1706, 1734, 1740], "4800": 1743, "480000": [1695, 1696, 1700, 1702, 1758], "4802": 1757, "4803662": 1781, "4811537": 1770, "48122": 1770, "4816628": 1781, "4818470201": [1754, 1803], "4818470204": [1754, 1803], "481873213172": 1833, "482": 1802, "48200": 1749, "4820877": 1781, "4825041": 1781, "4826520": 1781, "48296785": 1706, "483": [1734, 1802], "4833138": 1781, "48342016": 1837, "4843682167491039": 1836, "485": 323, "485797": 1841, "48579909070e": 1706, "486": 1802, "4862157": 1761, "486551484e": 1706, "4867135": 1781, "48758504": 1837, "48808e": 1838, "48819": 1770, "4892946": 1781, "4895864": 1770, "49": [1706, 1734, 1802], "490": 1802, "4902226": 1781, "49044826e": 1706, "491": 1802, "49186": 1841, "492418062e": 1706, "4927575": 1781, "4929609": 1770, "4937410": 1734, "4940734": [295, 318, 319, 1695, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "4940954": 1706, "4945706": [1734, 1781], "4948318": [1734, 1781], "49612913": 1837, "49639": 1770, "4976": [1692, 1752], "49800e": 1838, "4994190": 1734, "4994918": [1734, 1781], "499539341e": 1706, "4996382852165050": 1706, "4a": [1692, 1752], "4a1": 1757, "4a2": 1767, "4b": [1714, 1842], "4c": 1836, "4d_": 1838, "4e0596": 1786, "4ec3cae0546b6ae4f4f2cf28482cd164c8323cc6": [1692, 1752], "4f": 1833, "4f3": 1788, "4gb": [92, 1802], "4qov": 1756, "4rc1": 1748, "4th": [295, 318, 319, 1743, 1744, 1745, 1762, 1766, 1800], "4zapa": [1694, 1707, 1731, 1732], "5": [0, 1, 2, 13, 103, 150, 284, 291, 295, 296, 310, 314, 318, 319, 323, 341, 361, 375, 381, 382, 396, 404, 432, 487, 502, 549, 583, 588, 601, 606, 618, 632, 635, 641, 652, 669, 696, 700, 814, 835, 852, 854, 893, 933, 953, 972, 981, 993, 1028, 1138, 1147, 1153, 1180, 1197, 1199, 1200, 1203, 1206, 1210, 1211, 1213, 1214, 1215, 1217, 1221, 1222, 1224, 1225, 1226, 1228, 1229, 1231, 1236, 1245, 1246, 1247, 1253, 1254, 1255, 1265, 1269, 1272, 1273, 1274, 1275, 1287, 1297, 1299, 1340, 1343, 1395, 1396, 1421, 1422, 1426, 1522, 1556, 1567, 1568, 1604, 1605, 1644, 1645, 1658, 1670, 1675, 1680, 1684, 1692, 1694, 1695, 1698, 1700, 1701, 1704, 1706, 1707, 1711, 1714, 1730, 1731, 1732, 1733, 1734, 1738, 1739, 1740, 1741, 1742, 1743, 1746, 1748, 1750, 1752, 1753, 1756, 1757, 1758, 1759, 1761, 1763, 1764, 1766, 1767, 1768, 1769, 1770, 1771, 1776, 1781, 1782, 1783, 1786, 1789, 1791, 1792, 1796, 1798, 1800, 1802, 1808, 1809, 1817, 1821, 1826, 1828, 1832, 1833, 1834, 1836, 1837, 1838, 1841, 1842, 1844], "50": [1, 405, 431, 447, 524, 548, 585, 633, 646, 663, 914, 950, 966, 970, 1062, 1136, 1197, 1199, 1202, 1203, 1206, 1213, 1214, 1218, 1221, 1225, 1226, 1228, 1230, 1231, 1243, 1267, 1325, 1332, 1391, 1439, 1457, 1496, 1542, 1607, 1658, 1704, 1706, 1708, 1710, 1714, 1742, 1749, 1757, 1770, 1776, 1798, 1802, 1808, 1832, 1837, 1841, 1842], "500": [2, 685, 1141, 1206, 1221, 1231, 1592, 1704, 1786, 1828, 1832], "5000": 377, "50000": [572, 1206, 1704], "500000": [1695, 1696, 1697, 1700, 1702, 1758], "50005": 1770, "500387735e": 1706, "500mib": [374, 395], "501": 1770, "5012601": [295, 318, 319, 1695, 1698, 1699, 1703, 1734, 1758, 1766, 1800], "50223e": 1838, "5026452583": 1802, "503195220163": 1833, "503277593e": 1706, "503457": 1706, "503900": 1837, "504": 1802, "50405": 1841, "50432831": 1837, "504609503e": 1706, "505": 1802, "50500": 1781, "505349739e": 1706, "5057": 1837, "50586123": 1837, "506": 1802, "50669": 1770, "50673730": 1837, "507144": 1841, "5080": 1743, "5086168": 1734, "5090222": 1734, "509190205e": 1706, "5094737775374055927342256": 1706, "50962": 1770, "50964": 1841, "5096595e": 1706, "51": [323, 1706, 1708], "510000": [1695, 1696, 1700, 1758], "5106510": 1770, "5109989461": 1706, "512": [620, 1206, 1231, 1661, 1704, 1757, 1770], "5130066166e": 1706, "5137": 1837, "5139948": 1734, "51414": 1770, "5144964": 1734, "515": [1734, 1759], "5150": 1743, "51500": 1749, "51612746": 1837, "517327": 1833, "5173865": 1770, "518": 1802, "51934253": 1833, "5198298460088e": 1706, "51e": 1743, "52": [1706, 1708], "520000": [1695, 1696, 1697, 1700, 1758], "5218583": 1770, "522": [1734, 1805], "5221": 1706, "522300": [1695, 1697, 1700, 1702, 1758], "5238121": 1770, "523870772178089": 1752, "524": 1802, "524438411e": 1706, "5244823836": 1802, "52532395": 1837, "52534243": 1837, "527107413251": 1833, "528063": 1706, "5281": 1743, "5286439": 1770, "528790": 1706, "52917721067": 1706, "5294": 1757, "52971": 1841, "53": [1706, 1708, 1734, 1757], "530": 1734, "530000": [1695, 1696, 1697, 1700, 1758], "53532814": 1730, "536": 1828, "53614999": 1837, "53617865e": 1706, "53635": 1770, "536418": 1802, "53752571": 1837, "538": 1844, "53800": 1749, "5390": 1743, "54": [297, 323, 347, 1706, 1810], "540000": [1695, 1696, 1697, 1700, 1702, 1758], "540030314": 1781, "540100111": 1734, "5409035710": 1802, "5410": 1743, "541746451895025916414946904": 1706, "54291925": 1837, "54385233": 1837, "544757019107": 1838, "546": 1802, "546935": 1802, "5477": 1734, "548101": 1833, "5482": 1734, "5495": 1706, "5496": 1706, "55": [601, 1206, 1704], "550": [1714, 1734, 1759, 1842], "550000": [1695, 1696, 1697, 1700, 1758], "550414": 1802, "5504918473": 1802, "551007": 1837, "552136": 1841, "553": 1770, "55358703": 1837, "555": [1714, 1842], "55514739": 1837, "556": [1770, 1781], "55600": 1749, "556335252767e": 1706, "557000": [1695, 1700, 1758], "557685": 1833, "558111": 1802, "56": [323, 1224, 1233, 1235, 1236, 1237, 1238, 1239, 1241, 1704, 1733, 1740], "560000": [1695, 1697, 1700, 1702, 1758], "56083": 1841, "5615900098": [1754, 1803], "562": 323, "563468": 1802, "5654133": 1706, "5656": [1692, 1752], "56634474": 1837, "5665603": 1770, "56695248": 1837, "567900": [1695, 1700, 1702, 1758], "56841161": 1837, "568508": 1706, "57042064": 1837, "571249748886": 1833, "5748636": 1770, "57500": 1749, "57530818": 1837, "57615966": 1837, "57636": 1770, "57638507": 1706, "57747892": 1706, "57944161": 1837, "579683920711e": 1706, "58": [601, 1206, 1704, 1706, 1738], "58009e": 1838, "58073": 1841, "581": 1802, "5810": 1757, "582119514e": 1706, "583": 1770, "58408901": 1837, "585694702": 1706, "58728357": 1837, "589": [1714, 1842], "5897959670": 1743, "58991e": 1838, "58e": 1743, "59": [323, 601, 1206, 1704, 1706, 1757], "590": 1757, "59003378": 1837, "59009": 1770, "5904026": 1770, "592": 1782, "592753": 1802, "5930": 1771, "593333": 1841, "594": 1770, "59496320631871": 1838, "595": 323, "5968": [1734, 1771], "5976": [1225, 1271, 1704], "599677": 1837, "5a7522a": 1788, "5b00817": [1734, 1781], "5b01128": [1734, 1781], "5d": [691, 1206, 1704, 1707, 1722, 1730, 1731, 1810], "5d87b55": 1786, "5e": 1743, "5e5": [374, 395], "5e8": [92, 1832], "5z": 1738, "5zapa": [1694, 1707, 1731, 1732], "6": [0, 1, 150, 262, 265, 284, 291, 295, 296, 303, 310, 321, 323, 341, 361, 374, 389, 395, 408, 433, 439, 466, 473, 491, 499, 500, 507, 514, 572, 601, 609, 614, 622, 635, 641, 662, 686, 690, 696, 709, 711, 712, 722, 734, 763, 818, 907, 911, 924, 931, 936, 971, 976, 985, 993, 1002, 1079, 1085, 1174, 1178, 1197, 1199, 1200, 1201, 1202, 1206, 1207, 1208, 1209, 1210, 1212, 1213, 1214, 1215, 1219, 1222, 1224, 1225, 1226, 1229, 1230, 1231, 1233, 1242, 1250, 1257, 1272, 1285, 1350, 1410, 1444, 1445, 1462, 1478, 1497, 1552, 1638, 1692, 1694, 1704, 1706, 1707, 1711, 1714, 1729, 1730, 1731, 1732, 1733, 1734, 1738, 1739, 1740, 1742, 1743, 1746, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1757, 1759, 1763, 1766, 1769, 1770, 1771, 1775, 1776, 1781, 1782, 1786, 1788, 1789, 1792, 1794, 1795, 1798, 1802, 1817, 1828, 1832, 1833, 1837, 1838, 1841, 1842, 1844], "60": [342, 356, 601, 1206, 1231, 1652, 1704, 1708, 1750, 1757, 1841], "600": [374, 395, 1844], "600000": [1695, 1696, 1697, 1700, 1758], "600000000": [374, 395], "600000000l": [374, 395], "6008": 1837, "601": [1714, 1842], "6021766208e": 1706, "60218631": 1837, "6031427": 1770, "60532": 1781, "605693009": 1706, "606": 323, "606057": 1802, "6061": [1734, 1754], "6064153737": 1802, "60709": 1770, "60768372": 1730, "609588650e": 1706, "60998364": 1837, "60e": 1743, "61": [323, 601, 1206, 1704, 1706, 1708], "6100822": 1786, "6103": [1734, 1755], "6106": [1692, 1752], "611": [1714, 1842], "61249e": 1838, "612928": 1706, "6137632": 1770, "614413": [1695, 1700, 1702, 1758], "615938": 1841, "616229e": 1706, "62": [601, 1206, 1704, 1706, 1708, 1735], "62000698": 1837, "622593285": 1706, "62349901753706": 1838, "62391373": 1730, "623ad64": 1748, "6240195463": 1802, "626070040e": 1706, "62639942687878": 1838, "62689561367233": 1838, "62694151275420": 1838, "62694337910040": 1838, "62694340915198": 1838, "62694340999315": 1838, "627": 1706, "62730705472407": 1838, "62730737348096": 1838, "62730738537113": 1838, "62730738624032": 1838, "627352": [1828, 1833, 1844], "628": 323, "6286": [443, 479, 519, 543, 1199, 1200, 1202, 1203, 1704], "629145600": [374, 395], "6297": [443, 479, 519, 543, 1199, 1200, 1202, 1203, 1704], "63": [284, 601, 1206, 1704, 1706, 1708, 1740], "6313702": 1706, "6324": 1743, "63645e": 1838, "636822": 1833, "63697e": 1838, "637563": 1833, "639": 323, "639498336738": 1833, "63e": [1743, 1802], "64": [323, 575, 595, 601, 651, 1206, 1685, 1704, 1708, 1738, 1776, 1788], "640882152784": 1833, "6431662": 1770, "644657230e": 1706, "64545587": 1837, "64572e": 1841, "6478": 1828, "6480": 1844, "64800": 1749, "6487772731e": 1706, "649232019048": 1838, "64gb": 1837, "65": [323, 1706, 1734, 1757, 1828, 1844], "650000": [1695, 1696, 1697, 1700, 1758], "65010327": 1837, "6509": 1734, "651226": 1802, "6516467e": 1706, "65200": 1749, "65238683": 1837, "6524587158e": 1706, "65300": 1749, "65344779": 1833, "65441e": 1841, "65498573": 1837, "65616e": 1838, "656530": 1802, "65723": 1833, "6579683920": 1706, "658": 1706, "6583745": 1706, "66": [323, 1734], "660000": [1695, 1696, 1697, 1700, 1702, 1758], "660539040000e": 1706, "660539040e": 1706, "6615": [1734, 1759], "6623650e": 1706, "6645256529074572": 1836, "6649726": 1770, "667578": [1828, 1833, 1844], "67": 1706, "6700535363": 1706, "670367e": 1706, "6709": 1743, "67171405": 1706, "672": 323, "672621898e": 1706, "673": 1782, "673774709694": 1833, "67384e": 1832, "674": 1770, "67408e": 1706, "67416758080654": 1752, "674927471e": 1706, "678369": 1802, "68": [1734, 1781], "680": 1770, "680000": [1695, 1696, 1697, 1700, 1758], "680398": 1837, "683": 323, "683650": 1802, "68366158": 1706, "6838545": 1770, "684669": 1802, "68497934": 1706, "68499694": 1706, "686": [1230, 1469, 1704, 1837], "68644814": 1706, "68662563": 1837, "6867811e": 1706, "687348": 1802, "6888063568e": 1838, "689090": 1802, "68980e": 1838, "68990e": 1838, "69": [323, 1706, 1734], "690000": [1695, 1696, 1697, 1700, 1702, 1758], "69193e": 1838, "692833774e": 1706, "693240": [1828, 1833, 1844], "693370": 1802, "69430495": 1752, "69435362": 1752, "69464439": 1837, "695000": 1841, "69570268": 1837, "69689985": 1837, "697024": 1802, "699036": 1802, "69968912": 1837, "6a": [1692, 1752], "6b00456": 1734, "6cbc05e": 1786, "6d": [691, 1206, 1704, 1707, 1722, 1730, 1731, 1810], "6f": [1828, 1833, 1844], "6g": [1694, 1707, 1731, 1732], "6h": 1730, "6z": 1738, "6zapa": [1694, 1707, 1731, 1732], "7": [284, 295, 297, 323, 347, 455, 529, 552, 582, 601, 613, 628, 645, 669, 684, 696, 850, 876, 949, 993, 1055, 1086, 1176, 1199, 1202, 1203, 1206, 1210, 1213, 1215, 1218, 1219, 1222, 1226, 1229, 1231, 1301, 1328, 1408, 1548, 1602, 1603, 1692, 1704, 1706, 1711, 1714, 1730, 1734, 1738, 1739, 1740, 1742, 1743, 1746, 1748, 1749, 1752, 1753, 1755, 1757, 1759, 1761, 1766, 1770, 1771, 1776, 1781, 1782, 1786, 1788, 1789, 1792, 1798, 1802, 1805, 1808, 1828, 1829, 1833, 1837, 1838, 1841, 1842], "70": [1231, 1632, 1704, 1838], "700": 1757, "7000176": 1808, "70011547": 1730, "705": 323, "70649e": 1841, "70684615": 1837, "707325": 1802, "707746": 1802, "708370": 1802, "7084139850": 1743, "70861e": 1706, "709": 1782, "7093200": 1730, "70932405488924": [1828, 1844], "70932405488935": [1828, 1844], "7096126": 1770, "71": [1708, 1757], "710000": [1695, 1696, 1697, 1700, 1758], "7109913627": 1802, "711": 1706, "71100": 1749, "711418672248": 1833, "71200": 1749, "713491": 1833, "7140": [1734, 1755], "715": 1788, "7151": 1837, "7151135": 1770, "71581": 1841, "716": [323, 1770], "717362356e": 1706, "717651915252": 1833, "7197947": 1770, "71e": 1743, "72": [1708, 1833], "720000": [1695, 1696, 1700, 1758], "7221": [1734, 1771], "72286487": 1837, "7230": 1734, "72343814": 1837, "727": [323, 1833], "72700202": 1743, "72764911": 1743, "72806043": 1743, "72817678": 1743, "72821875": 1743, "72827951": 1743, "72831099": 1743, "72831991": 1743, "72836761": 1743, "72842215": 1743, "72845143": 1743, "72845373": 1743, "72848118": 1743, "72850993": 1743, "72852567": 1743, "72853498": 1743, "72855167": 1743, "72855247": 1743, "7288723155": 1802, "7294": 1706, "72e": 1802, "73": [1708, 1734, 1738], "730": [628, 1206, 1704, 1770], "730313461": 1706, "73076": 1841, "730924488e": 1706, "73200": 1749, "73400": 1749, "735": [575, 1206, 1704], "735e": 1759, "736": [443, 479, 519, 543, 1199, 1200, 1202, 1203, 1704], "7369": 1833, "7370": 1833, "7371": 1833, "739": 1770, "739888": 1841, "74": [295, 1708, 1734, 1757, 1766], "740": [443, 479, 519, 543, 1199, 1200, 1202, 1203, 1704], "74100": 1749, "741771790e": 1706, "742": 1770, "74247000": 1837, "74296": 1833, "7445512": 1770, "745960643462": 1833, "7478283184": 1802, "748": 1738, "748978309671": 1833, "749": [323, 1770], "74900": 1749, "75": [297, 323, 347, 714, 1143, 1207, 1221, 1231, 1533, 1618, 1704, 1708, 1743, 1757, 1832], "75000": 1749, "750000": [1695, 1696, 1697, 1700, 1758], "7505": 1833, "751e": 1706, "75483e": 1841, "755": 1738, "7550": 1706, "7550882318031839256652313": 1706, "75689e": 1841, "7569489": 1770, "7577": 1743, "757718": 1844, "758561": 1837, "758605": 1828, "758820024e": 1706, "76": [2, 323, 1706, 1708, 1734, 1743, 1752, 1756, 1771, 1776, 1828, 1832, 1844], "76075473": 1837, "760859644e": 1706, "7611816259664579": 1836, "7617665603": 1706, "7617861313": 1706, "762": [651, 1206, 1704], "762503": 1837, "7638459": 1770, "76487181": 1837, "766603000356": 1833, "7669880": 1706, "7680411190": 1802, "7682826": 1706, "76960": 1841, "7696838": 1770, "76e": 1743, "77": [323, 1708, 1752, 1757], "770": [1230, 1469, 1704, 1757, 1837], "77037903": 1837, "771": 323, "772570540211": 1833, "772960": 1802, "774": 1770, "77605762": 1837, "77624": 1841, "777290": 1833, "77763": 1770, "78": [1734, 1752], "782661907e": 1706, "7842846": 1770, "78438": 1833, "785": [1734, 1792], "786082": 1802, "7865043": 1770, "786fb2b": 1788, "7878417": 1770, "788248": 1841, "79": [323, 1706, 1708], "790": [1692, 1752, 1802], "792": 1770, "792775600": 1706, "7928473508": 1706, "793701": [1695, 1696, 1700, 1758], "7949930": 1770, "799": [1734, 1754], "7992447e": 1706, "799961446760": 1838, "7b00174": 1781, "7f": [691, 1206, 1704, 1707, 1730, 1731, 1810], "7th": [1714, 1842], "7z": 1738, "7zapa": [1694, 1707, 1731, 1732], "8": [2, 284, 285, 287, 336, 338, 374, 395, 601, 662, 687, 696, 777, 847, 918, 977, 984, 1029, 1034, 1077, 1140, 1206, 1209, 1210, 1213, 1214, 1218, 1219, 1221, 1226, 1228, 1230, 1231, 1341, 1389, 1438, 1440, 1442, 1543, 1600, 1692, 1704, 1706, 1711, 1736, 1737, 1738, 1739, 1740, 1743, 1748, 1749, 1752, 1754, 1757, 1759, 1770, 1771, 1781, 1782, 1786, 1787, 1792, 1798, 1802, 1814, 1821, 1828, 1829, 1833, 1837, 1838, 1841, 1844], "80": [313, 323, 364, 485, 1200, 1231, 1629, 1704, 1708, 1743, 1752, 1841], "800000000": [374, 395], "80032977420572": 1838, "8007": [1714, 1842], "801466202085710": 2, "8031688251": [1754, 1803], "804": [323, 1743], "8040686146": 1802, "80466e": 1838, "805375": 1802, "805894": 1802, "806554": 1706, "80665": 1706, "807": 1706, "807024": 1802, "807436": 1802, "8074555": 1706, "80760445": 1837, "80800": 1749, "8088610": 1730, "80937379": 1837, "81": 1708, "810717": 1802, "811790225041": 1833, "81251": 1770, "81348351": 1833, "8138764635": 1833, "8139169342": 1802, "8141619690": 1802, "8153482424": 1802, "8167": 1706, "8179403227e": 1706, "81e": 1743, "82": [0, 323, 1734, 1738], "8218": [356, 1734], "821873": 1802, "82204": 1770, "82293384": 1833, "825": 323, "82608545": 1706, "826189": 1841, "82714": 1770, "827253": [1734, 1781], "828215": 1841, "82e": 1743, "83": [1706, 1708, 1757, 1810], "8318": 1734, "83217802": [150, 262], "833": 1802, "8330227": 1770, "833601608592": 1833, "834": [1794, 1838], "8340933116": 1802, "8357382590": 1743, "835978525e": 1706, "835979e": 1706, "83718642": 1837, "839500": 1837, "8396901": 1770, "84": [323, 1708, 1781], "84372": 1770, "84608": 1770, "84678e": 1706, "84717649": 1752, "84e": [1743, 1759], "85": [1110, 1221, 1704, 1706, 1708, 1750, 1752], "850718": 1802, "850870129e": 1706, "85252518": 1837, "85358e": 1838, "854187817e": 1706, "85440936": 1837, "854801999e": 1706, "85518839": 1738, "85541474": 1833, "8566666": 1770, "8574382311": 1706, "86": [1708, 1757], "860": 1770, "8615926764e": 1706, "8624456357": 1802, "863178": 1841, "864": 1706, "86635e": 1838, "867": [1770, 1802], "8670730": 1770, "867594308e": 1706, "87": [323, 1225, 1271, 1704, 1708, 1734, 1810], "87104935": 1837, "878": [1692, 1752], "8789238e": 1706, "88": [1692, 1706, 1708, 1734, 1752, 1789], "88024338": 1706, "881": 323, "8811319": 1770, "881921": 1841, "8822939": 1770, "88342055": 1837, "883531594e": 1706, "883829": 1802, "88527922": 1706, "8853463281": 1802, "888": [1692, 1752], "8887241813": 1802, "8897161646320724": 323, "89": [297, 323, 347, 1708, 1734, 1757], "89059705": 1706, "890600": 1837, "8910365886e": 1706, "89111": 1706, "892": 323, "8921463": 1770, "89248408": 1706, "89372": 1706, "895249": 1841, "8960491": 1770, "89725": 1770, "89884187": 1837, "89e": [1743, 1802], "8b00072": [295, 318, 319, 1695, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "8b00286": 1734, "8b01089": [1734, 1781], "8f": 1834, "9": [2, 106, 150, 192, 193, 203, 204, 262, 284, 285, 287, 336, 338, 374, 395, 601, 695, 764, 766, 902, 927, 1051, 1206, 1209, 1212, 1213, 1218, 1229, 1230, 1424, 1481, 1482, 1692, 1704, 1706, 1734, 1736, 1740, 1743, 1748, 1749, 1752, 1754, 1757, 1759, 1763, 1767, 1770, 1771, 1774, 1781, 1802, 1817, 1828, 1832, 1833, 1837, 1838, 1840, 1841], "90": [855, 1058, 1210, 1218, 1231, 1624, 1704, 1706, 1713, 1730, 1742, 1750, 1767, 1770, 1789, 1802], "900": 323, "90033": [297, 347], "90041e": 1838, "900503": [1828, 1833, 1844], "90100": 1749, "9015844116": [1754, 1803], "901788": 1841, "902": 1706, "9024664": 1770, "903": 1770, "9030376": 1770, "90349624": 1837, "90749": 1706, "907714": 1802, "9084": [885, 1210, 1704], "9094": [885, 1210, 1704], "90986540": 1837, "9099": 1743, "90997067": 1837, "91": 1706, "91003922": 1837, "912085762652": 1838, "91304273": 1706, "91313050": 1837, "9143727": 1770, "91526": 1833, "91591820": 1802, "9160": [1692, 1734, 1752, 1802], "91714746": 1837, "9178691296": 1743, "918035522052": 1833, "91816882": 1837, "91e": 1802, "92": [323, 1692, 1708, 1752, 1836], "920155714e": 1706, "92050": 1706, "9209603634": 1802, "921112": 1706, "9212623197e": 1706, "9213": [1714, 1842], "9215": 1762, "92153588": 1706, "923": 1770, "923499": 1706, "923621": [1828, 1833, 1844], "92529543": 1802, "92533462456894": 1844, "925334628859886": 1828, "92533462887677": 1828, "92540669": 1802, "92548668": 1802, "92548698": 1802, "925572581453": 1833, "926": 1781, "92934049": 1833, "92967": 1770, "9298523": 1770, "92e": 1802, "93": [1708, 1757, 1781, 1828, 1844], "93023559": 1837, "93042809": 1833, "931": [1706, 1770], "931494095": 1706, "934259": 1837, "936": 1770, "938": 1706, "9382724": 1770, "939": 1706, "93e": 1743, "94": [1708, 1734, 1781], "94200": 1749, "94222": 1770, "944245": 1802, "946347": 1802, "948079": 1833, "949": 1802, "949807": 1841, "95": [1692, 1708, 1734, 1752, 1757, 1802], "950962": 1833, "95107": 1786, "95164": 1706, "952052": 1802, "953": 1803, "95387e": 1841, "955593": 1802, "957": 1832, "9574": 1837, "9574153": 1770, "95788332": 1706, "957924920": 1706, "958": 1743, "95e": 1802, "96": [1734, 1828, 1844], "960": 1706, "96187e": 1838, "962771": 1841, "963929": [1828, 1833, 1844], "9646519": 1770, "96485": 1706, "965": [1770, 1802], "96785": 1770, "9681078610": 1802, "968607": 1802, "97": [323, 1708, 1734, 1837], "971": 1802, "971920097e": 1706, "97259968907": 1706, "973": [1734, 1754], "974": 1757, "9770": [1734, 1802], "97787e": 1706, "977905": 1802, "978": 1782, "9780195357738": 1734, "9780470125915": 1781, "9781118008720": [377, 1734], "978834": 1802, "978962460": 1706, "98": [693, 1206, 1704, 1714, 1734, 1740, 1838, 1842], "98000": 1749, "98104857": 1833, "9846751653": 1802, "98526650": 1837, "986445824e": 1706, "986471814808": 1833, "987551787e": 1706, "98921779": 1837, "98e": 1802, "99": [2, 285, 287, 323, 336, 338, 1084, 1219, 1704, 1740, 1757, 1763, 1802], "990085": 1832, "990195": 1832, "990227": 1802, "9903127110e": 1706, "99100": 1749, "9920": 1837, "99216": 1770, "992851882e": 1706, "99315267046": 1706, "99371703348": 1706, "994915": [1828, 1844], "99497e": 1838, "99500": 1749, "9950517332": 1833, "9964630692": 1802, "99734": 1770, "998400": 1802, "99862347844": 1706, "999": [644, 1206, 1704, 1786, 1803], "99900750087": 1706, "99e": 1802, "9b00860": 1734, "9g": [691, 1206, 1704, 1810], "A": [0, 1, 2, 11, 13, 26, 75, 76, 100, 106, 138, 150, 182, 259, 284, 287, 295, 296, 303, 314, 321, 324, 327, 329, 335, 338, 342, 356, 368, 369, 374, 377, 386, 395, 399, 404, 433, 434, 446, 466, 484, 507, 514, 592, 596, 640, 679, 729, 770, 776, 837, 906, 957, 993, 1048, 1153, 1197, 1199, 1200, 1201, 1202, 1206, 1208, 1209, 1210, 1212, 1213, 1215, 1218, 1221, 1225, 1226, 1229, 1230, 1231, 1242, 1283, 1289, 1294, 1304, 1313, 1336, 1405, 1469, 1473, 1485, 1499, 1500, 1520, 1536, 1544, 1556, 1669, 1675, 1679, 1683, 1704, 1706, 1708, 1713, 1714, 1725, 1726, 1730, 1734, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1746, 1748, 1749, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1760, 1761, 1764, 1765, 1766, 1767, 1768, 1769, 1771, 1772, 1774, 1776, 1777, 1780, 1781, 1782, 1783, 1785, 1786, 1789, 1790, 1791, 1792, 1794, 1797, 1798, 1801, 1802, 1803, 1806, 1809, 1810, 1817, 1823, 1824, 1828, 1832, 1833, 1835, 1838, 1839, 1841, 1842, 1843, 1844], "AND": [794, 1210, 1704, 1770, 1821], "AT": [1685, 1714, 1776, 1798, 1799, 1828, 1842], "And": [1738, 1767, 1777, 1780, 1828, 1844], "As": [106, 111, 284, 577, 1206, 1704, 1707, 1730, 1731, 1736, 1737, 1738, 1740, 1743, 1746, 1748, 1750, 1752, 1753, 1755, 1757, 1759, 1763, 1767, 1770, 1779, 1781, 1783, 1789, 1798, 1801, 1802, 1810, 1821, 1828, 1829, 1832, 1834, 1837, 1838, 1841, 1844], "At": [2, 342, 356, 617, 641, 1125, 1206, 1221, 1704, 1707, 1731, 1738, 1740, 1749, 1752, 1753, 1754, 1756, 1757, 1763, 1764, 1770, 1771, 1774, 1782, 1792, 1801, 1802, 1803, 1809, 1828, 1833, 1834, 1837, 1838, 1844], "Be": [614, 661, 1126, 1206, 1221, 1224, 1240, 1704, 1707, 1731, 1761, 1786, 1788], "But": [2, 1748, 1759, 1788, 1837, 1843], "By": [0, 2, 106, 284, 671, 681, 1206, 1704, 1735, 1740, 1743, 1747, 1750, 1753, 1754, 1755, 1759, 1762, 1767, 1768, 1770, 1771, 1788, 1794, 1799, 1801, 1808, 1824, 1828, 1832, 1833, 1836, 1837, 1838, 1841, 1844], "For": [0, 1, 2, 8, 106, 150, 158, 159, 279, 283, 292, 296, 300, 301, 302, 324, 333, 342, 343, 350, 376, 397, 416, 433, 457, 466, 507, 514, 539, 569, 593, 601, 608, 609, 616, 628, 659, 660, 662, 665, 671, 675, 681, 700, 707, 715, 727, 794, 833, 861, 1126, 1150, 1188, 1189, 1190, 1191, 1198, 1199, 1200, 1201, 1202, 1203, 1206, 1207, 1208, 1210, 1221, 1222, 1225, 1226, 1230, 1231, 1242, 1313, 1326, 1448, 1449, 1450, 1463, 1464, 1465, 1466, 1615, 1620, 1704, 1714, 1730, 1733, 1738, 1740, 1742, 1743, 1746, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1762, 1763, 1764, 1765, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1792, 1794, 1795, 1796, 1798, 1799, 1800, 1801, 1802, 1803, 1809, 1810, 1817, 1824, 1828, 1832, 1833, 1835, 1837, 1838, 1839, 1841, 1842, 1844], "IN": [1668, 1669, 1690, 1776], "If": [0, 1, 2, 8, 13, 64, 84, 86, 100, 106, 148, 150, 255, 259, 262, 267, 282, 284, 296, 300, 301, 302, 303, 318, 319, 326, 329, 331, 332, 335, 342, 346, 377, 384, 389, 430, 474, 550, 569, 570, 573, 593, 616, 638, 656, 660, 661, 672, 704, 707, 726, 746, 808, 821, 827, 852, 859, 860, 862, 875, 930, 934, 949, 958, 1025, 1026, 1027, 1129, 1157, 1199, 1200, 1203, 1206, 1208, 1210, 1213, 1217, 1221, 1224, 1225, 1226, 1228, 1230, 1231, 1236, 1240, 1266, 1290, 1331, 1332, 1381, 1453, 1565, 1578, 1612, 1654, 1704, 1714, 1730, 1735, 1738, 1740, 1742, 1743, 1746, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1761, 1762, 1763, 1764, 1765, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1782, 1783, 1784, 1785, 1786, 1788, 1791, 1792, 1794, 1797, 1798, 1800, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1817, 1821, 1824, 1828, 1829, 1833, 1835, 1837, 1838, 1839, 1841, 1842, 1843, 1844], "In": [0, 1, 2, 8, 106, 150, 284, 314, 329, 377, 575, 584, 603, 609, 619, 623, 626, 655, 660, 695, 697, 747, 829, 890, 921, 922, 1125, 1206, 1208, 1210, 1213, 1221, 1224, 1225, 1230, 1241, 1244, 1441, 1704, 1707, 1714, 1731, 1734, 1735, 1737, 1738, 1740, 1741, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1756, 1757, 1759, 1762, 1763, 1764, 1765, 1767, 1770, 1771, 1773, 1775, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1791, 1794, 1797, 1798, 1799, 1801, 1802, 1803, 1808, 1809, 1810, 1817, 1824, 1828, 1829, 1832, 1833, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1844], "It": [0, 2, 5, 84, 279, 285, 336, 510, 573, 609, 660, 681, 882, 883, 993, 1124, 1201, 1206, 1210, 1215, 1221, 1231, 1498, 1704, 1738, 1740, 1742, 1743, 1746, 1747, 1748, 1750, 1752, 1753, 1755, 1764, 1767, 1770, 1772, 1781, 1786, 1788, 1789, 1791, 1801, 1803, 1808, 1810, 1817, 1824, 1828, 1829, 1833, 1835, 1836, 1837, 1838, 1841, 1843, 1844], "Its": [1739, 1781], "NO": [150, 314, 596, 707, 1000, 1163, 1206, 1215, 1221, 1704, 1714, 1746, 1762, 1785, 1791, 1836, 1842], "NOT": [87, 1124, 1221, 1704, 1738, 1752, 1759], "NOs": [1083, 1084, 1085, 1219, 1231, 1614, 1704, 1771, 1837], "NeAr": [1692, 1752], "Near": [1781, 1828, 1844], "No": [1, 2, 11, 284, 410, 422, 495, 516, 522, 531, 550, 563, 569, 593, 601, 608, 609, 616, 623, 628, 629, 630, 631, 636, 660, 665, 670, 671, 679, 715, 717, 733, 767, 771, 778, 783, 784, 794, 810, 819, 824, 825, 827, 829, 855, 892, 897, 899, 963, 1005, 1006, 1007, 1008, 1009, 1032, 1033, 1050, 1057, 1065, 1075, 1099, 1100, 1102, 1103, 1108, 1109, 1111, 1112, 1115, 1116, 1120, 1123, 1126, 1127, 1128, 1130, 1150, 1155, 1156, 1158, 1159, 1160, 1161, 1162, 1164, 1165, 1168, 1170, 1177, 1192, 1195, 1197, 1198, 1200, 1202, 1203, 1204, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1214, 1215, 1218, 1219, 1220, 1221, 1222, 1223, 1226, 1227, 1230, 1231, 1304, 1307, 1308, 1309, 1310, 1311, 1314, 1318, 1319, 1320, 1321, 1322, 1336, 1357, 1358, 1359, 1360, 1371, 1377, 1437, 1445, 1446, 1484, 1502, 1521, 1527, 1551, 1559, 1562, 1579, 1581, 1582, 1584, 1586, 1595, 1619, 1642, 1655, 1657, 1658, 1692, 1704, 1730, 1736, 1740, 1742, 1743, 1746, 1750, 1752, 1754, 1755, 1759, 1763, 1767, 1771, 1772, 1775, 1781, 1785, 1788, 1789, 1791, 1832, 1834, 1835, 1836, 1837, 1841], "Not": [150, 296, 778, 799, 886, 1209, 1210, 1704, 1737, 1738, 1740, 1743, 1754, 1769, 1776, 1781, 1785], "ON": [1, 576, 579, 596, 597, 598, 602, 604, 617, 625, 626, 636, 639, 640, 642, 648, 655, 658, 672, 673, 678, 679, 680, 682, 688, 691, 692, 693, 694, 695, 698, 699, 701, 706, 1206, 1704, 1738, 1746, 1748, 1749, 1754, 1762, 1765, 1773, 1775, 1782, 1783, 1784, 1788, 1803, 1839], "ONE": [2, 286, 294, 337, 345, 1690, 1776, 1821], "OR": [794, 1210, 1228, 1393, 1704, 1738, 1748, 1749, 1759, 1764], "Of": [2, 603, 1206, 1704, 1748, 1798, 1828, 1844], "On": [1730, 1736, 1748, 1757, 1767, 1787, 1808, 1810, 1814, 1838], "One": [84, 150, 267, 317, 342, 365, 377, 577, 771, 1206, 1209, 1704, 1714, 1752, 1753, 1754, 1757, 1759, 1767, 1770, 1771, 1777, 1790, 1828, 1832, 1833, 1834, 1836, 1837, 1838, 1842, 1844], "Ons": [1738, 1748, 1777, 1787], "Or": [150, 255, 1737, 1738, 1748, 1786, 1797], "Such": [2, 692, 1206, 1704, 1757, 1764], "THE": 1828, "TO": 1794, "That": [2, 586, 1206, 1704, 1738, 1743, 1748, 1764, 1786, 1794, 1801, 1828, 1832, 1838, 1844], "The": [0, 1, 2, 8, 11, 13, 14, 64, 81, 83, 84, 87, 88, 100, 106, 111, 112, 113, 115, 128, 130, 134, 135, 138, 145, 148, 150, 214, 265, 284, 295, 296, 300, 301, 302, 312, 314, 318, 319, 321, 322, 325, 329, 335, 342, 352, 356, 368, 369, 377, 381, 382, 390, 399, 403, 410, 411, 412, 414, 420, 422, 430, 432, 433, 454, 466, 467, 474, 476, 507, 513, 514, 523, 528, 531, 547, 551, 557, 568, 569, 572, 575, 580, 582, 586, 593, 594, 601, 603, 606, 607, 608, 609, 614, 616, 622, 632, 635, 641, 644, 646, 647, 659, 660, 662, 664, 670, 671, 672, 677, 678, 685, 690, 696, 697, 703, 709, 710, 711, 712, 716, 720, 729, 744, 751, 752, 755, 756, 757, 759, 772, 791, 800, 811, 820, 823, 826, 828, 829, 833, 870, 873, 874, 876, 882, 884, 889, 890, 929, 930, 935, 944, 946, 947, 949, 958, 961, 993, 997, 1002, 1005, 1006, 1007, 1008, 1009, 1021, 1084, 1095, 1097, 1099, 1100, 1101, 1118, 1120, 1124, 1148, 1149, 1153, 1167, 1168, 1177, 1192, 1194, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1206, 1207, 1208, 1209, 1210, 1213, 1215, 1216, 1219, 1220, 1221, 1222, 1224, 1225, 1226, 1228, 1229, 1230, 1231, 1241, 1242, 1266, 1279, 1281, 1282, 1283, 1290, 1294, 1296, 1323, 1341, 1379, 1398, 1399, 1400, 1401, 1402, 1403, 1405, 1409, 1423, 1426, 1427, 1429, 1433, 1454, 1455, 1463, 1464, 1465, 1466, 1479, 1498, 1499, 1512, 1513, 1515, 1516, 1517, 1518, 1522, 1523, 1524, 1525, 1526, 1527, 1529, 1530, 1532, 1550, 1551, 1559, 1561, 1562, 1563, 1567, 1572, 1573, 1574, 1579, 1580, 1581, 1589, 1595, 1608, 1611, 1655, 1661, 1662, 1704, 1706, 1711, 1713, 1714, 1726, 1730, 1733, 1735, 1737, 1738, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1774, 1775, 1776, 1777, 1779, 1781, 1782, 1785, 1786, 1788, 1789, 1790, 1791, 1792, 1794, 1795, 1796, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1808, 1809, 1810, 1818, 1821, 1823, 1824, 1826, 1828, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "Then": [2, 8, 279, 1714, 1740, 1746, 1748, 1749, 1762, 1765, 1767, 1770, 1773, 1775, 1782, 1783, 1784, 1798, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1838, 1839, 1842], "There": [0, 2, 344, 616, 628, 640, 842, 1206, 1210, 1704, 1730, 1735, 1738, 1742, 1743, 1748, 1751, 1755, 1759, 1764, 1770, 1771, 1774, 1781, 1788, 1799, 1801, 1809, 1810, 1817, 1823], "These": [265, 321, 377, 570, 574, 664, 1206, 1230, 1231, 1441, 1690, 1704, 1714, 1730, 1733, 1738, 1740, 1743, 1750, 1753, 1754, 1757, 1759, 1767, 1770, 1771, 1774, 1776, 1780, 1782, 1788, 1789, 1794, 1798, 1799, 1802, 1808, 1809, 1810, 1817, 1824, 1828, 1832, 1833, 1837, 1838, 1839, 1841, 1842, 1844], "To": [0, 1, 2, 106, 150, 153, 275, 681, 829, 1206, 1210, 1704, 1730, 1735, 1737, 1738, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1762, 1765, 1767, 1769, 1770, 1773, 1774, 1775, 1782, 1783, 1784, 1786, 1792, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1810, 1817, 1823, 1824, 1828, 1831, 1832, 1833, 1837, 1838, 1839, 1844], "Will": [150, 314, 1225, 1229, 1231, 1245, 1246, 1247, 1253, 1254, 1255, 1265, 1272, 1273, 1274, 1275, 1421, 1422, 1548, 1704, 1791, 1798], "With": [0, 2, 356, 662, 1125, 1206, 1221, 1704, 1750, 1759, 1771, 1788, 1810, 1817, 1824, 1833, 1837], "_": [284, 377, 392, 1730, 1733, 1740, 1741, 1753, 1759, 1763, 1776, 1788, 1798, 1801, 1829, 1836, 1837, 1838, 1841], "_1": [1742, 1837], "_2": [1742, 1764, 1768, 1828, 1837], "_220_lattice_spacing_of_silicon": 1706, "_3": [1714, 1742, 1842], "__": [376, 397, 1828], "__file__": [2, 1738], "__getattr__": 315, "__init__": [1738, 1786, 1808], "__setattr__": 316, "__version__": [1738, 1786, 1788], "__version_branch_nam": 1786, "__version_cmak": 1786, "__version_is_clean": 1786, "__version_last_releas": 1786, "__version_long": [1786, 1788], "__version_prereleas": 1786, "__version_releas": 1786, "__version_upcoming_annotated_v_tag": [1786, 1788], "_a": 1837, "_b": 1837, "_c": 1757, "_contents_": 1794, "_dir": [1738, 1785], "_exit": 1785, "_function": [267, 1757, 1759], "_g_converg": [1226, 1324, 1704, 1802], "_get_default_xtpl": 1740, "_i": [1776, 1829], "_j": [1776, 1829], "_l": [295, 1683, 1739, 1742, 1766, 1776, 1781, 1792, 1793, 1798], "_n": [0, 1742], "_nprocessors_onln": [1738, 1748], "_optional_": 1748, "_psi4_true_raise_handl": 2, "_py_falsestruct": [1736, 1767], "_qcvar_reshape_get": 367, "_std": 1740, "_to_arrai": 1797, "_x": 1757, "_xtpl_": 1740, "a0": [76, 106, 267, 386, 388, 389, 399, 1759, 1772, 1774, 1776, 1802, 1817, 1838], "a1": [68, 300, 301, 302, 384, 993, 1215, 1704, 1714, 1746, 1750, 1772, 1802, 1828, 1842, 1844], "a1133": [1734, 1757], "a1138": 1734, "a1vib": 384, "a2": [68, 993, 1215, 1704, 1746, 1795, 1802], "a24": [1711, 1743, 1832], "aT": [1739, 1742, 1781, 1798], "a_": [0, 13, 1763, 1798, 1837], "a_1": [300, 301, 302, 829, 1210, 1704, 1714, 1759, 1772, 1833, 1842], "a_2": [829, 1210, 1704, 1759, 1833], "a_g": 1833, "a_i": [829, 1210, 1704], "a_point": 1810, "a_q": 13, "a_ras3_max": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "a_u": 1833, "aa": [13, 1228, 1383, 1704, 1706, 1708, 1734, 1749, 1755], "aaa": [1669, 1776], "aab": [1669, 1776], "aaqz": 1733, "ab": [1, 13, 259, 433, 466, 507, 514, 568, 575, 641, 708, 1047, 1199, 1200, 1201, 1202, 1206, 1218, 1225, 1242, 1679, 1704, 1708, 1714, 1734, 1742, 1753, 1755, 1756, 1759, 1763, 1770, 1771, 1776, 1777, 1781, 1786, 1790, 1802, 1829, 1838, 1842], "abb": [1669, 1776], "abbott": 1734, "abbr_acc": 1786, "abbrev": 1786, "abbrevi": [701, 1206, 1704, 1738, 1743], "abc": [259, 324, 329, 1679, 1714, 1755, 1759, 1770, 1776, 1827, 1842], "abc2": [1714, 1770, 1842], "abcd": [0, 1, 2, 627, 1206, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "abcdtyp": [568, 1206, 1704], "abelian": [106, 387, 573, 619, 696, 1206, 1704, 1781, 1833, 1838], "abil": [342, 1750, 1772, 1832, 1837], "abl": [1757, 1782, 1792, 1809, 1817, 1828, 1837, 1844], "abnorm": 1798, "abort": [656, 1206, 1704], "about": [0, 2, 81, 112, 115, 120, 139, 150, 1099, 1156, 1220, 1221, 1704, 1730, 1738, 1743, 1750, 1753, 1754, 1757, 1759, 1764, 1767, 1772, 1775, 1782, 1786, 1788, 1801, 1802, 1803, 1809, 1816, 1824, 1828, 1833, 1835, 1838, 1844], "abov": [0, 2, 267, 277, 279, 284, 454, 496, 551, 592, 601, 609, 629, 660, 704, 1101, 1199, 1200, 1203, 1206, 1220, 1230, 1231, 1462, 1562, 1704, 1730, 1738, 1740, 1742, 1743, 1748, 1750, 1752, 1753, 1755, 1757, 1759, 1760, 1767, 1768, 1770, 1772, 1775, 1779, 1781, 1782, 1788, 1794, 1797, 1799, 1801, 1802, 1808, 1809, 1810, 1817, 1828, 1829, 1832, 1833, 1834, 1837, 1838, 1840, 1841, 1844], "abram": 1781, "absenc": [1714, 1743, 1842], "absent": [79, 106, 1781, 1804], "absmax": 100, "absolut": [2, 100, 285, 287, 336, 338, 374, 383, 395, 415, 496, 582, 656, 683, 740, 823, 824, 825, 827, 829, 905, 1053, 1198, 1200, 1206, 1208, 1210, 1212, 1218, 1224, 1226, 1230, 1231, 1234, 1366, 1455, 1497, 1549, 1559, 1569, 1579, 1581, 1704, 1714, 1742, 1743, 1752, 1757, 1767, 1776, 1810, 1817, 1837, 1838, 1842, 1843], "absorb": [1764, 1808], "absorpt": [369, 377, 1781, 1790], "abspath": 1828, "abstract": [324, 329, 1768, 1817], "absurdli": 1757, "ac": [295, 318, 319, 1679, 1695, 1698, 1700, 1702, 1703, 1708, 1734, 1758, 1759, 1763, 1766, 1776, 1781, 1800, 1802], "academ": [1734, 1781], "acc": [1734, 1740, 1781], "accc": 1833, "acceler": [438, 515, 538, 584, 686, 687, 688, 699, 760, 762, 812, 833, 1173, 1175, 1199, 1202, 1203, 1206, 1209, 1210, 1222, 1229, 1231, 1430, 1485, 1546, 1557, 1615, 1616, 1617, 1704, 1706, 1734, 1735, 1738, 1753, 1754, 1789, 1824, 1838], "accept": [402, 454, 539, 550, 551, 696, 830, 1197, 1199, 1203, 1206, 1210, 1704, 1737, 1738, 1742, 1748, 1785, 1822], "access": [0, 70, 300, 301, 302, 318, 319, 620, 641, 1130, 1206, 1221, 1704, 1714, 1715, 1726, 1737, 1738, 1739, 1740, 1743, 1748, 1751, 1752, 1757, 1767, 1775, 1779, 1781, 1782, 1786, 1788, 1794, 1795, 1797, 1800, 1801, 1808, 1809, 1823, 1824, 1828, 1832, 1833, 1834, 1837, 1838, 1841, 1842, 1844], "accessor": [100, 148, 1738, 1797], "accident": 1786, "accommod": 1767, "accomod": 1817, "accompani": 1743, "accomplish": [1713, 1747, 1767, 1808, 1823, 1824, 1837, 1838], "accord": [8, 106, 296, 300, 301, 302, 586, 664, 691, 1206, 1704, 1730, 1737, 1738, 1740, 1743, 1747, 1750, 1757, 1763, 1769, 1770, 1772, 1781, 1794, 1798, 1802, 1810, 1833, 1835, 1837, 1838, 1840], "accordingli": [342, 356, 377, 1788, 1833, 1837, 1838], "account": [0, 1228, 1232, 1382, 1666, 1704, 1714, 1726, 1737, 1742, 1749, 1753, 1762, 1809, 1817, 1837, 1838, 1842, 1843], "accumul": [1231, 1568, 1704], "accumulate_product": 100, "accur": [295, 318, 319, 666, 1206, 1695, 1698, 1699, 1703, 1704, 1742, 1753, 1754, 1755, 1756, 1757, 1758, 1766, 1770, 1781, 1800, 1829, 1837, 1838], "accuraci": [2, 285, 287, 336, 338, 1714, 1734, 1753, 1754, 1756, 1757, 1763, 1771, 1781, 1796, 1798, 1806, 1837, 1838, 1842], "acen": 1781, "aces2": 1743, "acetylen": [1714, 1828, 1842, 1844], "achiev": [930, 949, 958, 1213, 1225, 1266, 1290, 1704, 1730, 1735, 1743, 1749, 1753, 1757, 1763, 1770, 1798, 1802, 1803, 1833, 1838], "acid": [460, 1199, 1692, 1704, 1711, 1714, 1752, 1833, 1837, 1842], "acml": 1738, "acpf": [284, 295, 1078, 1106, 1219, 1221, 1680, 1704, 1714, 1739, 1740, 1766, 1771, 1776, 1781, 1842], "across": [329, 1231, 1606, 1704, 1738, 1755, 1757, 1763, 1770, 1785, 1828, 1838, 1844], "act": [13, 1714, 1786, 1796, 1835, 1842], "acta": 1734, "action": [639, 1206, 1704, 1706, 1788], "activ": [0, 1, 2, 13, 76, 79, 86, 92, 106, 150, 191, 214, 215, 243, 260, 268, 284, 295, 335, 378, 454, 539, 551, 569, 587, 592, 654, 662, 676, 705, 795, 888, 989, 994, 1000, 1171, 1199, 1203, 1206, 1210, 1215, 1222, 1228, 1231, 1378, 1500, 1673, 1704, 1714, 1722, 1729, 1730, 1733, 1734, 1735, 1737, 1738, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "activate_all_frag": 106, "active_nat_orb": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "active_occ": 150, "active_vir": 150, "actual": [2, 8, 359, 570, 572, 1206, 1704, 1714, 1726, 1730, 1735, 1736, 1740, 1743, 1747, 1767, 1779, 1786, 1794, 1801, 1810, 1832, 1833, 1837, 1838, 1842, 1844], "actv": 1835, "ad": [8, 106, 150, 291, 296, 303, 314, 329, 341, 496, 589, 671, 751, 1200, 1206, 1208, 1225, 1296, 1704, 1730, 1738, 1742, 1747, 1748, 1750, 1755, 1757, 1760, 1763, 1764, 1767, 1769, 1775, 1777, 1779, 1781, 1787, 1788, 1790, 1791, 1798, 1802, 1804, 1808, 1814, 1815, 1817, 1823, 1828, 1832, 1833, 1836, 1837, 1838, 1839, 1840, 1844], "adapt": [16, 237, 295, 617, 619, 662, 707, 1110, 1206, 1221, 1230, 1689, 1704, 1734, 1743, 1748, 1754, 1755, 1766, 1776, 1777, 1790, 1806, 1810, 1828, 1833, 1838, 1844], "adc": [1, 295, 381, 382, 400, 408, 1704, 1705, 1709, 1734, 1738, 1766, 1776, 1777, 1790, 1826], "adcc": [295, 401, 404, 406, 407, 408, 1197, 1704, 1738, 1748, 1766, 1777, 1780, 1781, 1790], "adcc_stat": 0, "add": [2, 5, 73, 84, 88, 100, 106, 111, 114, 138, 148, 183, 184, 275, 284, 293, 321, 835, 1210, 1226, 1298, 1299, 1704, 1730, 1736, 1737, 1740, 1747, 1748, 1750, 1752, 1755, 1760, 1764, 1767, 1768, 1772, 1777, 1781, 1786, 1787, 1788, 1794, 1800, 1801, 1802, 1804, 1808, 1809, 1814, 1815, 1817, 1819, 1832, 1833, 1834, 1837, 1838], "add_": 1801, "add_and_orthogonalize_row": 100, "add_arrai": 114, "add_atom": 106, "add_auxiliary_bond": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "add_bool": [114, 1801], "add_c_funct": 138, "add_doubl": 1801, "add_execut": 1738, "add_int": [114, 1801], "add_opt": 327, "add_regression_test": 2, "add_spac": 27, "add_str": [114, 1801], "add_str_i": [114, 1170, 1221, 1704, 1772, 1791, 1801], "add_transform": 27, "add_x_funct": 138, "addbasi": 73, "addcharg": [73, 1838], "addchargeangstrom": 275, "addchargebohr": 275, "adddiffus": 275, "addfin": 1788, "addit": [0, 1, 2, 150, 266, 279, 297, 303, 308, 312, 314, 318, 319, 329, 347, 378, 608, 610, 667, 669, 671, 704, 794, 823, 890, 1125, 1206, 1210, 1221, 1230, 1435, 1436, 1704, 1730, 1733, 1738, 1740, 1742, 1743, 1746, 1748, 1749, 1750, 1753, 1754, 1755, 1757, 1759, 1762, 1763, 1765, 1767, 1771, 1773, 1775, 1780, 1781, 1782, 1783, 1784, 1788, 1790, 1791, 1797, 1799, 1800, 1801, 1803, 1805, 1808, 1809, 1828, 1829, 1833, 1837, 1838, 1844], "addition": [0, 106, 295, 300, 301, 302, 318, 319, 693, 1206, 1225, 1279, 1704, 1738, 1740, 1743, 1748, 1750, 1754, 1757, 1766, 1768, 1772, 1794, 1798, 1799, 1800, 1828, 1832, 1837, 1838, 1843], "additional_info": 266, "additionalproperti": [265, 1740, 1772, 1794], "addl": 1730, "addon": [2, 1724, 1738, 1748, 1785, 1788], "addon_nam": 1785, "addonconfig": 1738, "address": [0, 268, 620, 1206, 1704, 1714, 1823, 1831, 1842], "adenin": [1692, 1752, 1837], "adiabat": [655, 1206, 1704, 1757], "adii": [1231, 1550, 1615, 1704, 1714, 1838, 1842], "adjac": [106, 1692, 1740, 1752, 1768, 1838], "adjoint": [698, 1206, 1704, 1754], "adjust": [368, 369, 432, 635, 652, 1199, 1206, 1704, 1738, 1742, 1748, 1757, 1759, 1774, 1788, 1833, 1837, 1838], "admin": 1788, "administr": [1738, 1748, 1767, 1786], "admittedli": 1834, "adopt": 1757, "adv": 1781, "advanc": [608, 761, 774, 1097, 1206, 1209, 1220, 1229, 1688, 1704, 1714, 1734, 1738, 1754, 1755, 1759, 1775, 1781, 1782, 1790, 1810, 1832, 1838, 1842], "advantag": [2, 335, 356, 573, 647, 692, 1206, 1704, 1730, 1743, 1747, 1753, 1786, 1789, 1798, 1824, 1828, 1838, 1841], "adventur": 1803, "advertis": [2, 1785], "advic": [1738, 1757, 1810, 1838], "advis": [150, 660, 1206, 1230, 1480, 1704, 1748, 1755, 1757, 1788, 1832, 1837, 1838], "advisor": [1738, 1748, 1788], "advoc": 1757, "adz": 1733, "ae": [1761, 1809], "aedii": [1714, 1842], "aettig": 1734, "affect": [8, 661, 1206, 1224, 1240, 1704, 1736, 1740, 1753, 1756, 1763, 1767, 1770, 1817, 1837, 1844], "affin": [895, 1211, 1225, 1258, 1261, 1704, 1757, 1781, 1805], "affirm": [1795, 1796], "afford": [1742, 1824], "afirst": 106, "aforement": 1802, "after": [0, 2, 63, 84, 86, 87, 106, 138, 279, 295, 300, 301, 302, 318, 319, 384, 471, 559, 570, 605, 614, 640, 701, 838, 986, 989, 999, 1188, 1189, 1190, 1191, 1200, 1204, 1206, 1210, 1215, 1222, 1226, 1229, 1231, 1361, 1426, 1498, 1619, 1649, 1692, 1704, 1711, 1714, 1730, 1735, 1736, 1743, 1746, 1747, 1750, 1752, 1753, 1757, 1759, 1766, 1767, 1770, 1771, 1772, 1774, 1775, 1781, 1785, 1788, 1792, 1799, 1800, 1801, 1808, 1810, 1817, 1828, 1832, 1837, 1838, 1842, 1843, 1844], "ag": [993, 1215, 1704, 1707, 1731, 1746, 1834], "again": [283, 333, 1738, 1756, 1767, 1770, 1785, 1794, 1801, 1809, 1828, 1837, 1838, 1844], "against": [2, 100, 285, 286, 287, 336, 337, 338, 383, 392, 1714, 1718, 1722, 1726, 1738, 1746, 1748, 1757, 1762, 1765, 1767, 1773, 1775, 1782, 1783, 1784, 1785, 1801, 1808, 1824, 1832, 1839, 1842], "aggreg": 1740, "aggress": [1743, 1757, 1838], "agre": [1748, 1804], "agreement": [1735, 1743, 1804, 1828, 1844], "ah": [843, 856, 857, 1210, 1704, 1789], "ahcc1": 1833, "ahcc2": 1833, "ahcc3": 1833, "ahead": [1738, 1788], "ahlrich": [1707, 1731, 1734], "ahoh": 1832, "ahold": 1738, "ai": 1841, "aid": [296, 928, 1184, 1213, 1222, 1704, 1769, 1786, 1817], "aida": 1734, "aim": [2, 1770, 1799, 1828], "aimqc": [1734, 1802], "aindex": 98, "aio_cphf": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "aio_df_int": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "aj": 1706, "ak": 1708, "aka": [1714, 1777, 1781, 1834, 1842], "akin": [2, 1776, 1788], "al": [1, 786, 885, 1126, 1210, 1221, 1225, 1271, 1692, 1704, 1707, 1714, 1731, 1734, 1752, 1754, 1763, 1802, 1805, 1806, 1837, 1841, 1842], "alanin": [1714, 1833, 1842], "alast": 106, "alejandro": 1734, "alenaizan": [1734, 1781], "alert": 1817, "alexand": [1753, 1802, 1829], "algebra": [0, 1, 295, 381, 382, 1197, 1668, 1738, 1766, 1777, 1812, 1824, 1826], "algerror": 1802, "algo": [1231, 1576, 1704], "algorithm": [0, 1, 2, 106, 268, 342, 356, 411, 428, 430, 465, 473, 491, 496, 499, 500, 510, 512, 513, 535, 557, 568, 570, 575, 609, 615, 623, 627, 641, 647, 655, 727, 732, 739, 742, 746, 750, 843, 876, 935, 944, 946, 947, 961, 964, 1049, 1095, 1106, 1107, 1146, 1147, 1166, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1206, 1213, 1214, 1218, 1219, 1221, 1225, 1227, 1229, 1230, 1279, 1281, 1282, 1296, 1375, 1429, 1443, 1497, 1505, 1552, 1572, 1620, 1704, 1714, 1727, 1730, 1733, 1735, 1740, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1754, 1755, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1790, 1791, 1792, 1794, 1795, 1797, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1839, 1840, 1841, 1842, 1843, 1844], "alia": [2, 80, 106, 267, 1714, 1733, 1740, 1751, 1757, 1759, 1768, 1772, 1777, 1788, 1842], "alias": [284, 300, 301, 302, 318, 319, 381, 382, 1752, 1759, 1772, 1788, 1800, 1826, 1831, 1834, 1844], "align": [106, 1714, 1743, 1750, 1776, 1833, 1838, 1842], "alignmentmil": 106, "alik": [1759, 1781, 1838], "alkali": [1714, 1837, 1842], "alkan": [1692, 1752, 1763], "alken": [1692, 1752], "all": [0, 2, 5, 8, 11, 13, 21, 64, 73, 86, 87, 96, 98, 100, 105, 106, 111, 112, 114, 138, 148, 150, 152, 171, 183, 184, 195, 196, 208, 224, 227, 230, 235, 239, 246, 255, 263, 265, 267, 268, 277, 284, 291, 295, 296, 300, 301, 302, 314, 317, 318, 319, 326, 330, 331, 341, 342, 346, 352, 356, 359, 365, 370, 383, 384, 388, 400, 418, 433, 454, 466, 476, 507, 514, 526, 551, 568, 570, 574, 575, 581, 582, 586, 608, 609, 615, 616, 625, 626, 627, 641, 646, 657, 665, 703, 795, 811, 828, 852, 874, 921, 922, 1097, 1101, 1108, 1111, 1145, 1198, 1199, 1200, 1201, 1202, 1203, 1206, 1210, 1213, 1220, 1221, 1224, 1225, 1226, 1228, 1229, 1230, 1231, 1235, 1236, 1242, 1279, 1315, 1316, 1317, 1333, 1341, 1355, 1379, 1380, 1411, 1426, 1441, 1454, 1455, 1459, 1460, 1461, 1464, 1465, 1466, 1591, 1641, 1704, 1708, 1711, 1714, 1715, 1722, 1727, 1730, 1735, 1738, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1753, 1754, 1755, 1756, 1757, 1759, 1762, 1763, 1764, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1775, 1777, 1779, 1781, 1782, 1785, 1786, 1788, 1789, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1802, 1803, 1808, 1809, 1810, 1812, 1817, 1823, 1828, 1829, 1832, 1833, 1834, 1835, 1837, 1838, 1840, 1841, 1842, 1844], "allclos": [2, 383], "allen": [1714, 1734, 1740, 1743, 1781, 1842], "allen_focal_point": 1740, "allnormco": 384, "alloc": [138, 305, 353, 374, 395, 714, 1207, 1231, 1618, 1624, 1704, 1810, 1821, 1838], "allof": [265, 1740, 1794], "allow": [2, 106, 265, 267, 284, 296, 595, 601, 621, 625, 633, 634, 648, 668, 671, 692, 699, 708, 709, 711, 712, 794, 819, 859, 860, 881, 890, 1206, 1210, 1226, 1229, 1230, 1231, 1302, 1312, 1426, 1444, 1602, 1620, 1704, 1714, 1738, 1740, 1743, 1749, 1754, 1755, 1756, 1757, 1759, 1768, 1769, 1770, 1771, 1772, 1779, 1781, 1782, 1783, 1785, 1788, 1794, 1798, 1802, 1803, 1804, 1805, 1808, 1810, 1817, 1824, 1828, 1829, 1831, 1832, 1833, 1835, 1837, 1838, 1842, 1844], "allterm": [1714, 1842], "allvib": 384, "alml": 1781, "almlof": [1734, 1802], "almost": [1786, 1802, 1810, 1821, 1824, 1838], "alogrithm": [745, 749, 1208, 1704], "alon": [2, 1231, 1615, 1704, 1730, 1767, 1785, 1833], "along": [0, 2, 265, 390, 603, 608, 1206, 1226, 1231, 1340, 1343, 1556, 1704, 1708, 1738, 1740, 1742, 1743, 1746, 1750, 1768, 1775, 1776, 1779, 1781, 1782, 1794, 1798, 1802, 1808, 1810, 1828, 1832, 1833, 1834, 1838, 1844], "alongsid": [2, 1738, 1746, 1748, 1749, 1759, 1762, 1765, 1773, 1774, 1775, 1782, 1783, 1784, 1803, 1806, 1807, 1808, 1832, 1838, 1839], "alp": 1759, "alpha": [0, 11, 13, 80, 84, 92, 98, 100, 138, 150, 284, 291, 314, 341, 400, 660, 664, 782, 789, 823, 824, 825, 827, 829, 1111, 1206, 1210, 1221, 1230, 1231, 1453, 1522, 1531, 1559, 1564, 1579, 1581, 1669, 1680, 1689, 1690, 1706, 1708, 1709, 1714, 1724, 1740, 1750, 1755, 1756, 1757, 1777, 1781, 1791, 1810, 1829, 1832, 1833, 1837, 1838, 1842], "alpha6": [68, 1759], "alpha_6": 1759, "alpha_corr_to_pitz": 90, "alpha_n": 1759, "alpha_orbital_spac": 150, "alpha_particle_electron_mass_ratio": 1706, "alpha_particle_mass": 1706, "alpha_particle_mass_energy_equival": 1706, "alpha_particle_mass_energy_equivalent_in_mev": 1706, "alpha_particle_mass_in_u": 1706, "alpha_particle_molar_mass": 1706, "alpha_particle_proton_mass_ratio": 1706, "alphabet": 1785, "alphamo": 1750, "alphast": [575, 1206, 1704], "alphastr": [827, 1210, 1704], "alreadi": [2, 61, 150, 225, 255, 1746, 1749, 1759, 1762, 1765, 1767, 1770, 1773, 1774, 1775, 1782, 1783, 1784, 1788, 1803, 1806, 1807, 1809, 1815, 1824, 1828, 1834, 1837, 1839, 1841, 1844], "also": [0, 2, 106, 150, 263, 267, 279, 284, 297, 335, 347, 359, 386, 392, 470, 574, 609, 662, 664, 665, 811, 823, 833, 993, 1168, 1200, 1206, 1210, 1215, 1221, 1226, 1230, 1231, 1324, 1451, 1463, 1626, 1629, 1634, 1658, 1704, 1708, 1710, 1714, 1726, 1730, 1735, 1738, 1739, 1740, 1741, 1742, 1743, 1746, 1748, 1749, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1762, 1763, 1765, 1767, 1770, 1771, 1773, 1774, 1775, 1776, 1779, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1795, 1798, 1801, 1802, 1803, 1807, 1808, 1809, 1810, 1817, 1821, 1823, 1824, 1828, 1832, 1833, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1844], "alt": [1707, 1714, 1731, 1842], "altair": 1841, "alter": [327, 671, 1206, 1704, 1754, 1786], "altern": [0, 106, 299, 318, 319, 349, 625, 627, 670, 1206, 1704, 1738, 1742, 1748, 1755, 1756, 1757, 1763, 1767, 1771, 1777, 1785, 1789, 1790, 1799, 1800, 1802, 1804, 1832, 1833, 1835, 1836, 1837, 1838, 1839], "although": [647, 1206, 1704, 1743, 1782, 1798, 1802, 1810, 1817, 1824, 1828, 1833, 1838, 1844], "altogeth": [1770, 1802, 1838], "alwai": [2, 13, 259, 267, 284, 443, 479, 519, 543, 586, 592, 596, 603, 620, 650, 705, 1199, 1200, 1202, 1203, 1206, 1704, 1730, 1738, 1740, 1743, 1748, 1756, 1767, 1779, 1782, 1786, 1788, 1794, 1797, 1799, 1801, 1802, 1809, 1810, 1821, 1824, 1837, 1838, 1840], "am": [18, 81, 310, 361, 1714, 1734, 1738, 1783, 1788, 1817, 1839, 1842], "am7": 1738, "am8": 1738, "amaz": 1786, "amazonaw": 1735, "ambigu": [296, 1730, 1757, 1769, 1770], "ambit": 1738, "ambiti": 1831, "amchar": 81, "amelior": 1838, "amen": 1838, "american": 1734, "ammet": [1734, 1838], "ammonia": [1714, 1722, 1842], "among": [11, 106, 299, 349, 1231, 1232, 1655, 1666, 1704, 1714, 1737, 1738, 1740, 1757, 1770, 1785, 1789, 1794, 1795, 1809, 1829, 1832, 1841, 1842, 1843], "amount": [8, 106, 138, 198, 342, 356, 412, 568, 608, 644, 650, 651, 667, 716, 720, 729, 882, 1021, 1034, 1118, 1153, 1198, 1206, 1207, 1208, 1210, 1216, 1218, 1221, 1229, 1230, 1231, 1405, 1463, 1499, 1608, 1704, 1742, 1750, 1757, 1759, 1763, 1767, 1774, 1801, 1817, 1832, 1837, 1838, 1844], "amp": [11, 1726, 1785], "amplitud": [0, 1, 2, 11, 75, 401, 429, 432, 433, 448, 452, 455, 457, 466, 481, 487, 507, 509, 514, 520, 525, 529, 530, 536, 544, 548, 549, 554, 575, 582, 585, 659, 699, 700, 792, 793, 794, 799, 868, 911, 912, 913, 914, 935, 953, 966, 1086, 1197, 1199, 1200, 1201, 1202, 1203, 1206, 1210, 1213, 1214, 1219, 1225, 1229, 1230, 1242, 1243, 1287, 1405, 1416, 1419, 1424, 1434, 1440, 1459, 1461, 1704, 1708, 1714, 1721, 1726, 1742, 1756, 1763, 1771, 1785, 1798, 1837, 1842], "ampltud": [972, 1214, 1704], "amu": [618, 1206, 1226, 1348, 1704], "amu2g": 1706, "amu2kg": 1706, "an": [0, 2, 5, 8, 11, 13, 20, 74, 84, 89, 90, 91, 92, 100, 103, 106, 110, 115, 130, 132, 139, 148, 150, 216, 235, 236, 255, 262, 263, 266, 279, 284, 285, 310, 312, 314, 318, 319, 321, 329, 336, 342, 356, 361, 367, 374, 376, 395, 397, 568, 569, 574, 575, 577, 593, 608, 609, 614, 622, 625, 637, 642, 656, 660, 669, 670, 671, 672, 676, 679, 690, 694, 696, 704, 709, 711, 712, 731, 765, 774, 819, 828, 855, 863, 874, 1002, 1006, 1007, 1038, 1065, 1099, 1100, 1102, 1123, 1125, 1126, 1127, 1128, 1159, 1160, 1161, 1162, 1164, 1165, 1168, 1206, 1208, 1209, 1210, 1215, 1218, 1219, 1220, 1221, 1225, 1226, 1229, 1230, 1231, 1245, 1246, 1247, 1253, 1254, 1255, 1265, 1272, 1273, 1274, 1275, 1296, 1340, 1343, 1356, 1421, 1422, 1435, 1436, 1508, 1516, 1553, 1583, 1586, 1606, 1619, 1655, 1704, 1708, 1714, 1722, 1726, 1730, 1733, 1734, 1736, 1737, 1738, 1740, 1741, 1742, 1743, 1746, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1761, 1762, 1763, 1764, 1765, 1767, 1770, 1771, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1781, 1782, 1783, 1784, 1787, 1788, 1789, 1791, 1792, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1808, 1809, 1810, 1814, 1816, 1817, 1821, 1824, 1825, 1828, 1829, 1831, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843], "ana": [1736, 1738, 1767], "anaconda": [1736, 1737, 1746, 1748, 1749, 1759, 1762, 1764, 1765, 1767, 1773, 1774, 1775, 1782, 1783, 1784, 1788, 1803, 1806, 1807, 1839], "analog": [356, 525, 549, 868, 1202, 1203, 1210, 1226, 1231, 1357, 1358, 1359, 1360, 1506, 1604, 1605, 1704, 1714, 1738, 1739, 1743, 1748, 1753, 1755, 1809, 1832, 1842], "analogi": 1788, "analogu": 1838, "analys": [303, 1217, 1226, 1770, 1775, 1837, 1843], "analysi": [0, 76, 84, 150, 259, 267, 303, 307, 318, 319, 384, 386, 388, 389, 390, 399, 616, 640, 707, 753, 1038, 1040, 1206, 1208, 1218, 1220, 1230, 1231, 1232, 1638, 1639, 1640, 1641, 1642, 1649, 1665, 1666, 1667, 1681, 1689, 1704, 1714, 1719, 1735, 1738, 1740, 1759, 1776, 1777, 1778, 1780, 1781, 1788, 1790, 1794, 1800, 1806, 1822, 1831, 1837, 1840, 1842], "analyt": [265, 267, 300, 301, 302, 306, 307, 318, 319, 571, 596, 608, 610, 615, 665, 679, 707, 750, 1206, 1208, 1217, 1704, 1714, 1718, 1740, 1743, 1748, 1754, 1768, 1772, 1790, 1794, 1796, 1800, 1803, 1809, 1838, 1842], "analytic1": [1714, 1842], "analytic2": [1714, 1842], "analyz": [0, 1, 2, 399, 574, 1206, 1230, 1689, 1704, 1714, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1828, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "anchor": [292, 343, 373, 391], "andez": 1734, "andi": 1768, "andr": 1734, "andrew": [1753, 1761, 1765, 1769, 1775, 1782, 1792, 1799, 1803, 1829, 1838, 1841], "andysim": 386, "anew": 1747, "ang": [781, 1209, 1704, 1754, 1802, 1828, 1833, 1844], "angl": [100, 106, 855, 1188, 1210, 1222, 1226, 1228, 1307, 1309, 1311, 1315, 1318, 1320, 1322, 1357, 1358, 1360, 1396, 1704, 1706, 1714, 1742, 1750, 1759, 1782, 1789, 1802, 1828, 1832, 1833, 1838, 1842, 1844], "angstrom": [83, 106, 275, 705, 1099, 1100, 1206, 1220, 1704, 1706, 1743, 1761, 1768, 1775, 1782, 1802, 1803, 1828, 1833, 1835, 1837, 1844], "angstrom_star": 1706, "angstr\u00f6m": 1754, "angular": [2, 4, 8, 81, 89, 103, 285, 310, 336, 361, 377, 1157, 1221, 1704, 1710, 1714, 1730, 1733, 1736, 1754, 1767, 1783, 1810, 1817, 1842], "angularmomentumint": [1817, 1827], "anharmon": [571, 572, 574, 604, 1206, 1704, 1761, 1831], "ani": [0, 1, 2, 8, 84, 100, 106, 148, 150, 265, 266, 267, 277, 279, 284, 298, 308, 312, 314, 318, 319, 329, 342, 344, 348, 355, 358, 359, 371, 375, 376, 378, 394, 396, 397, 403, 599, 608, 664, 671, 795, 859, 860, 1070, 1088, 1124, 1126, 1197, 1199, 1206, 1210, 1219, 1221, 1226, 1230, 1324, 1464, 1465, 1466, 1669, 1704, 1714, 1730, 1735, 1738, 1740, 1743, 1748, 1751, 1752, 1755, 1757, 1759, 1760, 1761, 1763, 1764, 1767, 1770, 1771, 1772, 1776, 1781, 1782, 1785, 1786, 1788, 1791, 1792, 1794, 1798, 1799, 1800, 1801, 1802, 1808, 1809, 1817, 1823, 1824, 1828, 1832, 1833, 1835, 1837, 1838, 1840, 1842, 1843, 1844], "anilin": 1833, "anilino": 1833, "anim": [1828, 1844], "anion": [1714, 1730, 1733, 1757, 1768, 1838, 1842], "anion_mult": 1768, "annoi": [1738, 1764], "annot": [106, 139, 150, 1787, 1814], "announc": [1788, 1804], "annual": [1734, 1748, 1787, 1814, 1825], "ano": [1707, 1731, 1836], "ano0": [1707, 1731], "anom": 1788, "anomali": 1706, "anonym": [1228, 1393, 1704, 1749], "anoth": [2, 88, 100, 148, 150, 327, 671, 1206, 1704, 1730, 1738, 1748, 1755, 1757, 1763, 1767, 1770, 1774, 1785, 1789, 1798, 1801, 1802, 1804, 1810, 1832, 1833, 1836, 1837, 1838], "ansatz": [119, 138, 653, 1206, 1229, 1398, 1704, 1754, 1756, 1757, 1776, 1829, 1838], "answer": [2, 1714, 1781, 1801, 1816, 1829, 1837, 1842], "anthoni": [1220, 1681, 1775], "anthracen": [1692, 1752], "anti": [575, 1206, 1704], "antialia": 323, "antialias_threshold": 323, "anticip": [318, 319, 1781, 1787, 1800], "antisymmetr": [1753, 1756, 1776, 1837, 1838], "antoni": 1734, "anyof": [265, 1740, 1794], "anyon": [1786, 1804], "anyth": [644, 1206, 1704, 1737, 1743, 1781, 1809, 1833, 1835, 1838], "anytim": 1757, "anywai": [284, 662, 1206, 1704, 1740, 1821], "anywher": [1809, 1833], "ao": [8, 75, 89, 103, 115, 118, 147, 150, 314, 430, 568, 575, 577, 623, 657, 682, 727, 845, 858, 998, 1199, 1206, 1208, 1210, 1215, 1704, 1708, 1711, 1714, 1743, 1746, 1753, 1763, 1767, 1785, 1789, 1791, 1808, 1809, 1812, 1814, 1821, 1838, 1842], "ao_3center_deriv1": 103, "ao_3coverlap": 103, "ao_angular_momentum": [89, 103], "ao_basi": [0, 1, 2, 1704, 1714, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "ao_dipol": [89, 103], "ao_dkh": 103, "ao_efp_multipole_potenti": 103, "ao_elec_dip_deriv1": 103, "ao_erf_eri": 103, "ao_eri": 103, "ao_eri_shel": 103, "ao_f12": 103, "ao_f12_double_commut": 103, "ao_f12_squar": 103, "ao_f12g12": 103, "ao_kinet": [89, 103], "ao_metric_deriv1": 103, "ao_multipol": [89, 103], "ao_multipole_potenti": [89, 103], "ao_nabla": [89, 103], "ao_oei_deriv1": 103, "ao_oei_deriv2": 103, "ao_overlap": [89, 103], "ao_overlap_half_deriv1": 103, "ao_potenti": [89, 103], "ao_potential_erf": 103, "ao_potential_erf_compl": 103, "ao_pvp": 103, "ao_quadrupol": [89, 103], "ao_tei_deriv1": 103, "ao_tei_deriv2": 103, "ao_to_shel": 8, "ao_traceless_quadrupol": [89, 103], "aobasi": [444, 482, 568, 1199, 1200, 1206, 1704, 1711, 1743], "aointegr": 1808, "aorb": 98, "aoshellcombinationsiter": [89, 1827], "aotoso": [118, 150], "apart": [0, 574, 665, 1206, 1704], "apbw": [1229, 1398, 1704], "apdx": 1764, "apecifi": 1711, "api": [2, 106, 329, 1710, 1714, 1726, 1759, 1777, 1788, 1828, 1831, 1832, 1842], "app": [300, 301, 302, 719, 1207, 1704, 1748, 1772, 1788, 1808], "appar": 1801, "appeal": 1838, "appear": [2, 5, 1730, 1738, 1742, 1743, 1756, 1764, 1770, 1776, 1788, 1798, 1799, 1832, 1833, 1837, 1841], "append": [2, 5, 8, 73, 100, 111, 252, 284, 388, 1226, 1304, 1324, 1704, 1730, 1738, 1740, 1741, 1743, 1752, 1757, 1759, 1767, 1768, 1776, 1785, 1801, 1802, 1832, 1833, 1835, 1837], "appendcharg": 73, "appendic": [1742, 1764, 1777, 1781], "appendix": [0, 1730, 1733, 1742, 1755, 1756, 1764, 1790, 1792, 1802, 1829, 1832, 1843], "appl": [1738, 1781], "appleclang": [1738, 1808], "appli": [0, 2, 100, 106, 148, 267, 283, 284, 295, 300, 301, 302, 318, 319, 329, 331, 333, 350, 381, 382, 387, 472, 481, 520, 544, 592, 605, 608, 628, 629, 630, 631, 687, 729, 738, 744, 759, 855, 919, 920, 1200, 1202, 1203, 1206, 1208, 1210, 1213, 1225, 1229, 1230, 1231, 1252, 1405, 1427, 1442, 1499, 1571, 1588, 1704, 1714, 1730, 1740, 1743, 1752, 1757, 1759, 1761, 1766, 1772, 1777, 1788, 1789, 1794, 1797, 1798, 1800, 1817, 1826, 1832, 1833, 1835, 1837, 1838, 1841, 1842], "applic": [2, 573, 679, 1206, 1704, 1734, 1737, 1743, 1753, 1759, 1767, 1768, 1770, 1774, 1781, 1833, 1838], "apply_denomin": 100, "apport": [1809, 1835], "apportion": 1795, "appreci": [1781, 1810, 1817], "approach": [0, 377, 430, 575, 584, 608, 613, 615, 623, 662, 677, 694, 874, 1101, 1199, 1206, 1210, 1220, 1231, 1532, 1704, 1734, 1742, 1747, 1754, 1755, 1756, 1757, 1761, 1763, 1775, 1781, 1789, 1802, 1803, 1805, 1819, 1824, 1828, 1829, 1833, 1836, 1837, 1838, 1841], "appropri": [0, 103, 284, 577, 599, 601, 708, 730, 823, 1125, 1206, 1208, 1210, 1221, 1704, 1730, 1733, 1738, 1740, 1743, 1755, 1757, 1762, 1767, 1769, 1771, 1775, 1781, 1785, 1788, 1794, 1798, 1815, 1817, 1823, 1824, 1828, 1833, 1837, 1838, 1844], "approv": [1736, 1767, 1786, 1804], "approx": 1763, "approx_diag": [926, 1213, 1704, 1798], "approx_diag_ekt": [926, 1213, 1704, 1798], "approx_diag_hf": [926, 1213, 1704, 1798], "approx_solv": 133, "approxim": [0, 295, 299, 318, 319, 329, 342, 349, 356, 381, 382, 470, 608, 635, 651, 652, 662, 679, 835, 874, 985, 1132, 1200, 1206, 1210, 1214, 1221, 1225, 1230, 1231, 1279, 1444, 1448, 1449, 1450, 1459, 1461, 1470, 1656, 1704, 1714, 1730, 1733, 1742, 1743, 1744, 1745, 1749, 1753, 1754, 1755, 1756, 1757, 1759, 1763, 1766, 1776, 1781, 1789, 1790, 1792, 1793, 1798, 1800, 1801, 1803, 1826, 1829, 1838, 1841, 1842], "apr": [1694, 1707, 1731, 1732, 1733], "april": [1738, 1770, 1786], "aqcc": [284, 295, 1078, 1219, 1680, 1704, 1739, 1740, 1766, 1771, 1776, 1781], "aqz": 1733, "ar": [0, 2, 11, 13, 84, 92, 106, 112, 115, 150, 247, 255, 262, 263, 265, 268, 269, 277, 284, 285, 287, 296, 300, 301, 302, 304, 314, 318, 319, 321, 329, 336, 338, 342, 346, 351, 352, 356, 370, 371, 376, 377, 381, 382, 383, 385, 388, 397, 399, 402, 415, 430, 440, 448, 454, 476, 490, 539, 550, 551, 568, 569, 572, 574, 575, 577, 579, 582, 586, 592, 593, 594, 596, 597, 599, 600, 601, 602, 603, 605, 608, 609, 610, 613, 614, 615, 616, 617, 621, 623, 625, 626, 635, 636, 637, 638, 639, 640, 641, 645, 650, 652, 656, 657, 660, 662, 664, 665, 671, 672, 674, 675, 677, 682, 684, 691, 692, 695, 696, 699, 700, 703, 704, 707, 708, 710, 726, 740, 746, 761, 774, 777, 794, 804, 811, 823, 828, 830, 833, 838, 852, 859, 860, 874, 883, 905, 935, 986, 989, 1041, 1053, 1078, 1079, 1086, 1100, 1108, 1111, 1124, 1125, 1127, 1128, 1156, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1206, 1208, 1209, 1210, 1212, 1213, 1215, 1217, 1218, 1219, 1220, 1221, 1223, 1224, 1226, 1228, 1230, 1231, 1234, 1235, 1241, 1313, 1331, 1332, 1339, 1341, 1352, 1362, 1379, 1380, 1381, 1441, 1443, 1445, 1455, 1462, 1463, 1464, 1465, 1466, 1490, 1520, 1521, 1563, 1569, 1591, 1602, 1612, 1658, 1690, 1692, 1704, 1707, 1708, 1710, 1711, 1714, 1726, 1730, 1731, 1733, 1735, 1736, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1763, 1764, 1767, 1768, 1769, 1770, 1771, 1772, 1774, 1775, 1776, 1779, 1781, 1782, 1785, 1786, 1788, 1789, 1790, 1791, 1792, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1808, 1809, 1810, 1813, 1815, 1817, 1821, 1822, 1823, 1824, 1826, 1828, 1829, 1832, 1833, 1834, 1835, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "arar": [1692, 1752], "araya": [1734, 1750], "arbitrari": [2, 89, 100, 107, 295, 317, 334, 365, 577, 1099, 1206, 1210, 1220, 1673, 1704, 1714, 1730, 1738, 1739, 1760, 1766, 1775, 1781, 1790, 1794, 1799, 1817, 1834, 1838, 1842], "arbitrarili": [1753, 1831, 1832], "arch": 1738, "architectur": [575, 1206, 1704, 1737, 1748, 1767, 1781, 1788, 1821, 1840], "archiv": [1781, 1788], "area": [318, 319, 1743, 1747, 1757, 1767, 1786, 1800, 1803, 1804, 1832], "aren": [367, 1738, 1764, 1780], "arg": [2, 5, 8, 13, 20, 27, 29, 64, 88, 90, 92, 96, 100, 101, 103, 106, 114, 119, 147, 148, 246, 248, 252, 317, 334, 346, 365, 381, 382, 1738, 1748, 1799], "arg0": [6, 7, 8, 12, 13, 14, 17, 18, 20, 22, 23, 24, 25, 26, 27, 29, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 64, 68, 70, 73, 75, 76, 78, 80, 81, 84, 85, 86, 88, 89, 90, 91, 92, 96, 97, 100, 101, 103, 105, 106, 108, 110, 111, 112, 114, 118, 119, 128, 130, 131, 133, 138, 139, 141, 143, 144, 145, 147, 148, 149, 150, 180, 183, 184, 215, 216, 217, 220, 222, 223, 225, 229, 232, 240, 252], "arg1": [8, 12, 13, 20, 22, 23, 24, 25, 27, 29, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 64, 75, 76, 80, 84, 85, 86, 92, 97, 100, 103, 105, 106, 112, 114, 119, 128, 131, 133, 138, 139, 141, 143, 144, 147, 149, 150, 183, 184, 216, 217, 222, 240], "arg10": [31, 32, 33, 34, 44, 48, 49, 52, 53, 54, 57, 59], "arg11": [31, 32, 33, 34, 44, 48, 52, 57, 59], "arg12": [31, 32, 33, 48, 52], "arg13": [31, 32, 33], "arg2": [8, 12, 13, 22, 23, 24, 25, 27, 29, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 75, 76, 80, 84, 85, 92, 97, 103, 106, 114, 128, 133, 138, 139, 141, 143, 144, 147, 149, 150, 240], "arg3": [12, 13, 22, 23, 24, 25, 27, 29, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 80, 84, 85, 92, 103, 128, 133, 138, 143, 144, 150, 240], "arg4": [12, 13, 23, 24, 25, 31, 32, 33, 34, 35, 36, 37, 38, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 133, 138, 240], "arg5": [12, 13, 23, 24, 25, 31, 32, 33, 34, 35, 36, 37, 38, 42, 43, 44, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 138], "arg6": [23, 31, 32, 33, 34, 35, 37, 38, 42, 43, 44, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 138], "arg7": [31, 32, 33, 34, 35, 38, 42, 43, 44, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60], "arg8": [31, 32, 33, 34, 35, 38, 44, 47, 48, 49, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60], "arg9": [31, 32, 33, 34, 35, 44, 48, 49, 51, 52, 53, 54, 55, 56, 57, 59], "argo": [643, 1206, 1704], "argon": [1692, 1714, 1752, 1842], "argument": [0, 2, 8, 100, 103, 115, 150, 284, 295, 300, 301, 302, 312, 314, 318, 319, 329, 378, 381, 382, 581, 586, 662, 696, 1206, 1704, 1738, 1740, 1742, 1743, 1748, 1750, 1752, 1757, 1766, 1767, 1768, 1772, 1775, 1779, 1785, 1788, 1791, 1794, 1795, 1796, 1799, 1800, 1801, 1802, 1809, 1810, 1817, 1822, 1826, 1828, 1832, 1838, 1840], "aris": [1743, 1759, 1782, 1798, 1802, 1837], "arkr": [1692, 1752], "arm": 1802, "arm64": 1788, "arn": 1752, "aromat": 1770, "around": [84, 106, 247, 729, 1208, 1229, 1231, 1405, 1499, 1704, 1714, 1743, 1748, 1754, 1757, 1764, 1786, 1788, 1797, 1810, 1825, 1828, 1832, 1838, 1842, 1844], "arr": [100, 148, 331, 1797], "arrai": [0, 1, 2, 92, 98, 100, 106, 114, 147, 148, 150, 176, 212, 246, 248, 255, 262, 263, 275, 284, 300, 301, 302, 306, 307, 310, 321, 331, 334, 361, 367, 377, 387, 410, 422, 495, 531, 550, 569, 593, 601, 609, 616, 660, 670, 671, 715, 771, 783, 784, 794, 819, 824, 825, 827, 829, 855, 897, 1005, 1006, 1007, 1008, 1009, 1032, 1033, 1050, 1057, 1065, 1099, 1100, 1102, 1108, 1111, 1112, 1115, 1116, 1123, 1126, 1127, 1128, 1155, 1156, 1159, 1160, 1161, 1162, 1164, 1165, 1168, 1177, 1192, 1197, 1198, 1200, 1202, 1203, 1206, 1207, 1209, 1210, 1211, 1215, 1218, 1219, 1220, 1221, 1222, 1226, 1231, 1314, 1521, 1551, 1559, 1562, 1579, 1581, 1582, 1586, 1595, 1619, 1642, 1655, 1657, 1669, 1680, 1685, 1690, 1704, 1714, 1740, 1742, 1743, 1746, 1750, 1752, 1754, 1755, 1761, 1772, 1775, 1776, 1780, 1785, 1788, 1789, 1794, 1799, 1800, 1801, 1810, 1817, 1829, 1832, 1833, 1835, 1837, 1838, 1840, 1841, 1842, 1844], "arrang": [1124, 1221, 1704, 1730, 1733, 1785, 1802, 1835], "array_equ": 2, "array_interfac": [100, 148], "array_to_matrix": 1797, "array_vari": 150, "arraytyp": 1801, "arriv": 356, "art": [1770, 1781], "articl": [1692, 1752, 1781], "artifact": 1788, "artifactu": 1798, "arvo": 106, "asadchev": 1734, "asarrai": [318, 319, 1797, 1800], "ascend": [63, 100, 601, 1206, 1704], "ascii": [100, 1708, 1768, 1770, 1787, 1814], "asdf": 278, "ask": [1755, 1781, 1786, 1788, 1810, 1817, 1835], "aspect": [0, 672, 1206, 1232, 1666, 1704, 1763, 1843], "aspir": [1714, 1842], "assembl": [1201, 1739, 1740, 1772, 1787, 1794, 1835], "assemble_nbody_compon": 1794, "assert": [2, 1788], "assess": [84, 145, 1781], "assidu": 1759, "assign": [2, 1226, 1303, 1341, 1704, 1711, 1714, 1726, 1730, 1759, 1770, 1781, 1788, 1801, 1817, 1832, 1838, 1842], "assist": [321, 1757, 1828, 1838], "associ": [2, 8, 21, 103, 200, 283, 329, 333, 352, 356, 574, 582, 645, 681, 1206, 1704, 1730, 1742, 1743, 1757, 1764, 1767, 1768, 1776, 1781, 1795, 1799, 1801, 1809, 1828, 1831, 1838], "assum": [84, 100, 288, 289, 314, 329, 339, 340, 368, 369, 457, 550, 575, 660, 665, 883, 1124, 1199, 1203, 1206, 1210, 1221, 1704, 1730, 1742, 1755, 1757, 1767, 1791, 1802, 1817, 1832, 1833, 1837, 1838, 1841], "assume_socc_alpha": 150, "assur": 1832, "asymmetr": [295, 573, 1206, 1232, 1666, 1704, 1714, 1730, 1766, 1776, 1781, 1792, 1793, 1798, 1833, 1838, 1842, 1843], "asymptot": [1231, 1522, 1523, 1524, 1525, 1526, 1704, 1714, 1757, 1763, 1837, 1842], "asynchron": [1230, 1435, 1436, 1704, 1837], "asyncron": [1714, 1842], "atg0": 106, "atla": 1738, "atm": 1759, "atmgr": 1759, "atmospher": 1706, "atol": [2, 278, 285, 287, 336, 338], "atol_expon": [2, 285, 287, 336, 338], "atom": [8, 9, 81, 84, 100, 103, 106, 132, 134, 150, 262, 263, 265, 267, 318, 319, 323, 352, 368, 369, 377, 386, 388, 389, 390, 399, 550, 575, 614, 628, 629, 630, 631, 636, 705, 771, 983, 1061, 1098, 1100, 1125, 1126, 1203, 1206, 1209, 1214, 1218, 1220, 1221, 1226, 1228, 1231, 1298, 1307, 1308, 1309, 1310, 1311, 1314, 1318, 1319, 1320, 1321, 1322, 1335, 1336, 1339, 1349, 1351, 1357, 1358, 1359, 1360, 1364, 1365, 1382, 1383, 1518, 1586, 1607, 1609, 1610, 1685, 1692, 1704, 1706, 1711, 1714, 1721, 1724, 1726, 1730, 1734, 1738, 1742, 1743, 1749, 1750, 1752, 1753, 1754, 1756, 1757, 1759, 1768, 1770, 1771, 1775, 1776, 1781, 1782, 1785, 1786, 1788, 1791, 1794, 1799, 1800, 1802, 1806, 1810, 1828, 1832, 1835, 1837, 1838, 1841, 1842, 1844], "atom1": [103, 106, 1050, 1218, 1704], "atom2": [103, 1050, 1218, 1704], "atom_at_posit": 106, "atom_format": 106, "atom_lbl": 389, "atom_symbol": 388, "atomic_block": 105, "atomic_mass_const": 1706, "atomic_mass_constant_energy_equival": 1706, "atomic_mass_constant_energy_equivalent_in_mev": 1706, "atomic_mass_unit_electron_volt_relationship": 1706, "atomic_mass_unit_hartree_relationship": 1706, "atomic_mass_unit_hertz_relationship": 1706, "atomic_mass_unit_inverse_meter_relationship": 1706, "atomic_mass_unit_joule_relationship": 1706, "atomic_mass_unit_kelvin_relationship": 1706, "atomic_mass_unit_kilogram_relationship": 1706, "atomic_point_charg": 150, "atomic_unit_of_1st_hyperpolariz": 1706, "atomic_unit_of_2nd_hyperpolariz": 1706, "atomic_unit_of_act": 1706, "atomic_unit_of_charg": 1706, "atomic_unit_of_charge_dens": 1706, "atomic_unit_of_curr": 1706, "atomic_unit_of_electric_dipole_mom": 1706, "atomic_unit_of_electric_field": 1706, "atomic_unit_of_electric_field_gradi": 1706, "atomic_unit_of_electric_polariz": 1706, "atomic_unit_of_electric_potenti": 1706, "atomic_unit_of_electric_quadrupole_mom": 1706, "atomic_unit_of_energi": 1706, "atomic_unit_of_forc": 1706, "atomic_unit_of_length": 1706, "atomic_unit_of_mag_dipole_mom": 1706, "atomic_unit_of_mag_flux_dens": 1706, "atomic_unit_of_magnetiz": 1706, "atomic_unit_of_mass": 1706, "atomic_unit_of_momum": 1706, "atomic_unit_of_permitt": 1706, "atomic_unit_of_tim": 1706, "atomic_unit_of_veloc": 1706, "atomiccomput": [1740, 1768, 1772, 1794, 1827], "atomicinput": [265, 378], "atomicresult": [265, 367, 1740, 1772, 1794], "atomicresultprotocol": [265, 1740, 1794], "atommap": 106, "atoms_map": 106, "atop": [284, 1740, 1743, 1776], "attach": [267, 613, 1206, 1704, 1743, 1759, 1767], "attain": [1125, 1221, 1704, 1771, 1837], "attempt": [433, 466, 507, 514, 609, 1182, 1199, 1200, 1201, 1202, 1206, 1222, 1225, 1231, 1242, 1575, 1649, 1704, 1730, 1742, 1755, 1781, 1802, 1833, 1837, 1838], "attempt_number_": 84, "attent": [2, 313, 364, 1738, 1804, 1808], "attenu": [103, 1817], "attojoul": 1706, "attr": 355, "attract": [89, 1757, 1759, 1828, 1836, 1838, 1844], "attribut": [0, 3, 12, 62, 63, 64, 79, 81, 82, 83, 84, 88, 97, 100, 111, 112, 113, 122, 126, 134, 135, 148, 150, 235, 236, 247, 314, 323, 355, 1767, 1791, 1797, 1838], "atz": 1733, "au": [377, 550, 993, 1023, 1098, 1203, 1215, 1217, 1220, 1226, 1228, 1231, 1331, 1332, 1344, 1345, 1383, 1516, 1704, 1707, 1714, 1731, 1740, 1742, 1743, 1746, 1749, 1757, 1775, 1782, 1802, 1829, 1833, 1841, 1842], "au2amu": 1706, "aufbau": 1838, "aug": [284, 295, 318, 319, 1694, 1707, 1714, 1720, 1730, 1731, 1732, 1733, 1740, 1741, 1743, 1757, 1762, 1766, 1771, 1779, 1800, 1828, 1832, 1837, 1838, 1842, 1844], "augment": [329, 356, 752, 843, 1208, 1210, 1704, 1730, 1733, 1757, 1782, 1789, 1810, 1841], "august": [1730, 1837], "austin": 1743, "auth": 1788, "author": [0, 1, 106, 1735, 1740, 1742, 1743, 1746, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1769, 1770, 1771, 1773, 1774, 1775, 1782, 1783, 1784, 1787, 1789, 1791, 1792, 1794, 1797, 1798, 1799, 1802, 1803, 1804, 1805, 1806, 1807, 1829, 1836, 1837, 1838, 1839, 1841, 1843], "auto": [2, 951, 961, 1213, 1231, 1563, 1601, 1620, 1704, 1711, 1714, 1738, 1740, 1764, 1786, 1788, 1794, 1814, 1817, 1819, 1838, 1842], "auto_frag": [1768, 1777, 1833], "autoab": [1707, 1731], "autoaux": [1694, 1707, 1731, 1732], "autodoc": 1764, "autogener": [284, 1740, 1788, 1840], "autom": [1743, 1747, 1781, 1835, 1840], "automat": [1, 2, 295, 318, 319, 434, 599, 658, 664, 665, 774, 881, 891, 921, 922, 1049, 1095, 1199, 1206, 1209, 1210, 1213, 1218, 1219, 1224, 1230, 1231, 1236, 1241, 1441, 1601, 1704, 1711, 1714, 1726, 1730, 1738, 1742, 1750, 1754, 1755, 1756, 1757, 1759, 1766, 1771, 1774, 1775, 1781, 1782, 1788, 1792, 1798, 1800, 1801, 1802, 1805, 1808, 1810, 1817, 1828, 1832, 1833, 1837, 1838, 1842, 1844], "aux": [92, 983, 1214, 1704, 1837], "aux_basi": 1837, "aux_nam": 103, "aux_overlap": 75, "auxiliari": [2, 8, 73, 75, 92, 150, 394, 400, 717, 733, 810, 892, 899, 963, 1103, 1207, 1208, 1210, 1211, 1212, 1214, 1221, 1230, 1231, 1445, 1446, 1502, 1704, 1711, 1714, 1726, 1730, 1756, 1757, 1763, 1770, 1771, 1776, 1777, 1817, 1828, 1836, 1837, 1838, 1842, 1844], "auxiliary_bond_factor": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "auxilliari": [1075, 1219, 1704, 1714, 1771, 1842], "avail": [1, 2, 8, 198, 250, 268, 269, 284, 285, 287, 300, 301, 302, 317, 318, 319, 336, 338, 346, 355, 365, 400, 401, 404, 406, 407, 474, 488, 521, 523, 545, 547, 577, 581, 586, 596, 597, 608, 610, 613, 615, 627, 635, 641, 652, 699, 701, 703, 739, 742, 769, 851, 862, 944, 1078, 1095, 1195, 1197, 1200, 1202, 1203, 1206, 1208, 1209, 1210, 1213, 1217, 1219, 1223, 1224, 1230, 1231, 1241, 1441, 1481, 1620, 1624, 1704, 1714, 1730, 1735, 1736, 1737, 1739, 1740, 1742, 1743, 1746, 1748, 1749, 1750, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1764, 1765, 1767, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1782, 1783, 1784, 1790, 1791, 1792, 1794, 1798, 1799, 1800, 1801, 1803, 1806, 1807, 1808, 1809, 1823, 1824, 1828, 1829, 1831, 1832, 1834, 1835, 1837, 1839, 1840, 1842, 1844], "availbl": 1832, "aval": [1832, 1838], "averag": [13, 100, 106, 295, 318, 319, 576, 783, 784, 835, 1004, 1041, 1171, 1172, 1179, 1180, 1206, 1210, 1215, 1218, 1222, 1229, 1231, 1411, 1610, 1673, 1704, 1714, 1746, 1755, 1766, 1770, 1771, 1776, 1785, 1798, 1800, 1834, 1837, 1838, 1842], "avg": [1673, 1776, 1785], "avg_stat": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "avg_weight": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "avogadro": 1706, "avogadro_const": 1706, "avoid": [329, 727, 993, 1208, 1215, 1231, 1568, 1704, 1714, 1730, 1737, 1738, 1743, 1746, 1747, 1748, 1750, 1753, 1755, 1757, 1767, 1771, 1785, 1798, 1802, 1817, 1819, 1821, 1835, 1837, 1838, 1842], "avx": 1839, "avxfma": 1839, "awai": [656, 1206, 1704, 1837, 1838], "awar": [614, 661, 1206, 1224, 1240, 1704, 1743, 1759, 1763, 1767, 1804], "awesom": 1810, "ax": [329, 335, 1226, 1339, 1704, 1802], "axi": [106, 139, 377, 1743, 1750, 1833, 1838], "axilrod": 1759, "axpbi": 148, "axpi": [12, 100, 148], "axpy_matrix": [183, 184], "ayala": 1734, "ayer": 1781, "azimuth": [323, 1231, 1590, 1704], "azur": [1786, 1788], "b": [11, 13, 75, 76, 100, 106, 138, 141, 148, 150, 182, 215, 259, 303, 314, 335, 356, 811, 993, 1126, 1210, 1215, 1221, 1226, 1230, 1231, 1336, 1369, 1370, 1474, 1519, 1539, 1582, 1669, 1679, 1683, 1704, 1707, 1708, 1710, 1714, 1731, 1734, 1738, 1742, 1746, 1748, 1755, 1756, 1757, 1759, 1760, 1763, 1767, 1770, 1774, 1775, 1776, 1777, 1780, 1781, 1786, 1788, 1791, 1792, 1801, 1802, 1810, 1817, 1828, 1833, 1836, 1837, 1838, 1841, 1842, 1844], "b0": [76, 1761, 1802], "b1": [993, 1215, 1704, 1714, 1746, 1750, 1802, 1842], "b1g": [993, 1215, 1704, 1746, 1829], "b1lyp": [295, 318, 319, 1695, 1697, 1698, 1700, 1703, 1758, 1766, 1800], "b1pw91": [295, 318, 319, 1695, 1698, 1700, 1703, 1758, 1766, 1800], "b1u": [993, 1215, 1704, 1746], "b1wc": [295, 318, 319, 1695, 1698, 1700, 1703, 1758, 1766, 1800], "b2": [300, 301, 302, 993, 1215, 1704, 1714, 1746, 1772, 1802, 1828, 1842, 1844], "b204199p": 1734, "b2g": [993, 1215, 1704, 1746], "b2gpplyp": [295, 1695, 1696, 1697, 1698, 1700, 1758, 1766], "b2plyp": [295, 1695, 1696, 1697, 1698, 1700, 1714, 1739, 1757, 1758, 1759, 1766, 1781, 1842], "b2pylp": [1714, 1842], "b2u": [993, 1215, 1704, 1746], "b3": [993, 1215, 1704, 1746], "b3g": [993, 1215, 1704, 1746], "b3lyp": [150, 265, 291, 295, 296, 306, 314, 318, 319, 341, 1695, 1697, 1698, 1700, 1701, 1703, 1710, 1714, 1724, 1739, 1740, 1750, 1757, 1758, 1759, 1760, 1766, 1768, 1769, 1781, 1791, 1794, 1798, 1800, 1842], "b3lyp3": [1714, 1842], "b3lyp5": [295, 318, 319, 1695, 1698, 1700, 1703, 1714, 1758, 1766, 1800, 1842], "b3p86": [295, 318, 319, 1695, 1697, 1698, 1700, 1703, 1758, 1766, 1800], "b3pw91": [295, 318, 319, 1695, 1697, 1698, 1700, 1703, 1758, 1766, 1800], "b3u": [993, 1215, 1704, 1746], "b5050lyp": [295, 318, 319, 1695, 1698, 1700, 1703, 1758, 1766, 1800], "b787": 106, "b822910d": 1781, "b864": 1734, "b86b95": [295, 318, 319, 1695, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "b86bpbe": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "b871": 1734, "b88": [295, 1695, 1698, 1700, 1701, 1758, 1766], "b88b95": [295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "b97": [295, 318, 319, 1695, 1697, 1698, 1699, 1700, 1703, 1714, 1718, 1757, 1758, 1766, 1774, 1781, 1800, 1842], "b973c": [295, 318, 319, 1695, 1698, 1699, 1703, 1718, 1734, 1758, 1766, 1774, 1800], "b97m": [295, 318, 319, 1695, 1697, 1698, 1702, 1703, 1758, 1766, 1800], "b97x": [295, 1695, 1698, 1700, 1701, 1758, 1766], "b_": [1763, 1833, 1837], "b_1": [829, 1210, 1704, 1714, 1833, 1842], "b_2": [829, 1210, 1704, 1833], "b_3": 1833, "b_g": 1833, "b_i": [829, 1210, 1704], "b_ras3_max": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "b_u": 1833, "ba": [92, 1707, 1731, 1763, 1771], "back": [84, 153, 318, 319, 835, 1210, 1226, 1306, 1704, 1730, 1737, 1738, 1743, 1746, 1748, 1762, 1765, 1767, 1773, 1775, 1782, 1783, 1784, 1788, 1797, 1800, 1803, 1810, 1828, 1835, 1838, 1839, 1844], "back_transform": 100, "backbon": [1692, 1752], "backend": [0, 1, 401, 404, 406, 407, 1197, 1704, 1781, 1817], "background": 1763, "background_color": 323, "backport": 1788, "backtick": 1788, "backtransform": [61, 100, 1817], "backtransform_dens": 90, "backtransform_tpdm_restrict": 90, "backtransform_tpdm_unrestrict": 90, "backward": [1226, 1302, 1346, 1704, 1802], "bad": [374, 395, 1737, 1738, 1748, 1767], "badg": 1788, "badger": 1743, "bake": [1738, 1767], "baker": [1692, 1752, 1802], "bakken": [1692, 1734, 1752, 1802], "balanc": [2, 1231, 1628, 1704, 1753, 1754, 1757, 1817, 1836], "band": [324, 1757], "banner": 1834, "bannwarth": 1734, "bar": [106, 426, 1198, 1704, 1706, 1753, 1759, 1788], "barlett": 1734, "barrier": [1692, 1752, 1835], "bartlett": [532, 540, 555, 584, 1202, 1203, 1206, 1229, 1427, 1704, 1734, 1755], "base": [0, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 26, 27, 28, 29, 30, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 177, 183, 184, 233, 267, 274, 275, 295, 318, 319, 321, 322, 323, 324, 325, 326, 327, 329, 430, 432, 434, 562, 568, 626, 635, 637, 653, 670, 672, 673, 683, 786, 794, 856, 857, 925, 1013, 1015, 1101, 1108, 1111, 1170, 1189, 1190, 1191, 1199, 1204, 1206, 1210, 1213, 1216, 1220, 1221, 1222, 1223, 1225, 1230, 1231, 1259, 1260, 1442, 1532, 1648, 1654, 1692, 1695, 1698, 1699, 1700, 1703, 1704, 1714, 1726, 1730, 1733, 1735, 1737, 1738, 1740, 1742, 1743, 1748, 1749, 1750, 1752, 1753, 1755, 1756, 1757, 1758, 1759, 1760, 1766, 1768, 1770, 1771, 1772, 1775, 1776, 1777, 1780, 1781, 1790, 1791, 1794, 1798, 1800, 1802, 1803, 1805, 1812, 1814, 1821, 1823, 1824, 1829, 1836, 1837, 1838, 1841, 1842], "basecomput": [1768, 1772, 1777, 1794, 1827], "basemodel": [2, 1827], "basenam": 16, "bash": [1737, 1738, 1748, 1767, 1781, 1786, 1788], "bash_profil": [1738, 1748, 1767], "bashrc": [1738, 1748, 1767], "basi": [0, 1, 2, 6, 8, 14, 21, 73, 81, 92, 103, 106, 112, 113, 115, 128, 130, 132, 134, 145, 147, 150, 265, 283, 284, 285, 286, 287, 291, 295, 296, 297, 298, 303, 314, 317, 318, 319, 326, 329, 333, 336, 337, 338, 341, 342, 347, 348, 352, 365, 376, 378, 386, 394, 397, 430, 575, 577, 590, 614, 623, 628, 647, 671, 691, 717, 727, 733, 810, 892, 899, 963, 967, 978, 979, 998, 1009, 1030, 1063, 1075, 1103, 1108, 1113, 1120, 1126, 1131, 1157, 1199, 1206, 1207, 1208, 1210, 1211, 1214, 1215, 1218, 1219, 1221, 1445, 1446, 1485, 1487, 1500, 1501, 1502, 1506, 1514, 1535, 1593, 1611, 1621, 1695, 1698, 1699, 1700, 1701, 1703, 1704, 1710, 1711, 1714, 1715, 1722, 1726, 1727, 1734, 1735, 1736, 1739, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1777, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1790, 1791, 1792, 1795, 1797, 1798, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1828, 1829, 1831, 1833, 1834, 1835, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "basic": [284, 1153, 1221, 1704, 1740, 1743, 1748, 1756, 1778, 1780, 1785, 1790, 1808, 1834], "basicmpi": [1231, 1634, 1704], "basis1": [112, 113], "basis2": [112, 113], "basis_funct": [1112, 1221, 1704, 1750], "basis_guess": [0, 1, 2, 295, 1500, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "basis_lo": [284, 1740], "basis_on_atom": 106, "basis_project": 150, "basis_relativist": [0, 1, 2, 8, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "basis_set": [1735, 1832], "basis_set_exchang": 1738, "basis_valu": 7, "basisext": 1827, "basisfamili": 1764, "basisfunct": [119, 1827], "basislistdun": 1764, "basislistoth": 1764, "basisnam": 8, "basisset": [6, 14, 21, 29, 73, 84, 92, 97, 103, 115, 128, 130, 131, 145, 147, 150, 295, 386, 1714, 1726, 1766, 1801, 1809, 1817, 1827, 1837, 1842], "basset": 1730, "bat": 1788, "batch": [1231, 1592, 1704, 1767, 1817], "bb": [13, 1708], "bb1k": [295, 318, 319, 1695, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "bbb": [1669, 1776], "bbuild": 1738, "bc": [259, 961, 1213, 1679, 1704, 1708, 1759, 1776, 1802], "bc8d7f5": 1788, "bcc": [731, 1208, 1704], "bccd": [284, 295, 1739, 1740, 1742, 1766, 1781], "bccd_maxit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "be_quiet": 1828, "bear": [1828, 1844], "beauti": 1828, "becaus": [2, 106, 314, 430, 609, 1199, 1206, 1704, 1714, 1730, 1738, 1743, 1748, 1753, 1755, 1756, 1757, 1763, 1776, 1786, 1791, 1798, 1802, 1817, 1822, 1823, 1824, 1828, 1832, 1833, 1838, 1842, 1844], "beck": [1231, 1528, 1534, 1704, 1757, 1759, 1837], "becom": [1224, 1233, 1235, 1236, 1237, 1238, 1239, 1241, 1704, 1743, 1757, 1798, 1802, 1833, 1838, 1844], "been": [0, 2, 84, 106, 150, 171, 200, 208, 209, 210, 212, 230, 263, 265, 284, 370, 399, 430, 568, 574, 612, 641, 642, 647, 697, 882, 1095, 1199, 1206, 1210, 1219, 1704, 1714, 1730, 1733, 1735, 1736, 1737, 1738, 1740, 1743, 1746, 1747, 1748, 1749, 1751, 1753, 1756, 1757, 1759, 1762, 1763, 1764, 1765, 1767, 1770, 1771, 1773, 1774, 1775, 1780, 1781, 1782, 1783, 1784, 1786, 1788, 1792, 1794, 1798, 1801, 1802, 1803, 1806, 1807, 1808, 1809, 1817, 1828, 1829, 1832, 1833, 1837, 1838, 1839, 1840, 1842, 1844], "beer": 1838, "befor": [0, 100, 106, 235, 236, 259, 327, 342, 356, 661, 793, 838, 1204, 1206, 1210, 1224, 1226, 1229, 1230, 1231, 1240, 1347, 1409, 1464, 1465, 1466, 1510, 1602, 1704, 1714, 1738, 1743, 1747, 1753, 1754, 1755, 1757, 1759, 1767, 1768, 1770, 1786, 1787, 1801, 1804, 1808, 1817, 1828, 1832, 1833, 1835, 1837, 1838, 1842, 1844], "beforehand": [182, 259], "begin": [0, 137, 312, 700, 1180, 1206, 1222, 1223, 1704, 1740, 1743, 1750, 1752, 1755, 1770, 1771, 1776, 1797, 1801, 1802, 1823, 1828, 1836, 1838, 1841, 1844], "behav": [1743, 1757, 1798, 1804], "behavior": [106, 1231, 1490, 1704, 1711, 1757, 1759, 1767, 1798, 1802, 1821, 1828, 1837, 1838, 1844], "behaviour": 2, "behind": [1743, 1754, 1772, 1800, 1828, 1832, 1837, 1844], "behnl": [1734, 1798], "being": [2, 103, 112, 115, 134, 318, 319, 329, 388, 393, 516, 570, 601, 729, 1202, 1206, 1208, 1226, 1229, 1231, 1363, 1405, 1499, 1626, 1649, 1704, 1714, 1730, 1737, 1738, 1743, 1746, 1748, 1752, 1755, 1757, 1759, 1762, 1765, 1767, 1773, 1775, 1782, 1783, 1784, 1785, 1800, 1801, 1802, 1809, 1817, 1828, 1832, 1833, 1838, 1839, 1840, 1842, 1844], "belong": [9, 106, 1714, 1750, 1763, 1768, 1823, 1829, 1838, 1842], "below": [2, 106, 284, 286, 318, 319, 337, 415, 594, 606, 632, 645, 704, 736, 740, 829, 905, 1053, 1198, 1206, 1208, 1210, 1212, 1218, 1224, 1230, 1231, 1234, 1455, 1462, 1569, 1704, 1714, 1730, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1748, 1752, 1753, 1756, 1757, 1759, 1763, 1764, 1767, 1768, 1770, 1771, 1774, 1775, 1779, 1781, 1782, 1786, 1788, 1792, 1794, 1795, 1796, 1798, 1799, 1800, 1801, 1802, 1805, 1806, 1808, 1809, 1810, 1817, 1828, 1829, 1832, 1833, 1834, 1835, 1837, 1838, 1842, 1844], "bench": [0, 1, 2, 1704, 1714, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "benchmark": [154, 155, 156, 157, 158, 159, 1104, 1221, 1692, 1704, 1714, 1752, 1757, 1781, 1817, 1832, 1842], "benchmark_nam": [1692, 1752], "bend": [1711, 1714, 1802, 1842], "bendazzoli": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "benefit": [457, 1199, 1704, 1738, 1742, 1753, 1763, 1781, 1837, 1838], "benjamin": 1839, "bennyp": 1839, "bent": [1714, 1842], "benzaldehyd": 1833, "benzen": [1692, 1714, 1722, 1726, 1729, 1730, 1752, 1782, 1802, 1833, 1842], "benzenesulfon": 1833, "benzenesulfonamid": 1833, "benzenesulfonohydrazid": 1833, "benzenesulfonyl": 1833, "benzoic": 1833, "benzonitril": 1833, "benzyl": [1714, 1842], "beran": [267, 1759], "berquist": 1734, "besalu": [1734, 1802], "besal\u00fa": 1734, "besid": [100, 148, 331, 662, 1206, 1704, 1738, 1797], "best": [106, 284, 342, 356, 584, 586, 774, 808, 1206, 1209, 1210, 1231, 1620, 1704, 1711, 1730, 1737, 1738, 1739, 1740, 1742, 1743, 1754, 1757, 1782, 1794, 1801, 1804, 1809, 1835, 1837, 1838], "best_l": 356, "best_r": 356, "best_valu": [342, 356], "best_vector": 342, "beta": [0, 11, 13, 84, 92, 98, 100, 138, 150, 291, 314, 341, 660, 664, 785, 790, 823, 824, 825, 827, 829, 1111, 1206, 1210, 1221, 1225, 1231, 1284, 1523, 1559, 1564, 1579, 1581, 1669, 1680, 1690, 1704, 1708, 1714, 1740, 1750, 1755, 1756, 1757, 1759, 1776, 1781, 1791, 1810, 1829, 1838, 1842], "beta_corr_to_pitz": 90, "beta_orbital_spac": 150, "betastr": [827, 1210, 1704], "better": [2, 586, 1206, 1704, 1737, 1742, 1747, 1748, 1756, 1757, 1798, 1821, 1824, 1832, 1837, 1838], "between": [0, 1, 2, 20, 73, 106, 112, 143, 144, 149, 168, 195, 197, 309, 329, 360, 383, 404, 443, 457, 476, 479, 519, 543, 823, 826, 840, 887, 1101, 1197, 1199, 1200, 1202, 1203, 1210, 1220, 1226, 1231, 1301, 1307, 1309, 1310, 1311, 1318, 1320, 1321, 1322, 1357, 1358, 1359, 1360, 1616, 1617, 1704, 1711, 1714, 1730, 1733, 1737, 1738, 1742, 1743, 1748, 1752, 1753, 1755, 1757, 1763, 1767, 1768, 1770, 1775, 1776, 1779, 1782, 1785, 1791, 1795, 1797, 1799, 1801, 1802, 1804, 1809, 1810, 1817, 1828, 1832, 1833, 1835, 1837, 1838, 1842, 1844], "beyond": [106, 662, 1206, 1704, 1738, 1743, 1754, 1755, 1770, 1788, 1833, 1837], "bf": [106, 983, 1214, 1704, 1714, 1768, 1798, 1833, 1842], "bfdb": [1692, 1752], "bfg": [1226, 1329, 1704, 1802], "bfs_arrai": 106, "bfs_map": 106, "bfs_molecul": 106, "bg": [993, 1215, 1704, 1746], "bg_user_scftyp": 1801, "bg_user_wfn": 1801, "bh": [1714, 1842], "bhandh": [295, 318, 319, 1695, 1698, 1700, 1703, 1758, 1766, 1800], "bhandhlyp": [295, 318, 319, 1695, 1698, 1700, 1703, 1758, 1766, 1800], "bi": [1707, 1731], "biatom": [1692, 1752], "bibliographi": [400, 1764, 1777], "bibtex": 68, "big": [106, 1740, 1798], "biggest": 1810, "bimolecular": [1692, 1711, 1714, 1743, 1752, 1833, 1842], "bin": [2, 1735, 1738, 1748, 1750, 1759, 1764, 1767, 1808], "binari": [1, 86, 295, 1738, 1743, 1746, 1749, 1750, 1754, 1759, 1762, 1764, 1765, 1766, 1767, 1773, 1774, 1775, 1777, 1781, 1782, 1783, 1784, 1785, 1788, 1792, 1803, 1806, 1807, 1819, 1832, 1839], "bind": [1711, 1714, 1823, 1835, 1842], "binder": 1788, "bindex": 98, "binstar": 1748, "biofrag": [1692, 1752], "biolog": 1734, "biorthogon": [1714, 1842], "biorthonorm": 1841, "birad": [692, 1206, 1704], "bit": [2, 15, 120, 575, 651, 1206, 1704, 1767, 1770, 1781, 1786, 1810], "bizarr": 1730, "bj": [106, 267, 295, 318, 319, 1695, 1697, 1698, 1700, 1701, 1702, 1703, 1758, 1759, 1766, 1800], "bl_user_scftype_scf": 1801, "bl_user_wfn": 1801, "bl_user_wfn_scf": 1801, "bla": [2, 154, 155, 156, 1714, 1736, 1737, 1746, 1756, 1767, 1771, 1782, 1785, 1812, 1814, 1838, 1842], "blank": [86, 138, 1231, 1508, 1704, 1730, 1743, 1808, 1828, 1833, 1835, 1844], "blanklin": 1743, "blas1": 1810, "blas2": [1757, 1810], "blas3": [1757, 1810], "blas_librari": 1738, "blas_typ": 1738, "bld": 1788, "blend": [8, 1838], "bless": [267, 1759], "blindli": [660, 1206, 1704, 1743], "blob": [372, 1788, 1833], "block": [0, 13, 88, 100, 105, 110, 119, 138, 147, 148, 283, 300, 301, 302, 331, 333, 334, 366, 379, 399, 474, 501, 575, 603, 609, 615, 648, 664, 665, 671, 681, 795, 807, 830, 831, 832, 833, 834, 837, 1031, 1114, 1130, 1200, 1206, 1210, 1218, 1221, 1225, 1230, 1231, 1296, 1459, 1461, 1515, 1516, 1517, 1518, 1625, 1704, 1714, 1726, 1730, 1733, 1742, 1743, 1755, 1756, 1757, 1763, 1771, 1772, 1781, 1782, 1783, 1785, 1786, 1788, 1795, 1796, 1797, 1798, 1801, 1808, 1810, 1813, 1822, 1828, 1832, 1833, 1836, 1837, 1838, 1841, 1842, 1844], "block_diag": 334, "block_matrix": 1810, "block_siz": 1817, "block_start": 1817, "blockofpoint": 9, "blockopoint": [7, 105, 119, 147, 1827], "blockpq": 1817, "blockpq_idx": 1817, "blockr": 1817, "blockrs_idx": 1817, "blockspq": 1817, "blocksr": 1817, "blue": 1750, "blyp": [106, 267, 295, 318, 319, 1695, 1696, 1697, 1698, 1699, 1700, 1703, 1757, 1758, 1759, 1760, 1766, 1800], "bmk": [295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "bobjdir": 1738, "bodi": [112, 143, 279, 1708, 1714, 1756, 1757, 1768, 1770, 1776, 1780, 1783, 1790, 1794, 1798, 1801, 1804, 1828, 1829, 1837, 1838, 1842, 1844], "bofil": [1226, 1329, 1704, 1734, 1802], "bohr": [83, 106, 275, 306, 307, 388, 618, 632, 705, 781, 1032, 1033, 1115, 1116, 1206, 1209, 1218, 1221, 1226, 1231, 1340, 1343, 1348, 1598, 1660, 1704, 1706, 1714, 1750, 1754, 1772, 1776, 1782, 1800, 1803, 1833, 1837, 1838, 1842], "bohr2angstrom": [1706, 1754], "bohr2cm": 1706, "bohr2m": 1706, "bohr_magneton": 1706, "bohr_magneton_in_evpt": 1706, "bohr_magneton_in_hzpt": 1706, "bohr_magneton_in_inverse_meters_per_tesla": 1706, "bohr_magneton_in_kpt": 1706, "bohr_per_ang": 323, "bohr_radiu": 1706, "boi": [10, 965, 973, 974, 1214, 1704, 1763], "boilerpl": 1801, "boldsymbol": 1753, "bolton": 1734, "boltzmann": [1706, 1754], "boltzmann_const": 1706, "boltzmann_constant_in_evpk": 1706, "boltzmann_constant_in_hzpk": 1706, "boltzmann_constant_in_inverse_meters_per_kelvin": 1706, "bond": [106, 323, 1034, 1049, 1050, 1218, 1226, 1298, 1303, 1313, 1326, 1341, 1692, 1704, 1714, 1752, 1755, 1761, 1770, 1776, 1790, 1799, 1802, 1828, 1832, 1842, 1844], "bond_threshold": 106, "bond_width": 323, "bondi": [773, 1209, 1704, 1734, 1754], "bonding_alpha": 323, "bonn": [106, 1759, 1774], "book": 1843, "bookkeep": [1817, 1838], "bool": [2, 3, 8, 12, 13, 14, 18, 27, 61, 66, 76, 78, 80, 81, 84, 86, 87, 89, 90, 92, 96, 100, 103, 104, 106, 114, 119, 128, 130, 133, 138, 143, 144, 145, 148, 150, 182, 187, 207, 208, 209, 210, 211, 212, 213, 219, 246, 248, 250, 251, 252, 256, 259, 263, 265, 267, 277, 282, 283, 288, 289, 296, 308, 314, 332, 333, 339, 340, 342, 350, 356, 370, 374, 383, 386, 388, 389, 395, 399, 1759, 1768, 1769, 1785, 1791, 1794, 1797, 1817], "boolean": [2, 100, 114, 150, 265, 295, 300, 301, 302, 314, 318, 319, 359, 416, 417, 418, 424, 425, 426, 427, 429, 438, 440, 441, 448, 451, 453, 457, 458, 459, 460, 461, 462, 463, 468, 470, 471, 477, 478, 480, 481, 486, 488, 493, 494, 497, 498, 501, 503, 509, 510, 515, 517, 520, 526, 530, 532, 534, 536, 538, 540, 541, 544, 554, 555, 559, 561, 562, 566, 576, 579, 596, 597, 598, 602, 604, 605, 625, 626, 639, 642, 648, 653, 657, 658, 672, 675, 678, 679, 680, 682, 688, 691, 692, 694, 695, 697, 698, 699, 706, 713, 718, 742, 743, 745, 749, 753, 762, 765, 786, 787, 788, 792, 795, 799, 801, 802, 803, 807, 809, 812, 817, 821, 822, 823, 831, 836, 838, 839, 844, 849, 859, 860, 861, 863, 864, 865, 866, 867, 872, 875, 882, 883, 885, 886, 887, 888, 909, 910, 913, 915, 917, 919, 920, 921, 922, 925, 934, 940, 941, 942, 945, 952, 954, 956, 986, 990, 991, 994, 995, 996, 998, 999, 1004, 1010, 1012, 1014, 1016, 1017, 1019, 1020, 1022, 1024, 1025, 1026, 1027, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1044, 1045, 1059, 1061, 1064, 1069, 1071, 1073, 1074, 1076, 1078, 1083, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1105, 1117, 1121, 1124, 1132, 1145, 1151, 1152, 1157, 1171, 1172, 1173, 1175, 1179, 1182, 1183, 1186, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1212, 1213, 1215, 1216, 1217, 1218, 1219, 1221, 1222, 1225, 1226, 1228, 1229, 1230, 1231, 1244, 1252, 1253, 1254, 1255, 1258, 1259, 1260, 1261, 1262, 1264, 1268, 1270, 1276, 1277, 1278, 1280, 1288, 1295, 1298, 1300, 1306, 1312, 1315, 1316, 1317, 1327, 1330, 1334, 1337, 1355, 1356, 1361, 1367, 1369, 1370, 1372, 1373, 1374, 1378, 1381, 1385, 1386, 1390, 1392, 1404, 1406, 1407, 1411, 1413, 1414, 1415, 1418, 1419, 1420, 1421, 1422, 1428, 1430, 1431, 1432, 1434, 1435, 1436, 1441, 1447, 1448, 1449, 1450, 1451, 1452, 1459, 1460, 1461, 1464, 1465, 1466, 1467, 1468, 1480, 1483, 1491, 1510, 1535, 1541, 1546, 1549, 1553, 1554, 1557, 1558, 1560, 1564, 1565, 1566, 1578, 1583, 1585, 1587, 1591, 1593, 1594, 1596, 1606, 1610, 1613, 1614, 1623, 1624, 1637, 1643, 1647, 1656, 1663, 1704, 1735, 1740, 1742, 1743, 1746, 1749, 1752, 1754, 1755, 1766, 1770, 1771, 1772, 1785, 1791, 1794, 1795, 1796, 1798, 1800, 1801, 1803, 1837, 1841], "boost": [284, 1735, 1738, 1740], "bop": [295, 318, 319, 1695, 1697, 1698, 1699, 1701, 1703, 1758, 1766, 1800], "borb": 98, "border": [0, 1, 2, 106, 1379, 1384, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "border_n_redist": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "border_redist_ord": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "border_redist_pol": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "border_rmin": [0, 1, 2, 1383, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "border_rmin_unit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "border_typ": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "born": [597, 1206, 1704], "borrow": 1757, "bot": [1814, 1819], "both": [0, 2, 8, 106, 112, 278, 280, 284, 356, 373, 391, 539, 601, 609, 617, 664, 679, 741, 746, 830, 1203, 1206, 1208, 1210, 1225, 1226, 1231, 1279, 1352, 1615, 1704, 1714, 1715, 1716, 1722, 1726, 1730, 1735, 1738, 1740, 1742, 1743, 1747, 1750, 1753, 1755, 1756, 1757, 1759, 1763, 1764, 1767, 1770, 1771, 1774, 1775, 1776, 1781, 1785, 1788, 1792, 1795, 1796, 1798, 1802, 1805, 1808, 1810, 1817, 1828, 1832, 1833, 1835, 1837, 1838, 1842, 1844], "bottleneck": [1742, 1817, 1823, 1824, 1837, 1838], "bottom": [390, 1770, 1788, 1804, 1837, 1844], "boughton": [445, 1199, 1704], "bound": [1226, 1344, 1345, 1692, 1704, 1738, 1743, 1752, 1757, 1833, 1838, 1844], "boundari": [1754, 1770, 1803], "box": [313, 364], "boysloc": 1827, "bozkaya": [1692, 1734, 1752, 1781, 1786, 1798], "bp": [445, 1199, 1704], "bp86": [295, 318, 319, 1695, 1697, 1698, 1699, 1703, 1714, 1715, 1758, 1759, 1766, 1800, 1842], "br": [1707, 1731], "bra": [13, 1708, 1756], "bracket": [284, 1730, 1740, 1743, 1761, 1776, 1821, 1844], "bragg": 1757, "braggslat": [1714, 1715, 1724, 1842], "branch": [1737, 1738, 1764, 1783, 1786, 1787], "branch_protection_rul": 1788, "brand": 1838, "brandenburg": [1734, 1774], "breadth": 106, "break": [2, 342, 835, 1210, 1231, 1564, 1704, 1714, 1755, 1757, 1770, 1781, 1798, 1802, 1817, 1828, 1837, 1838, 1842], "breakdown": [1756, 1757, 1776, 1781], "breda": 1757, "breviti": 0, "brianqc": [400, 1105, 1221, 1704, 1738, 1777, 1780, 1842], "brianqc_dir": 1735, "brianqc_en": [0, 1, 2, 1704, 1730, 1733, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "brianqc_install_path": 1735, "brianqc_manual_v1_1_0": 1735, "brianqc_sdk_instal": 1735, "brief": [1757, 1781, 1802, 1835, 1837, 1842], "briefli": 1770, "brien": [1734, 1781], "bright_schem": 1750, "brillioun": 1756, "bring": 2, "broad": 1738, "broadcast": 1797, "broaden": [0, 322, 324, 325, 377, 1841], "broken": [697, 1206, 1231, 1564, 1692, 1704, 1752, 1768, 1790], "brook": [1734, 1781], "brought": [1804, 1841], "broughton": [443, 479, 519, 543, 1199, 1200, 1202, 1203, 1704], "browser": [1764, 1788], "brueckner": [295, 431, 432, 457, 579, 1066, 1199, 1206, 1219, 1669, 1704, 1742, 1766, 1776, 1785], "brueckner_maxit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "brueckner_orb": 1785, "brueckner_orbs_r_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "bryant": 1734, "bs1": 103, "bs2": 103, "bs3": 103, "bs4": 103, "bsd": [1781, 1806], "bse": [1714, 1842], "bsse": [106, 295, 1714, 1752, 1757, 1766, 1768, 1774, 1794, 1842], "bsse_typ": [1752, 1794, 1828, 1832, 1844], "bsseenum": 1794, "bsvec": 1827, "btwn": [1714, 1842], "bu": [993, 1215, 1704, 1746], "budapest": [586, 1206, 1704], "buf": [1231, 1576, 1704], "buffer": [12, 837, 902, 1210, 1212, 1230, 1481, 1704, 1755], "buffer_": 1817, "bug": [2, 1737, 1771, 1781, 1818, 1838], "bui": [284, 351, 370, 381, 382, 1740, 1743, 1752, 1826, 1838, 1840], "build": [2, 8, 18, 29, 64, 66, 68, 76, 92, 97, 138, 147, 150, 314, 346, 394, 463, 503, 1199, 1200, 1231, 1566, 1567, 1704, 1723, 1734, 1737, 1743, 1748, 1753, 1756, 1757, 1759, 1764, 1767, 1771, 1774, 1780, 1781, 1787, 1791, 1792, 1797, 1807, 1808, 1814, 1817, 1824, 1828, 1834, 1837, 1838, 1841, 1842], "build_alwai": 1738, "build_bas": 80, "build_cabs_spac": 115, "build_collocation_cach": 147, "build_jk": 92, "build_libint2_gener": [1738, 1783], "build_plan": [1785, 1788], "build_ri_spac": 115, "build_sad": 131, "build_task": [1740, 1772, 1794], "builder": 1757, "buildtim": 1738, "built": [1, 2, 8, 106, 1231, 1553, 1704, 1711, 1714, 1737, 1738, 1740, 1746, 1748, 1749, 1754, 1755, 1757, 1759, 1762, 1764, 1765, 1767, 1770, 1773, 1774, 1775, 1780, 1782, 1783, 1784, 1785, 1788, 1799, 1803, 1806, 1807, 1808, 1810, 1828, 1831, 1832, 1834, 1838, 1839, 1842, 1844], "builtin": [1158, 1221, 1704, 1792, 1832], "bukowski": 1734, "bulk": 138, "bullet": [1785, 1788, 1835, 1842], "bump": [1231, 1503, 1504, 1704, 1787, 1788, 1814], "bundl": [1746, 1749, 1762, 1765, 1773, 1775, 1782, 1783, 1784, 1803, 1839], "burdensom": 1833, "burk": [295, 318, 319, 1695, 1697, 1698, 1699, 1703, 1758, 1766, 1800], "burn": [106, 1692, 1734, 1740, 1743, 1746, 1752, 1759, 1765, 1773, 1774, 1781, 1782, 1783, 1784, 1786, 1802, 1804, 1807, 1839, 1843], "button": [1737, 1743, 1748, 1786, 1788], "bvec": [867, 1210, 1704], "bw": [1229, 1398, 1704], "bypass": [1738, 1788, 1809, 1832], "byproduct": [1739, 1781], "byrd": 1734, "byte": [198, 250, 305, 353, 374, 395, 620, 1206, 1704, 1767, 1821, 1828, 1832], "bz2": [1714, 1842], "bzbz_": [1692, 1752], "bzbz_pd": [1692, 1752], "bzbz_pd32": [1692, 1752], "bzbz_pd34": [1692, 1752], "bzbz_pd36": [1692, 1752], "bzbz_t": [1692, 1752], "bzh2": [1692, 1752], "bzme": [1692, 1752], "c": [0, 8, 11, 21, 76, 84, 90, 100, 106, 115, 130, 138, 141, 259, 351, 368, 369, 377, 392, 443, 479, 519, 543, 696, 804, 837, 993, 1017, 1018, 1019, 1020, 1047, 1199, 1200, 1202, 1203, 1206, 1210, 1215, 1216, 1218, 1229, 1230, 1231, 1427, 1469, 1540, 1560, 1582, 1679, 1704, 1706, 1707, 1708, 1710, 1713, 1714, 1715, 1716, 1730, 1731, 1734, 1736, 1737, 1743, 1746, 1747, 1748, 1749, 1753, 1754, 1755, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1767, 1769, 1770, 1773, 1774, 1775, 1776, 1777, 1781, 1782, 1783, 1784, 1786, 1788, 1789, 1791, 1792, 1798, 1799, 1801, 1802, 1803, 1806, 1807, 1808, 1809, 1810, 1817, 1818, 1819, 1822, 1824, 1828, 1829, 1832, 1833, 1836, 1837, 1838, 1839, 1841, 1842, 1844], "c1": [0, 2, 11, 14, 103, 128, 130, 143, 145, 150, 696, 993, 1206, 1215, 1231, 1564, 1704, 1708, 1713, 1714, 1730, 1735, 1743, 1746, 1749, 1754, 1757, 1763, 1770, 1782, 1802, 1803, 1805, 1810, 1833, 1837, 1838, 1841, 1842], "c1_deep_copi": [14, 128, 130, 145, 150], "c2": [103, 106, 139, 696, 993, 1206, 1215, 1704, 1714, 1746, 1802, 1833, 1838, 1842], "c2_x": 139, "c2_y": 139, "c2_z": 139, "c2h": [696, 993, 1206, 1215, 1704, 1746, 1833], "c2h2": [1714, 1842], "c2h3": [1692, 1752], "c2h4": [1692, 1752], "c2hx": 1833, "c2hy": 1833, "c2hz": 1833, "c2v": [696, 993, 1206, 1215, 1232, 1666, 1704, 1714, 1746, 1833, 1838, 1842, 1843], "c2vx": 1833, "c2vy": 1833, "c2vz": 1833, "c2x": 1833, "c2y": 1833, "c2z": 1833, "c3": 103, "c3v": 106, "c4": [103, 284, 295, 318, 319, 581, 586, 1206, 1704, 1740, 1743, 1744, 1745, 1766, 1800], "c4h4n": [1714, 1842], "c4h5n": [1714, 1842], "c4nh4": [1714, 1842], "c6": 1802, "c6cp00164e": [1734, 1781], "c6h6": 1782, "c852257": 1786, "c_": [1706, 1730, 1755, 1757, 1759, 1810, 1829, 1833, 1838], "c_0": 1755, "c_1": [14, 128, 130, 145, 150, 698, 829, 1206, 1210, 1704, 1752, 1833], "c_2": [829, 1210, 1704, 1833], "c_4h_4o": 0, "c_6": 1759, "c_8": 1759, "c_add": 92, "c_alpha": 138, "c_au": 1706, "c_clear": 92, "c_ddot": 1810, "c_dgemm": 1810, "c_dgemv": 1810, "c_dpotrf": 1810, "c_ene": 1833, "c_function": [138, 1757], "c_hybrid": [1695, 1696, 1697, 1699, 1700, 1701, 1702, 1758], "c_i": [829, 1210, 1704, 1755, 1833], "c_left_add": 92, "c_lrc": [1695, 1696, 1697, 1699, 1700, 1701, 1702, 1758], "c_method_nam": 1757, "c_mp2": 1757, "c_n": 1759, "c_omega": 138, "c_os_alpha": 138, "c_right_add": 92, "c_sc": [1695, 1696, 1697, 1699, 1700, 1701, 1702, 1758], "c_ss_alpha": 138, "c_yne": 1833, "ca": [2, 104, 131, 150, 314, 1707, 1714, 1731, 1746, 1786, 1791, 1805, 1810, 1829, 1842], "ca_subset": 150, "cach": [147, 329, 412, 433, 434, 466, 467, 507, 514, 537, 558, 580, 728, 900, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1206, 1208, 1212, 1225, 1231, 1242, 1507, 1704, 1738, 1742, 1748, 1808], "cachelevel": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cachetyp": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cal": [0, 1742, 1753, 1756, 1763, 1771], "cal2j": 1706, "calc": [170, 307, 1224, 1231, 1236, 1662, 1704, 1714, 1722, 1743, 1752, 1772, 1785, 1809, 1833, 1842], "calc_s_squar": [0, 1, 2, 884, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "calcul": [1, 2, 8, 11, 13, 70, 106, 150, 267, 275, 284, 295, 296, 300, 301, 302, 307, 312, 314, 318, 319, 356, 368, 369, 377, 381, 382, 399, 430, 433, 439, 443, 457, 466, 473, 476, 479, 495, 507, 514, 519, 539, 543, 550, 568, 569, 570, 571, 572, 573, 574, 575, 577, 581, 586, 588, 589, 593, 597, 598, 599, 600, 601, 605, 606, 607, 608, 609, 610, 611, 612, 614, 615, 616, 617, 619, 623, 625, 627, 635, 637, 639, 641, 648, 652, 653, 655, 657, 658, 660, 664, 665, 667, 669, 670, 671, 672, 673, 674, 675, 676, 679, 680, 681, 690, 692, 693, 695, 696, 698, 699, 701, 702, 703, 704, 707, 737, 775, 776, 786, 787, 804, 818, 850, 882, 924, 986, 989, 999, 1000, 1024, 1041, 1079, 1103, 1126, 1139, 1166, 1199, 1200, 1201, 1202, 1203, 1206, 1208, 1209, 1210, 1213, 1215, 1217, 1218, 1219, 1221, 1224, 1225, 1229, 1230, 1231, 1233, 1236, 1241, 1242, 1257, 1410, 1463, 1497, 1510, 1552, 1564, 1609, 1619, 1704, 1711, 1713, 1714, 1726, 1730, 1734, 1735, 1740, 1743, 1746, 1749, 1750, 1752, 1754, 1757, 1759, 1760, 1762, 1763, 1766, 1767, 1769, 1770, 1771, 1772, 1774, 1776, 1777, 1778, 1779, 1781, 1789, 1790, 1791, 1792, 1794, 1795, 1796, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1810, 1823, 1824, 1826, 1832, 1833, 1834, 1836, 1837, 1839, 1840, 1841, 1842], "calculu": 0, "caldeweyh": [1734, 1759], "calendar": [1730, 1733], "call": [0, 2, 84, 87, 92, 100, 106, 138, 150, 158, 168, 188, 213, 222, 235, 236, 266, 268, 269, 270, 271, 272, 276, 277, 278, 279, 284, 295, 300, 301, 302, 318, 319, 329, 350, 359, 380, 381, 382, 393, 399, 661, 662, 664, 891, 1070, 1138, 1198, 1199, 1201, 1204, 1206, 1210, 1215, 1216, 1219, 1221, 1222, 1223, 1224, 1231, 1240, 1669, 1677, 1678, 1682, 1690, 1698, 1703, 1704, 1714, 1715, 1726, 1730, 1738, 1740, 1742, 1743, 1744, 1745, 1746, 1748, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1763, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1774, 1775, 1779, 1782, 1785, 1788, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1808, 1809, 1812, 1814, 1823, 1824, 1826, 1828, 1832, 1833, 1834, 1837, 1838, 1842, 1844], "callabl": [2, 8, 84, 322, 324, 325, 335, 346, 1740, 1767, 1768, 1823, 1832], "callback": 8, "calle": 1779, "caller": [100, 342, 356, 1779, 1817], "calori": 1706, "calorie_joule_relationship": 1706, "cam": [295, 1695, 1697, 1698, 1700, 1701, 1714, 1758, 1766, 1842], "camb3lyp": [1714, 1842], "cammi": [1734, 1742, 1749, 1754, 1803], "can": [0, 1, 2, 8, 20, 86, 100, 106, 148, 150, 267, 279, 283, 284, 285, 295, 297, 300, 301, 302, 314, 318, 319, 328, 329, 331, 333, 335, 336, 347, 356, 386, 570, 574, 575, 577, 580, 586, 609, 628, 635, 641, 652, 657, 662, 672, 679, 697, 726, 727, 729, 738, 743, 751, 829, 842, 882, 993, 1065, 1104, 1125, 1127, 1128, 1158, 1164, 1165, 1206, 1208, 1210, 1215, 1219, 1221, 1226, 1228, 1229, 1231, 1304, 1394, 1405, 1620, 1655, 1704, 1714, 1730, 1733, 1735, 1737, 1738, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1779, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1817, 1821, 1822, 1823, 1824, 1828, 1829, 1831, 1832, 1833, 1835, 1836, 1837, 1838, 1839, 1841, 1842, 1844], "canc": [1734, 1754, 1803], "cancel": [1828, 1837, 1844], "canc\u00e8": 1734, "candid": 1794, "cannot": [584, 859, 860, 875, 1206, 1210, 1704, 1737, 1738, 1743, 1749, 1753, 1754, 1757, 1763, 1773, 1783, 1784, 1787, 1794, 1802, 1803, 1837, 1841, 1843], "canon": [150, 664, 665, 704, 1206, 1231, 1601, 1704, 1707, 1731, 1757, 1763, 1768, 1776, 1781, 1810, 1838], "canonic": [1171, 1172, 1222, 1704], "canonicalize_active_favg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "canonicalize_inactive_favg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cap": [114, 326, 1738, 1764, 1785], "cap0": [295, 318, 319, 1695, 1698, 1700, 1703, 1758, 1766, 1800], "capabilit": 1738, "capabl": [2, 68, 106, 138, 381, 382, 1736, 1749, 1755, 1762, 1764, 1765, 1767, 1775, 1777, 1782, 1788, 1790, 1803, 1809, 1826, 1829, 1838, 1841], "capac": [1755, 1832], "capit": [1743, 1785, 1810], "captur": [350, 351, 370, 476, 1110, 1200, 1221, 1704, 1750, 1757, 1759, 1771, 1799, 1838], "carbon": [1706, 1714, 1730, 1770, 1792, 1802, 1833, 1842], "card": [901, 1212, 1704], "care": [329, 1225, 1296, 1704, 1743, 1770, 1797, 1798, 1810, 1817, 1838, 1844], "carefulli": [2, 1763, 1817, 1824], "carrel": 1734, "carri": [306, 570, 706, 1206, 1704, 1742, 1756, 1768, 1776, 1794, 1800, 1802, 1837, 1841, 1844], "cart": 2, "cart_hess_read": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cartao": 1817, "cartesian": [8, 15, 16, 81, 82, 103, 106, 134, 139, 149, 318, 319, 350, 389, 592, 618, 637, 691, 707, 1206, 1226, 1231, 1300, 1301, 1306, 1308, 1352, 1623, 1704, 1711, 1714, 1730, 1743, 1750, 1768, 1800, 1802, 1810, 1817, 1828, 1832, 1833, 1835, 1837, 1838, 1842, 1844], "cartesian_sym_toler": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cartiesian": 1832, "casci": [1755, 1781, 1829], "case": [0, 13, 81, 106, 150, 151, 174, 175, 176, 207, 211, 212, 238, 244, 254, 255, 262, 279, 283, 284, 330, 333, 342, 355, 356, 358, 367, 374, 376, 377, 395, 397, 586, 601, 609, 626, 641, 655, 659, 660, 664, 665, 681, 695, 697, 727, 729, 778, 833, 1125, 1170, 1206, 1208, 1209, 1210, 1221, 1224, 1229, 1230, 1231, 1235, 1237, 1241, 1405, 1441, 1584, 1690, 1704, 1714, 1724, 1730, 1738, 1739, 1740, 1742, 1743, 1747, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1764, 1767, 1768, 1770, 1771, 1772, 1777, 1785, 1791, 1794, 1795, 1796, 1798, 1799, 1801, 1802, 1804, 1809, 1810, 1814, 1815, 1817, 1824, 1828, 1829, 1832, 1833, 1834, 1835, 1837, 1838, 1841, 1842, 1844], "casewit": 1734, "caspt2": [295, 986, 987, 988, 989, 1215, 1677, 1704, 1712, 1746, 1766, 1776, 1781], "casscf": [150, 295, 314, 381, 382, 676, 783, 828, 891, 1206, 1210, 1673, 1704, 1714, 1746, 1755, 1766, 1776, 1781, 1789, 1791, 1807, 1826, 1829, 1842], "cast": [393, 1714, 1756, 1809, 1821, 1838, 1842], "cast_up": 1752, "castabl": 2, "castup": [1714, 1842], "castup1": [1714, 1842], "castup2": [1714, 1842], "castup3": [1714, 1842], "cat": [1738, 1748, 1786, 1833], "catch": [86, 1786, 1810, 1821], "categori": [2, 1798], "cater": 1824, "cation": [660, 1206, 1704, 1714, 1757, 1768, 1833, 1837, 1842], "cation_mult": 1768, "cauchi": 1838, "caught": 1809, "caus": [11, 570, 644, 837, 1206, 1210, 1226, 1330, 1704, 1738, 1755, 1808, 1837], "caution": [150, 296, 605, 1206, 1704, 1726, 1769, 1833], "cautiou": 1802, "caveat": 1757, "caviti": [771, 772, 773, 1209, 1704, 1780, 1803], "caxi": 323, "cb": [104, 131, 150, 295, 300, 301, 302, 318, 319, 1714, 1740, 1741, 1743, 1752, 1766, 1768, 1772, 1776, 1779, 1800, 1832, 1842], "cb_subset": 150, "cbee32b": 1786, "cbs1": [1711, 1714, 1740, 1743, 1842], "cbs_func": 1779, "cbs_metadata": [284, 1740], "cbsmeta": 1768, "cbsmetadata": 1768, "cbsrec": [1740, 1794], "cc": [0, 1, 2, 11, 74, 106, 130, 150, 179, 218, 262, 265, 271, 284, 295, 296, 318, 319, 342, 376, 397, 433, 443, 447, 455, 457, 466, 473, 474, 476, 479, 483, 487, 491, 495, 496, 498, 499, 500, 507, 514, 519, 525, 529, 543, 549, 552, 568, 579, 582, 583, 584, 585, 586, 600, 606, 608, 612, 613, 646, 653, 662, 670, 671, 672, 680, 731, 789, 790, 791, 792, 796, 797, 798, 800, 801, 802, 803, 812, 868, 1063, 1069, 1076, 1079, 1080, 1086, 1106, 1154, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1206, 1208, 1213, 1218, 1219, 1221, 1224, 1225, 1231, 1236, 1242, 1244, 1629, 1669, 1675, 1680, 1683, 1684, 1692, 1694, 1704, 1707, 1708, 1710, 1711, 1714, 1715, 1716, 1719, 1720, 1723, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1735, 1738, 1739, 1740, 1741, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1779, 1780, 1782, 1783, 1784, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1814, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1828, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "cc1": [1714, 1738, 1842], "cc10": [1714, 1842], "cc11": [1714, 1842], "cc12": [1714, 1842], "cc13": [1714, 1842], "cc13a": [1714, 1842], "cc13b": [1714, 1842], "cc13c": [1714, 1842], "cc13d": [1714, 1842], "cc14": [1714, 1842], "cc15": [1714, 1842], "cc16": [1714, 1842], "cc17": [1714, 1842], "cc18": [1714, 1842], "cc19": [1714, 1842], "cc2": [0, 284, 295, 318, 319, 381, 382, 1669, 1683, 1714, 1739, 1740, 1742, 1743, 1744, 1745, 1766, 1776, 1781, 1792, 1793, 1800, 1826, 1842], "cc21": [1714, 1842], "cc22": [1714, 1842], "cc23": [1714, 1842], "cc24": [1714, 1842], "cc25": [1714, 1842], "cc26": [1714, 1842], "cc27": [1714, 1842], "cc28": [1714, 1842], "cc29": [1714, 1842], "cc3": [284, 295, 318, 319, 463, 468, 471, 504, 586, 665, 1199, 1200, 1206, 1669, 1683, 1704, 1708, 1711, 1714, 1739, 1740, 1742, 1743, 1744, 1745, 1766, 1776, 1781, 1792, 1793, 1800, 1842], "cc30": [1714, 1842], "cc31": [1714, 1842], "cc32": [1714, 1842], "cc33": [1714, 1842], "cc34": [1714, 1842], "cc35": [1714, 1842], "cc36": [1714, 1842], "cc37": [1714, 1842], "cc38": [1714, 1842], "cc39": [1714, 1842], "cc3_follow_root": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc4": [295, 1683, 1714, 1738, 1766, 1776, 1792, 1793, 1842], "cc40": [1714, 1842], "cc41": [1714, 1842], "cc42": [1714, 1842], "cc43": [1714, 1842], "cc44": [1714, 1842], "cc45": [1714, 1842], "cc46": [1714, 1842], "cc47": [1714, 1842], "cc48": [1714, 1842], "cc49": [1714, 1842], "cc4a": [1714, 1842], "cc5": [295, 1714, 1766, 1792, 1793, 1842], "cc50": [1714, 1842], "cc51": [1714, 1842], "cc52": [1714, 1842], "cc53": [1714, 1842], "cc54": [283, 333, 1714, 1726, 1842], "cc55": [1714, 1842], "cc56": [1714, 1842], "cc6": [295, 1714, 1766, 1792, 1793, 1842], "cc7": [1714, 1842], "cc8": [1714, 1842], "cc8a": [1714, 1842], "cc8b": [1714, 1842], "cc8c": [1714, 1842], "cc9": [1714, 1842], "cc9a": [1714, 1842], "cc_a_ras3_max": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc_b_ras3_max": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc_diis_max_vec": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc_diis_min_vec": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc_ex_level": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc_ex_lvl": [795, 1210, 1704], "cc_fix_extern": [0, 1, 2, 793, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc_fix_external_min": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc_full": [662, 1206, 1704], "cc_lambda": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc_macro": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc_maxit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc_mix": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc_num_thread": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc_os_scal": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc_program": 1743, "cc_ras34_max": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc_ras3_max": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc_ras4_max": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc_scale_o": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc_scale_ss": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc_ss_scale": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc_time": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc_type": [0, 1, 2, 1704, 1730, 1733, 1735, 1740, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc_update_ep": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc_val_ex_level": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc_variat": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc_vecs_read": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cc_vecs_writ": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cccbdb": 1837, "cccc": 1838, "ccd": [295, 318, 319, 346, 431, 1106, 1199, 1221, 1230, 1438, 1439, 1440, 1447, 1451, 1456, 1458, 1461, 1675, 1689, 1704, 1708, 1714, 1739, 1742, 1766, 1776, 1781, 1798, 1800, 1809, 1837, 1842], "ccd_e_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ccd_maxit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ccd_t_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ccdensiti": [400, 1704, 1705, 1742], "ccdl": [1714, 1842], "ccenergi": [11, 295, 372, 400, 1158, 1221, 1704, 1705, 1709, 1714, 1739, 1755, 1766, 1792, 1832, 1842], "cceom": [11, 400, 472, 1704, 1705, 1742], "ccgradient": 11, "cchbar": [400, 1158, 1221, 1704, 1705, 1742], "ccl_energi": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cclambda": [400, 1704, 1705, 1742], "cclr": [550, 1203, 1704, 1790], "ccn": [612, 1206, 1683, 1704, 1776, 1792], "ccname": [1669, 1776], "ccnn": [1683, 1776], "ccrespons": [400, 1704, 1705, 1742], "ccsd": [11, 150, 190, 284, 295, 296, 300, 301, 302, 307, 314, 318, 319, 381, 382, 444, 446, 453, 458, 471, 482, 484, 521, 523, 545, 547, 568, 581, 586, 597, 605, 610, 662, 664, 665, 923, 951, 1067, 1068, 1075, 1083, 1084, 1085, 1087, 1092, 1093, 1106, 1199, 1200, 1202, 1203, 1205, 1206, 1213, 1219, 1221, 1224, 1227, 1229, 1235, 1241, 1375, 1399, 1402, 1669, 1670, 1675, 1680, 1683, 1688, 1692, 1704, 1711, 1714, 1720, 1721, 1723, 1724, 1726, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1752, 1755, 1766, 1769, 1772, 1776, 1777, 1781, 1790, 1791, 1792, 1793, 1794, 1798, 1799, 1800, 1803, 1826, 1828, 1829, 1832, 1838, 1842, 1844], "ccsd_no": [150, 314, 1791], "ccsd_t": [1229, 1402, 1704, 1714, 1829, 1842], "ccsd_t_": [1711, 1723, 1743], "ccsdl": [1714, 1842], "ccsdt": [295, 318, 319, 586, 665, 699, 1206, 1224, 1235, 1241, 1683, 1704, 1711, 1723, 1740, 1742, 1743, 1744, 1745, 1755, 1766, 1776, 1792, 1793, 1800], "ccsdt_q_": 1723, "ccsdtq": [295, 1224, 1235, 1241, 1683, 1704, 1742, 1755, 1766, 1776, 1792, 1793], "ccsdtqp": [295, 1766, 1792, 1793], "ccsdtqph": [295, 1766, 1792, 1793], "ccsort": [561, 1204, 1704, 1738, 1809], "cct3": [1158, 1221, 1704, 1738], "cctransort": [400, 561, 1704, 1705], "cctripl": [400, 1704, 1705, 1742], "ccwavefunct": [160, 162, 1827], "cd": [568, 575, 641, 708, 951, 1106, 1146, 1147, 1166, 1206, 1213, 1221, 1231, 1609, 1704, 1707, 1708, 1714, 1731, 1735, 1737, 1738, 1739, 1742, 1748, 1749, 1754, 1756, 1757, 1763, 1767, 1771, 1781, 1788, 1798, 1803, 1805, 1806, 1808, 1809, 1838, 1842], "cdgesv": [929, 1213, 1704], "cdomp2": [1714, 1842], "cdoremp": [1714, 1842], "cdot": [377, 1733, 1742, 1755, 1757, 1759, 1836, 1838], "cdremp": [1714, 1842], "cdsalc": [103, 1827], "cdsalclist": [103, 1827], "cdsgroup": [1738, 1788], "ce_mp2": 1834, "ce_mp25": 1834, "ce_mp3": 1834, "ceas": [1231, 1644, 1704], "cell": 1828, "center": [8, 89, 103, 106, 112, 113, 141, 158, 322, 325, 1057, 1218, 1685, 1704, 1757, 1759, 1774, 1776, 1782, 1790, 1794, 1799, 1802, 1817, 1838], "center_of_mass": 106, "centimet": 1706, "central": [1714, 1842], "cepa": [190, 284, 295, 923, 948, 1070, 1078, 1088, 1093, 1106, 1213, 1219, 1221, 1225, 1248, 1680, 1704, 1708, 1714, 1739, 1740, 1766, 1776, 1777, 1781, 1790, 1842], "cepa0": [730, 948, 1208, 1213, 1225, 1248, 1704], "cepa1": [948, 1213, 1225, 1248, 1704, 1714, 1842], "cepa2": [1714, 1842], "cepa3": [1714, 1842], "cepa_level": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cepa_no_singl": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cepa_os_scal": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cepa_sos_scal": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cepa_ss_scal": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cepa_typ": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cerjan": [635, 652, 1206, 1704], "certain": [215, 433, 466, 507, 514, 616, 882, 1199, 1200, 1201, 1202, 1206, 1210, 1225, 1231, 1242, 1620, 1704, 1730, 1738, 1740, 1742, 1743, 1747, 1752, 1755, 1767, 1795, 1799, 1802, 1829, 1832, 1833, 1837, 1838], "certainli": [605, 620, 1206, 1704, 1824, 1837], "cf": [89, 1728, 1764, 1788], "cfg": 1788, "cflow": [1692, 1752], "cfour": [8, 284, 295, 318, 319, 400, 575, 577, 581, 586, 599, 614, 620, 632, 643, 661, 682, 713, 1130, 1157, 1221, 1226, 1231, 1324, 1497, 1498, 1577, 1599, 1704, 1705, 1707, 1709, 1714, 1731, 1738, 1740, 1744, 1745, 1766, 1776, 1777, 1780, 1781, 1800, 1802, 1842], "cfour_": 1743, "cfour_abcdtyp": [0, 1, 2, 575, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_active_orbi": [0, 1, 2, 593, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_anh_algorithm": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_anh_deriv": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_anh_steps": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_anh_symmetri": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_anharmon": [0, 1, 2, 570, 573, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_ao_ladd": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_av_scf": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_basi": [0, 1, 2, 691, 1704, 1711, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_bruck_conv": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_brueckn": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_cache_rec": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_calc_level": [0, 1, 2, 586, 694, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_cc_conv": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_cc_expord": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_cc_extrapol": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_cc_maxcyc": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_cc_program": [0, 1, 2, 642, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_charg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_cis_conv": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_continuum": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_contract": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_coordin": [0, 1, 2, 637, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_core_orbit": [0, 1, 2, 569, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_cphf_conv": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_cphf_maxcyc": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_curvilinear": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_dboc": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_dct": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_deriv_level": [0, 1, 2, 586, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_diff_typ": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_dropmo": [0, 1, 2, 625, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_ecp": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_eigenvector": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_el_anharm": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_eom_nonit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_eom_nst": [655, 1206, 1704], "cfour_estate_conv": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_estate_maxcyc": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_estate_prop": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_estate_sym": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_estate_tran": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_eval_hess": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_excit": [0, 1, 2, 605, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_fc_field": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_fd_calctyp": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_fd_irrep": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_fd_project": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_fd_steps": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_fd_usegroup": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_file_recsiz": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_file_strip": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_finite_perturb": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_fock": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_freq_algorithm": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_frozen_cor": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_frozen_virt": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_gamma_abcd": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_genbas_1": [0, 1, 2, 629, 630, 631, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_genbas_2": [0, 1, 2, 630, 631, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_genbas_3": [0, 1, 2, 631, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_genbas_4": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_geo_conv": [0, 1, 2, 591, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_geo_maxcyc": [0, 1, 2, 663, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_geo_maxstep": [0, 1, 2, 649, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_geo_method": [0, 1, 2, 656, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_giao": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_grid": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_guess": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_hbar": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_hfstabl": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_incor": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_input_mrcc": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_integr": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_joda_print": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_lineq_conv": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_lineq_maxci": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_lineq_typ": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_lock_orbocc": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_maxstep": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_mem_unit": [0, 1, 2, 651, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_memori": 1743, "cfour_memory_s": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_method": [0, 1, 2, 603, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_mrcc": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_multipl": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_nacoupl": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_negev": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_newnorm": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_nonhf": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_ntop_tamp": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_occup": [0, 1, 2, 569, 593, 609, 648, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_omp_num_thread": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_open": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_opt_maxcyc": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_orbit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_pert_orb": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_point": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_print": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_prop": [0, 1, 2, 636, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_prop_integr": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_qrhf_gener": [0, 1, 2, 671, 672, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_qrhf_orbit": [0, 1, 2, 672, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_qrhf_spin": [672, 1206, 1704], "cfour_qrhfgu": [0, 1, 2, 670, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_raman_int": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_raman_orb": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_rdo": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_refer": [0, 1, 2, 586, 672, 694, 1231, 1599, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_relativist": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_relax_den": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_res_raman": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_restart_cc": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_rot_evec": [0, 1, 2, 640, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_save_int": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_scale_on": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_scf_conv": [0, 1, 2, 1231, 1497, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_scf_damp": [0, 1, 2, 1231, 1498, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_scf_expord": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_scf_expstart": [0, 1, 2, 685, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_scf_extrapol": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_scf_maxcyc": [0, 1, 2, 1231, 1577, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_sd_field": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_spher": [0, 1, 2, 577, 1157, 1221, 1704, 1711, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_spin_flip": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_spin_orbit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_spin_sc": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_spinrot": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_subgroup": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_sym_check": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_symmetri": [0, 1, 2, 696, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_t3_extrapol": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_tamp_sum": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_thermochemistri": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_trans_inv": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_treat_pert": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_uij_threshold": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_unit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_update_hessian": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_vibr": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_vtran": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_xfield": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_xform_tol": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_yfield": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cfour_zfield": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cg": [335, 1725], "cgi": [1692, 1752], "ch": [1714, 1792, 1828, 1842, 1844], "ch2": [377, 1714, 1734, 1757, 1781, 1828, 1842, 1844], "ch2f2": 1743, "ch2o": [1692, 1752], "ch3": [1714, 1842], "ch3oh": 1782, "ch4": [1692, 1714, 1752, 1842], "chaban": [1734, 1789], "chai": [1734, 1759], "chain": [100, 1838], "chain_dot": 100, "challeng": [1692, 1752, 1755], "champion": 1757, "chan": [1692, 1752], "chanc": 1756, "chandemonium": 1738, "chang": [0, 2, 86, 106, 138, 150, 192, 193, 203, 204, 220, 267, 276, 277, 326, 328, 342, 356, 383, 455, 473, 499, 529, 552, 582, 648, 684, 692, 738, 829, 833, 1070, 1076, 1088, 1096, 1125, 1126, 1129, 1199, 1200, 1202, 1203, 1206, 1208, 1210, 1219, 1221, 1226, 1231, 1330, 1331, 1332, 1350, 1507, 1704, 1730, 1738, 1742, 1743, 1748, 1750, 1754, 1757, 1762, 1764, 1767, 1770, 1771, 1785, 1787, 1790, 1792, 1795, 1801, 1804, 1808, 1824, 1828, 1833, 1834, 1835, 1837, 1838, 1844], "change_file_namespac": [86, 1837], "changeabl": 1776, "changedonli": 370, "changelog": 1788, "channel": [1736, 1737, 1738, 1748, 1785, 1787, 1816, 1825], "chaotic": 1838, "chapter": [1734, 1770], "char": [386, 1772, 1786, 1810], "char_tabl": 120, "charact": [2, 17, 81, 91, 285, 313, 336, 364, 373, 391, 392, 829, 1210, 1704, 1743, 1753, 1756, 1759, 1764, 1776, 1787, 1802, 1814, 1835, 1844], "character": 1759, "characterist": [761, 774, 1209, 1704, 1706, 1754, 1764, 1767], "characteristic_impedance_of_vacuum": 1706, "charactert": [120, 1827], "charg": [73, 103, 106, 150, 255, 262, 263, 274, 275, 295, 587, 983, 1015, 1034, 1058, 1125, 1206, 1214, 1216, 1218, 1221, 1227, 1228, 1229, 1376, 1380, 1400, 1685, 1692, 1704, 1706, 1714, 1734, 1743, 1749, 1752, 1754, 1757, 1766, 1768, 1771, 1776, 1782, 1785, 1790, 1794, 1799, 1803, 1805, 1817, 1828, 1833, 1835, 1838, 1842, 1844], "chat": 1804, "chdir": 1788, "cheap": [1753, 1756], "cheaper": [295, 1757, 1766, 1771, 1792, 1793, 1817], "cheapest": [295, 1766, 1792, 1793], "cheatsheet": 1820, "check": [0, 2, 11, 84, 86, 106, 284, 342, 356, 392, 443, 479, 519, 543, 647, 681, 751, 752, 754, 755, 756, 757, 1199, 1200, 1202, 1203, 1206, 1208, 1226, 1231, 1328, 1649, 1704, 1710, 1711, 1714, 1726, 1730, 1738, 1740, 1747, 1748, 1759, 1764, 1770, 1774, 1781, 1786, 1788, 1808, 1817, 1821, 1832, 1833, 1838, 1842], "check_nam": 2, "check_phas": 84, "checkfortrancompilerflag": 1738, "checkout": 1788, "checkpoint": [2, 285, 336, 991, 996, 1215, 1231, 1560, 1704, 1714, 1746, 1767, 1769, 1775, 1842], "checkrun": [1714, 1842], "chem": [356, 443, 479, 519, 543, 885, 1199, 1200, 1202, 1203, 1210, 1225, 1230, 1256, 1469, 1692, 1704, 1714, 1715, 1722, 1734, 1740, 1752, 1762, 1781, 1837, 1842], "chemi": [106, 1759, 1774], "chemic": [1, 669, 695, 703, 1206, 1704, 1734, 1740, 1742, 1746, 1749, 1752, 1755, 1757, 1759, 1762, 1765, 1770, 1775, 1781, 1803, 1833, 1834, 1838], "chemist": [1756, 1757, 1781, 1833, 1837, 1838], "chemistri": [2, 265, 284, 608, 1206, 1232, 1666, 1704, 1734, 1738, 1740, 1743, 1748, 1752, 1756, 1757, 1771, 1781, 1782, 1794, 1797, 1810, 1827, 1828, 1837, 1838, 1841, 1843, 1844], "chemps2": [181, 295, 400, 993, 1215, 1677, 1704, 1736, 1738, 1748, 1766, 1777, 1780, 1781, 1785, 1842], "chemps2_dir": 1746, "chemps2config": 1746, "chenei": 1734, "cheng": [1714, 1734, 1781, 1836, 1842], "cherri": 1788, "chg": [267, 1759], "chgmult": [106, 1833], "chi": 1837, "chi_": [1750, 1763, 1836, 1837], "chi_0": 1837, "chi_1": 1829, "chi_2": 1829, "chi_mu": 110, "chi_nu": 110, "child": 1840, "chim": 1734, "chip": 1737, "chipset": 1839, "chiral": [1714, 1842], "chlorid": [1754, 1833], "chmod": 1738, "choic": [402, 539, 650, 662, 668, 681, 715, 1197, 1203, 1206, 1207, 1704, 1737, 1738, 1742, 1752, 1753, 1757, 1763, 1771, 1824, 1828, 1835, 1836, 1838, 1840, 1844], "choleski": [0, 1, 2, 100, 916, 1072, 1076, 1219, 1230, 1231, 1443, 1486, 1600, 1704, 1714, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "cholesky_factor": 100, "cholesky_toler": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "choos": [2, 393, 671, 708, 730, 1206, 1208, 1704, 1735, 1736, 1748, 1767, 1781, 1798, 1802, 1833, 1838], "choosen": [946, 1213, 1225, 1281, 1704], "chose": 1730, "chosen": [318, 319, 377, 570, 612, 620, 637, 638, 679, 772, 1084, 1206, 1209, 1219, 1231, 1569, 1615, 1704, 1754, 1756, 1757, 1771, 1800, 1802, 1828, 1829, 1833, 1837, 1838, 1844], "chown": [265, 1738, 1740, 1794], "chrgfield": 1838, "christoph": 1734, "chunk": 1817, "ci": [0, 2, 13, 284, 295, 296, 314, 476, 499, 500, 588, 612, 641, 692, 696, 786, 804, 807, 808, 811, 819, 820, 821, 827, 828, 829, 833, 837, 839, 842, 844, 859, 860, 870, 871, 876, 881, 882, 883, 884, 885, 890, 891, 993, 995, 1107, 1164, 1165, 1173, 1182, 1200, 1206, 1210, 1215, 1221, 1222, 1224, 1236, 1673, 1704, 1708, 1712, 1714, 1725, 1729, 1734, 1735, 1739, 1740, 1743, 1746, 1754, 1766, 1769, 1776, 1777, 1780, 1786, 1788, 1789, 1790, 1791, 1810, 1823, 1833, 1842], "ci100219f": [1714, 1842], "ci5": [295, 300, 301, 302, 318, 319, 381, 382, 1766, 1772, 1800, 1826], "ci6": 1755, "ci_dii": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ci_file_start": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ci_maxit": [0, 1, 2, 842, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ci_nat_orb": 13, "ci_num_thread": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ci_typ": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ciblks_print": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cid": [1107, 1221, 1704, 1833], "cin": [1673, 1776], "circ": 268, "circa": 1837, "circul": 1706, "circular": [368, 377, 1790], "circumst": [1767, 1770, 1789], "circumv": 1767, "cisd": [284, 295, 381, 382, 860, 875, 1078, 1107, 1210, 1219, 1221, 1673, 1680, 1704, 1714, 1739, 1740, 1742, 1755, 1766, 1771, 1776, 1781, 1826, 1842], "cisd_": [295, 1766], "cisd_wfn": [295, 1766], "cisdt": [284, 295, 381, 382, 1673, 1740, 1755, 1766, 1776, 1826], "cisdtq": [284, 295, 381, 382, 1673, 1740, 1755, 1766, 1776, 1826], "cist": [819, 1210, 1704], "citat": [68, 80, 96, 138, 267, 1692, 1730, 1733, 1752, 1757, 1759, 1781, 1786], "cite": [0, 1753, 1777, 1798, 1836, 1837], "civect": [804, 1210, 1704], "civector": [13, 1827], "ciwavefunct": [150, 314, 1791, 1827], "ck": 133, "ckel": [1781, 1838], "cl": [293, 1707, 1731], "clamp": 1838, "clang": [1738, 1748, 1777, 1781, 1808, 1814, 1822], "clang401": 1738, "clang_osx": 1738, "clangxx": 1738, "clangxx_osx": 1738, "clarif": 1801, "clarifi": [671, 1206, 1704, 1743, 1828, 1844], "clariti": 1822, "clark": 1734, "clash": [1743, 1832], "class": [3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 26, 27, 28, 29, 30, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 183, 184, 233, 265, 267, 273, 274, 275, 293, 310, 315, 316, 321, 322, 323, 324, 325, 326, 327, 329, 331, 361, 882, 1210, 1226, 1367, 1692, 1704, 1714, 1740, 1743, 1752, 1755, 1756, 1757, 1759, 1767, 1768, 1772, 1783, 1794, 1797, 1801, 1817, 1819, 1823, 1824, 1832, 1833, 1838, 1842], "classchemps2_1_1irrep": [993, 1215, 1704, 1746], "classic": [267, 1706, 1738, 1759, 1774], "classical_electron_radiu": 1706, "classif": [1058, 1218, 1704], "classifi": 1776, "classmethod": [64, 100, 106, 148], "claus": [1781, 1806], "clean": [2, 84, 87, 106, 169, 1230, 1483, 1704, 1714, 1735, 1743, 1757, 1767, 1782, 1788, 1817, 1831, 1833, 1837, 1838, 1842], "clean_opt": [1788, 1832], "clean_tim": 1788, "clean_vari": [1743, 1832], "cleaner": 1738, "cleanup": [844, 849, 1210, 1704, 1734], "cleanup_ci": 13, "cleanup_dpd": 13, "clear": [5, 18, 73, 84, 106, 111, 147, 235, 236, 357, 1738, 1743, 1801, 1822, 1824, 1832, 1844], "clear_al": 27, "clear_collocation_cach": 147, "clear_d_prev": 18, "clear_external_cpscf_perturb": 84, "clear_external_potenti": 84, "clear_spac": 27, "clearli": [609, 1206, 1704], "clebsch": 1837, "clever": [786, 1210, 1704, 1743, 1757], "cli": [2, 1788], "click": [1743, 1748, 1788, 1822], "client": [265, 1740, 1772, 1794], "clobber": 1801, "clockwis": 139, "clone": [88, 100, 106, 148, 1736, 1738, 1747, 1748, 1767, 1786, 1788, 1805, 1806, 1817], "close": [86, 87, 106, 172, 188, 223, 224, 586, 681, 865, 1206, 1210, 1224, 1238, 1704, 1714, 1739, 1750, 1753, 1755, 1756, 1757, 1771, 1786, 1788, 1802, 1809, 1828, 1833, 1835, 1837, 1838, 1842, 1844], "close_io_fil": 12, "closer": 1838, "closest": [829, 1210, 1704, 1761], "clpse": [1714, 1842], "clue": 367, "cluster": [95, 140, 160, 161, 162, 164, 165, 166, 167, 232, 284, 295, 318, 319, 381, 382, 436, 437, 440, 457, 530, 788, 794, 1120, 1198, 1199, 1200, 1201, 1202, 1204, 1221, 1222, 1229, 1669, 1673, 1682, 1688, 1704, 1714, 1724, 1740, 1741, 1743, 1744, 1745, 1748, 1753, 1766, 1776, 1777, 1790, 1794, 1800, 1824, 1826, 1829, 1832, 1837, 1842, 1844], "clutter": [2, 1801], "cm": [106, 265, 377, 386, 390, 1706, 1740, 1761, 1772, 1776, 1794, 1828, 1844], "cmake": [1, 2, 1735, 1736, 1746, 1748, 1749, 1754, 1762, 1764, 1765, 1767, 1773, 1775, 1777, 1782, 1783, 1784, 1785, 1788, 1803, 1808, 1815, 1823, 1839], "cmake_build_typ": 1738, "cmake_c_compil": 1738, "cmake_c_flag": 1738, "cmake_current_binary_dir": 2, "cmake_current_source_dir": 1738, "cmake_cxx_compil": 1738, "cmake_cxx_flag": 1738, "cmake_cxx_standard": 1738, "cmake_disable_find_package_": 1738, "cmake_disable_find_package_chemps2": 1746, "cmake_disable_find_package_dkh": 1762, "cmake_disable_find_package_ecpint": 1765, "cmake_disable_find_package_gau2grid": 1773, "cmake_disable_find_package_gdma": 1775, "cmake_disable_find_package_libefp": 1782, "cmake_disable_find_package_libint2": 1783, "cmake_disable_find_package_libxc": 1784, "cmake_disable_find_package_pcmsolv": 1803, "cmake_disable_find_package_simint": 1839, "cmake_fortran_compil": 1738, "cmake_fortran_flag": 1738, "cmake_gener": 1738, "cmake_insist_find_package_": [1738, 1788], "cmake_insist_find_package_chemps2": 1746, "cmake_insist_find_package_dkh": 1762, "cmake_insist_find_package_ecpint": 1765, "cmake_insist_find_package_gau2grid": 1773, "cmake_insist_find_package_gdma": 1775, "cmake_insist_find_package_libefp": 1782, "cmake_insist_find_package_libint2": 1783, "cmake_insist_find_package_libxc": 1784, "cmake_insist_find_package_pcmsolv": 1803, "cmake_insist_find_package_simint": 1839, "cmake_install_bindir": 1738, "cmake_install_datadir": 1738, "cmake_install_includedir": 1738, "cmake_install_libdir": 1738, "cmake_install_prefix": [2, 1738], "cmake_module_path": 1738, "cmake_polici": 1738, "cmake_prefix_path": [1738, 1746, 1762, 1765, 1773, 1775, 1782, 1783, 1784, 1803, 1808, 1839], "cmake_vers": 1738, "cmakecach": 1738, "cmakefil": 1808, "cmakelist": [1738, 1764, 1783, 1785, 1788, 1804, 1808, 1823], "cmat": 90, "cmath": 159, "cmbi": [2, 287, 338, 388, 1791], "cmd": [1748, 1788], "cmp0167": 1738, "cn": [1692, 1714, 1752, 1842], "cnv": 106, "co": [444, 482, 521, 545, 1199, 1200, 1202, 1203, 1692, 1704, 1707, 1731, 1752, 1759, 1829], "co2": [1692, 1714, 1752, 1842], "coars": [1750, 1817], "codata": 1832, "code": [0, 1, 2, 89, 106, 160, 161, 162, 163, 164, 165, 166, 167, 173, 177, 178, 179, 180, 181, 185, 186, 190, 208, 209, 210, 215, 216, 217, 218, 222, 231, 232, 237, 267, 279, 295, 297, 308, 323, 347, 392, 434, 457, 607, 641, 697, 827, 829, 882, 1104, 1124, 1125, 1199, 1204, 1206, 1210, 1221, 1231, 1670, 1690, 1704, 1708, 1713, 1714, 1725, 1730, 1735, 1740, 1742, 1743, 1746, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1773, 1774, 1775, 1776, 1777, 1781, 1782, 1783, 1784, 1785, 1787, 1789, 1791, 1792, 1794, 1797, 1798, 1799, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1814, 1815, 1817, 1818, 1821, 1822, 1828, 1829, 1831, 1832, 1833, 1834, 1836, 1837, 1838, 1839, 1841, 1842, 1843, 1844], "codebas": [2, 1737, 1738, 1759, 1777, 1787, 1788, 1814, 1817], "codedep": 1738, "codemeta": 1788, "coder": 1739, "codeset": 1738, "coef": [73, 81, 134], "coeff": [19, 1708], "coeffic": [1182, 1222, 1704], "coeffici": [19, 73, 81, 97, 103, 115, 118, 130, 134, 368, 369, 704, 827, 829, 842, 978, 979, 1029, 1173, 1175, 1206, 1210, 1214, 1218, 1222, 1225, 1230, 1268, 1270, 1442, 1704, 1714, 1755, 1757, 1759, 1776, 1789, 1791, 1798, 1829, 1837, 1838, 1842], "coffe": [273, 284, 351, 370, 381, 382, 1740, 1743, 1752, 1826, 1840], "cohes": 1785, "coincid": [106, 1743], "col": 100, "colatitud": [1231, 1659, 1704], "coldim": [100, 183, 184], "collabor": 1757, "collaps": [277, 342, 356, 470, 808, 842, 1200, 1210, 1704, 1714, 1739, 1743, 1833, 1842], "collapse_s": [0, 1, 2, 842, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "collapse_with_last": [0, 1, 2, 471, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "collapse_with_last_cc3": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "collect": [2, 327, 328, 342, 344, 356, 357, 371, 1226, 1347, 1692, 1704, 1738, 1743, 1748, 1752, 1772, 1787, 1794, 1834, 1835, 1840], "collinear": [1226, 1335, 1704], "colloc": [105, 147, 1773], "collocation_s": 105, "colon": [1767, 1782], "color": [323, 1738, 1750, 1770, 1786], "color1": 1750, "color2": 1750, "column": [0, 2, 100, 183, 184, 1138, 1221, 1226, 1362, 1704, 1730, 1733, 1740, 1755, 1775, 1776, 1810, 1817, 1832], "colwel": 1734, "com": [372, 561, 1204, 1692, 1704, 1735, 1737, 1738, 1746, 1748, 1751, 1752, 1759, 1781, 1782, 1784, 1785, 1786, 1788, 1799, 1805, 1806, 1822, 1833, 1837], "com_fix": 106, "combat": [1757, 1838], "combin": [16, 106, 115, 143, 144, 158, 284, 346, 569, 593, 1125, 1206, 1221, 1226, 1231, 1339, 1663, 1704, 1714, 1739, 1740, 1743, 1748, 1750, 1753, 1755, 1757, 1759, 1771, 1774, 1779, 1781, 1782, 1802, 1805, 1809, 1810, 1817, 1828, 1833, 1835, 1836, 1837, 1838, 1842, 1843], "combo": 1785, "come": [150, 1157, 1221, 1704, 1714, 1738, 1743, 1756, 1757, 1764, 1781, 1782, 1808, 1810, 1817, 1828, 1838, 1842, 1844], "comma": [671, 1206, 1704, 1730, 1733, 1743, 1844], "command": [2, 235, 236, 284, 303, 351, 370, 581, 586, 599, 614, 650, 651, 661, 1206, 1224, 1240, 1704, 1730, 1736, 1737, 1740, 1743, 1747, 1750, 1768, 1770, 1772, 1775, 1777, 1779, 1786, 1788, 1796, 1800, 1801, 1808, 1810, 1828, 1832, 1833, 1834, 1838, 1844], "commandsinsteaddict": 370, "commenc": 1743, "comment": [2, 106, 304, 386, 1206, 1692, 1730, 1740, 1743, 1750, 1752, 1764, 1768, 1772, 1786, 1788, 1801, 1808, 1817, 1834, 1835, 1844], "commit": [279, 1738, 1747, 1785, 1786, 1788, 1804], "common": [0, 149, 159, 195, 197, 393, 1738, 1740, 1742, 1743, 1755, 1756, 1757, 1767, 1781, 1782, 1785, 1790, 1802, 1810, 1828, 1833, 1836, 1837, 1838, 1839, 1844], "common_model": [265, 1740, 1772, 1794], "commonli": [0, 342, 1738, 1763, 1789, 1829, 1832, 1834, 1838], "commun": [297, 347, 1734, 1743, 1777, 1781, 1785, 1816, 1818], "commut": [89, 103], "comp": [297, 347, 443, 479, 519, 543, 619, 1199, 1200, 1202, 1203, 1206, 1692, 1704, 1734, 1752, 1781], "compact": [1736, 1757, 1763, 1767, 1771, 1782, 1817, 1838], "compani": 1748, "companion": [1781, 1829], "compar": [2, 285, 286, 287, 336, 337, 338, 383, 1711, 1714, 1743, 1753, 1755, 1757, 1770, 1781, 1783, 1832, 1834, 1837, 1838, 1842], "compare_": [2, 1788], "compare_arrai": 2, "compare_cub": 2, "compare_fchkfil": 2, "compare_fcidump": 2, "compare_integ": 2, "compare_matric": 2, "compare_moldenfil": 2, "compare_molrec": 2, "compare_recurs": 2, "compare_str": 2, "compare_valu": [2, 278, 1738, 1833], "compare_vector": 2, "compare_vibinfo": 2, "compare_wavefunct": 2, "comparison": [278, 285, 286, 287, 336, 337, 338, 1714, 1717, 1753, 1777, 1837, 1842], "compat": [296, 1737, 1738, 1763, 1769, 1781, 1804, 1817, 1837], "compatibli": 1767, "compchem": [2, 285, 296, 336, 1769], "compens": [1770, 1802, 1837], "competit": [1743, 1838], "compil": [106, 1129, 1221, 1231, 1629, 1704, 1736, 1737, 1759, 1767, 1771, 1774, 1777, 1781, 1783, 1785, 1786, 1788, 1819, 1821, 1828, 1831, 1838, 1839, 1842, 1844], "compilervar": 1738, "complain": [1743, 1808], "complaint": [284, 1740], "complement": [89, 1785], "complementari": [306, 307, 1772, 1800], "complet": [8, 84, 106, 267, 295, 318, 319, 443, 479, 519, 543, 570, 676, 729, 885, 1034, 1199, 1200, 1202, 1203, 1206, 1208, 1210, 1218, 1229, 1231, 1405, 1499, 1616, 1673, 1704, 1714, 1730, 1738, 1742, 1743, 1746, 1752, 1753, 1755, 1757, 1759, 1766, 1767, 1770, 1774, 1776, 1777, 1779, 1781, 1786, 1788, 1789, 1790, 1799, 1800, 1802, 1809, 1818, 1828, 1829, 1831, 1832, 1833, 1837, 1838, 1840, 1842, 1844], "complete_basis_set": [284, 1740], "complex": [2, 385, 386, 472, 1200, 1692, 1704, 1711, 1714, 1730, 1743, 1752, 1755, 1757, 1768, 1771, 1772, 1781, 1794, 1802, 1817, 1824, 1828, 1831, 1832, 1833, 1837, 1841, 1842, 1844], "complex_toler": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "complianc": [1738, 1781], "compliant": [296, 1738, 1769], "complic": [2, 303, 608, 1206, 1704, 1738, 1740, 1743, 1755, 1757, 1775, 1789, 1810, 1833, 1837, 1838, 1844], "compon": [0, 111, 134, 284, 295, 390, 458, 459, 657, 694, 709, 711, 712, 865, 884, 921, 1199, 1205, 1206, 1210, 1213, 1230, 1453, 1673, 1704, 1711, 1714, 1722, 1738, 1740, 1755, 1756, 1766, 1770, 1771, 1775, 1776, 1780, 1781, 1794, 1799, 1808, 1817, 1828, 1829, 1832, 1835, 1836, 1837, 1838, 1841, 1842, 1844], "compos": [292, 343, 1752, 1794, 1837, 1838], "composit": [106, 284, 295, 318, 319, 1695, 1698, 1699, 1700, 1701, 1703, 1740, 1758, 1766, 1768, 1771, 1774, 1781, 1782, 1784, 1800, 1838], "compositecomput": [1740, 1768, 1794], "compositejk": 1827, "compound": [685, 1206, 1704, 1743, 1752, 1776, 1833], "comprehend": 1838, "comprehens": [1692, 1752, 1781], "compress": [100, 148, 367], "compris": [1764, 1771, 1794, 1832], "comptc": [1714, 1842], "compton": 1706, "compton_wavelength": 1706, "compton_wavelength_over_2_pi": 1706, "compuat": 1837, "comput": [0, 1, 2, 4, 13, 21, 26, 61, 65, 68, 69, 70, 71, 72, 73, 76, 84, 87, 89, 92, 93, 94, 95, 100, 103, 106, 107, 109, 110, 111, 112, 116, 121, 127, 138, 140, 141, 142, 143, 144, 147, 150, 160, 199, 243, 251, 259, 265, 267, 278, 284, 285, 286, 287, 288, 289, 294, 295, 300, 301, 302, 307, 309, 312, 314, 317, 318, 319, 329, 336, 337, 338, 339, 340, 342, 345, 352, 356, 360, 365, 368, 369, 370, 377, 381, 382, 383, 386, 387, 399, 403, 416, 418, 419, 422, 425, 430, 446, 471, 472, 474, 475, 483, 484, 489, 490, 504, 508, 509, 526, 527, 531, 539, 569, 575, 581, 586, 593, 599, 600, 608, 609, 615, 616, 655, 660, 668, 669, 675, 678, 695, 698, 707, 726, 727, 731, 732, 733, 742, 743, 750, 756, 758, 775, 776, 788, 794, 801, 810, 817, 836, 860, 861, 866, 872, 875, 887, 888, 892, 895, 896, 899, 901, 909, 917, 921, 922, 925, 935, 940, 942, 952, 963, 1012, 1014, 1015, 1016, 1017, 1019, 1020, 1041, 1071, 1073, 1074, 1076, 1078, 1096, 1099, 1106, 1107, 1108, 1111, 1112, 1120, 1125, 1132, 1146, 1147, 1148, 1149, 1155, 1156, 1158, 1166, 1167, 1186, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1244, 1256, 1258, 1259, 1260, 1261, 1262, 1264, 1268, 1276, 1278, 1295, 1296, 1323, 1394, 1398, 1399, 1403, 1406, 1411, 1417, 1420, 1423, 1428, 1429, 1435, 1436, 1441, 1445, 1446, 1448, 1449, 1450, 1452, 1454, 1459, 1460, 1461, 1464, 1465, 1466, 1467, 1502, 1568, 1596, 1649, 1658, 1666, 1668, 1669, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1682, 1684, 1686, 1687, 1688, 1690, 1692, 1704, 1708, 1711, 1713, 1714, 1715, 1716, 1718, 1725, 1726, 1730, 1734, 1735, 1737, 1738, 1739, 1740, 1742, 1743, 1750, 1752, 1753, 1754, 1756, 1757, 1759, 1761, 1762, 1766, 1767, 1768, 1769, 1771, 1772, 1774, 1775, 1776, 1779, 1781, 1782, 1785, 1786, 1788, 1790, 1791, 1792, 1794, 1795, 1798, 1799, 1800, 1801, 1802, 1809, 1810, 1817, 1821, 1824, 1826, 1828, 1829, 1831, 1832, 1833, 1834, 1836, 1838, 1840, 1841, 1842, 1843, 1844], "comput_s2": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "computation": [874, 1210, 1704, 1755, 1771, 1785, 1837], "compute_": 84, "compute_afock": 133, "compute_dens": 21, "compute_df": 61, "compute_energi": [68, 84, 150, 267], "compute_esp_over_grid_in_memori": 70, "compute_field_over_grid_in_memori": 70, "compute_fock_like_matric": 90, "compute_funct": [7, 80, 138], "compute_fvpi": 84, "compute_gradi": [68, 147, 150, 267], "compute_guess": 131, "compute_hessain": 147, "compute_hessian": [68, 150, 267], "compute_hk": 133, "compute_initial_": 84, "compute_list": [1740, 1794], "compute_mp4_tripl": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "compute_orbit": 21, "compute_orbital_gradi": [14, 84, 128, 130, 145], "compute_pair": 1817, "compute_phi": 8, "compute_point": 119, "compute_product": 329, "compute_properti": 21, "compute_q": 133, "compute_qk": 133, "compute_shel": [112, 141, 143, 144], "compute_shell_block": 1817, "compute_spin_contamin": 84, "compute_state_transf": 13, "compute_thc_factor": 94, "compute_tripl": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "compute_v": 147, "compute_vx": 147, "computed_shells_per_it": 92, "computeexternexterninteract": 73, "computenuclearenergi": 73, "computepotentialmatrix": 73, "con": 1838, "concaten": [380, 1768], "conceiv": [833, 1210, 1704], "concern": [106, 1763, 1771, 1779, 1801], "concern_mol": 106, "concert": [1756, 1757, 1838], "concienti": 2, "concis": 1754, "concomitantli": 1833, "concret": [1743, 1824], "concur": 1743, "concurr": 1759, "cond": 1785, "conda": [1, 1736, 1746, 1747, 1749, 1754, 1759, 1762, 1764, 1765, 1767, 1773, 1774, 1775, 1777, 1781, 1782, 1783, 1784, 1785, 1803, 1806, 1807, 1819, 1828, 1839], "conda_build_config": 1788, "conda_cos6": 1738, "conda_prefix": [1738, 1767], "condadist": 1738, "condadoc": 1786, "condarc": 1748, "condens": [284, 1740], "condit": [2, 100, 106, 268, 300, 301, 302, 326, 327, 390, 1055, 1218, 1231, 1506, 1620, 1704, 1738, 1753, 1756, 1757, 1771, 1772, 1785, 1798, 1809, 1838], "condition": 1785, "conduct": [1706, 1777, 1818], "conductance_quantum": 1706, "conductor": 1754, "conf": 1788, "conf_spac": 1805, "confid": [2, 1786], "config": [1738, 1747, 1748, 1765, 1783, 1788], "configdir": [1746, 1762, 1765, 1773, 1775, 1782, 1783, 1784, 1839], "configur": [177, 265, 295, 308, 310, 361, 381, 382, 676, 1071, 1182, 1206, 1210, 1219, 1222, 1229, 1432, 1673, 1704, 1735, 1740, 1742, 1747, 1748, 1764, 1766, 1768, 1776, 1777, 1780, 1788, 1790, 1794, 1805, 1808, 1826, 1829, 1832, 1838, 1844], "confin": 1743, "confirm": [2, 106, 1714, 1771, 1842], "conflict": [1736, 1743, 1747, 1767, 1804, 1814], "conform": [1785, 1838], "conftest": [2, 1788], "confus": [392, 671, 993, 1206, 1215, 1704, 1738, 1746, 1764, 1767, 1837], "conjug": [335, 946, 949, 950, 1213, 1225, 1281, 1285, 1286, 1704, 1753, 1757], "conjunct": [576, 1206, 1704, 1752, 1833, 1838], "connect": [0, 106, 308, 426, 592, 1198, 1206, 1226, 1303, 1341, 1704, 1734, 1737, 1738, 1768, 1770, 1771, 1781, 1798, 1802, 1829, 1833], "consecut": [1224, 1226, 1241, 1302, 1704, 1788], "consecutive_backstep": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "consensu": 1804, "consequ": [1763, 1767, 1798, 1810], "consequenti": 1838, "conserv": [1226, 1230, 1305, 1455, 1704, 1837], "consid": [0, 88, 148, 575, 582, 594, 625, 681, 684, 1183, 1206, 1222, 1225, 1231, 1288, 1591, 1704, 1737, 1738, 1743, 1757, 1768, 1771, 1776, 1785, 1788, 1809, 1817, 1824, 1828, 1829, 1833, 1838, 1844], "consider": [457, 623, 666, 1199, 1206, 1704, 1742, 1752, 1754, 1757, 1770, 1798, 1835, 1837, 1838], "consist": [0, 1, 295, 318, 319, 381, 382, 1210, 1231, 1673, 1690, 1714, 1734, 1743, 1747, 1753, 1755, 1760, 1766, 1770, 1771, 1776, 1777, 1781, 1782, 1785, 1786, 1790, 1800, 1802, 1817, 1821, 1826, 1829, 1833, 1837, 1838, 1840, 1842], "consol": 1750, "consolid": 1838, "const": 1817, "constant": [8, 106, 307, 368, 369, 386, 390, 400, 573, 574, 596, 614, 615, 618, 669, 679, 690, 707, 779, 780, 1206, 1209, 1226, 1338, 1342, 1704, 1714, 1743, 1754, 1755, 1763, 1764, 1767, 1772, 1777, 1817, 1828, 1831, 1838, 1842, 1844], "constitu": 64, "constrain": [1226, 1357, 1358, 1359, 1360, 1704, 1714, 1753, 1757, 1781, 1790, 1798, 1838, 1842], "constraint": [1231, 1620, 1704, 1714, 1788, 1802, 1838, 1842], "constrast": 1770, "construct": [0, 1, 8, 14, 92, 100, 106, 115, 128, 130, 145, 147, 148, 150, 295, 381, 382, 623, 837, 1197, 1206, 1210, 1231, 1521, 1668, 1704, 1714, 1726, 1730, 1734, 1738, 1753, 1755, 1763, 1766, 1770, 1771, 1776, 1782, 1788, 1790, 1797, 1801, 1802, 1817, 1823, 1826, 1835, 1836, 1837, 1842], "construct_from_pydict": 8, "constructor": [106, 1714, 1726, 1748, 1788, 1810, 1817, 1842], "consult": [2, 381, 382, 1730, 1733, 1736, 1737, 1738, 1739, 1743, 1748, 1752, 1759, 1770, 1826, 1828, 1832], "consum": 1818, "contact": [614, 669, 1206, 1704, 1735, 1770, 1837, 1838], "contain": [1, 2, 8, 17, 81, 92, 97, 106, 115, 120, 138, 150, 295, 296, 313, 364, 374, 377, 383, 395, 628, 829, 1027, 1065, 1123, 1127, 1128, 1130, 1168, 1206, 1210, 1217, 1219, 1221, 1226, 1304, 1336, 1704, 1708, 1714, 1726, 1730, 1735, 1736, 1738, 1743, 1746, 1749, 1750, 1752, 1754, 1755, 1756, 1757, 1762, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1775, 1782, 1783, 1784, 1786, 1791, 1792, 1799, 1801, 1802, 1803, 1808, 1817, 1823, 1828, 1829, 1833, 1835, 1837, 1838, 1839, 1841, 1842, 1844], "contamin": [1756, 1757, 1828, 1838, 1844], "content": [5, 86, 376, 397, 1228, 1393, 1704, 1708, 1738, 1740, 1743, 1749, 1767, 1772, 1788, 1794, 1804, 1832], "context": [288, 289, 328, 339, 340, 357, 1755, 1785, 1801, 1810, 1837, 1838], "contigu": 1810, "continu": [2, 584, 606, 656, 1206, 1704, 1738, 1752, 1759, 1774, 1788, 1802, 1817, 1838, 1840], "continum": 1780, "continuous_guess": 1768, "continuum": [589, 1206, 1209, 1227, 1672, 1686, 1704, 1742, 1748, 1754, 1776, 1780], "contiuum": 1738, "contract": [8, 13, 81, 103, 590, 628, 1206, 1704, 1708, 1743, 1781, 1817, 1829, 1838], "contradict": 1743, "contradictori": 1743, "contrari": 1746, "contrast": [2, 1743, 1754, 1776, 1804, 1838], "contribut": [61, 73, 106, 147, 284, 346, 372, 575, 614, 669, 677, 690, 835, 1073, 1074, 1095, 1206, 1210, 1219, 1225, 1229, 1230, 1231, 1288, 1296, 1413, 1455, 1460, 1650, 1704, 1714, 1737, 1740, 1742, 1753, 1756, 1757, 1759, 1770, 1771, 1776, 1777, 1781, 1782, 1785, 1788, 1794, 1798, 1817, 1825, 1828, 1836, 1837, 1838, 1841, 1842, 1844], "contributor": [346, 1756, 1786, 1788], "contriv": 1838, "control": [2, 84, 150, 282, 295, 303, 314, 318, 319, 332, 346, 376, 383, 397, 572, 575, 605, 623, 627, 637, 640, 644, 645, 667, 683, 685, 692, 695, 727, 728, 736, 745, 746, 747, 749, 754, 1125, 1208, 1221, 1225, 1293, 1490, 1658, 1704, 1737, 1738, 1740, 1743, 1744, 1745, 1753, 1754, 1755, 1757, 1763, 1766, 1767, 1770, 1771, 1775, 1777, 1785, 1788, 1791, 1795, 1798, 1799, 1800, 1802, 1809, 1828, 1833, 1838, 1841], "contruct": [443, 479, 519, 543, 1199, 1200, 1202, 1203, 1704], "conv": [0, 1, 408, 415, 432, 439, 455, 472, 473, 491, 496, 499, 500, 529, 552, 722, 732, 736, 737, 739, 740, 747, 752, 754, 777, 818, 841, 850, 854, 858, 876, 893, 903, 904, 905, 916, 924, 930, 935, 949, 953, 958, 967, 971, 973, 976, 1029, 1030, 1053, 1054, 1072, 1079, 1085, 1086, 1106, 1107, 1113, 1131, 1137, 1140, 1146, 1147, 1174, 1178, 1197, 1198, 1199, 1200, 1202, 1203, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1218, 1219, 1221, 1222, 1224, 1225, 1226, 1228, 1229, 1230, 1231, 1233, 1234, 1257, 1266, 1285, 1287, 1290, 1301, 1328, 1335, 1349, 1350, 1351, 1364, 1365, 1389, 1410, 1424, 1438, 1440, 1442, 1455, 1462, 1486, 1487, 1488, 1489, 1497, 1498, 1514, 1520, 1545, 1552, 1567, 1569, 1572, 1573, 1600, 1602, 1603, 1604, 1605, 1621, 1622, 1627, 1638, 1644, 1648, 1654, 1704, 1714, 1739, 1742, 1743, 1749, 1754, 1755, 1771, 1781, 1785, 1789, 1798, 1809, 1837, 1841, 1842], "conv_tol": 84, "convcrit": [1714, 1842], "convei": [266, 279], "conveni": [295, 991, 993, 1010, 1215, 1704, 1733, 1740, 1743, 1746, 1748, 1763, 1766, 1767, 1771, 1776, 1782, 1801, 1809, 1810, 1832, 1833, 1836, 1838, 1844], "convent": [11, 106, 288, 289, 339, 340, 823, 993, 1095, 1210, 1213, 1215, 1219, 1225, 1675, 1684, 1704, 1706, 1714, 1730, 1738, 1739, 1742, 1743, 1746, 1753, 1754, 1756, 1757, 1759, 1771, 1777, 1781, 1785, 1790, 1802, 1810, 1817, 1833, 1834, 1835, 1837, 1838, 1841, 1842], "convention": 1754, "conventional_value_of_josephson_const": 1706, "conventional_value_of_von_klitzing_const": 1706, "converg": [0, 1, 2, 11, 84, 97, 266, 277, 295, 318, 319, 335, 342, 356, 393, 408, 432, 438, 439, 455, 470, 473, 491, 499, 500, 515, 529, 538, 548, 552, 582, 583, 584, 588, 594, 606, 632, 645, 647, 657, 660, 672, 681, 684, 685, 686, 687, 688, 697, 699, 722, 726, 729, 737, 738, 739, 746, 747, 754, 755, 812, 818, 830, 833, 841, 843, 846, 847, 848, 850, 854, 856, 876, 924, 928, 930, 949, 953, 958, 971, 973, 975, 976, 995, 1002, 1006, 1029, 1054, 1079, 1086, 1121, 1140, 1166, 1173, 1174, 1175, 1178, 1184, 1188, 1189, 1190, 1191, 1197, 1199, 1200, 1202, 1203, 1206, 1207, 1208, 1210, 1213, 1214, 1215, 1218, 1219, 1221, 1222, 1224, 1225, 1228, 1229, 1230, 1233, 1257, 1266, 1285, 1287, 1290, 1312, 1324, 1349, 1350, 1351, 1364, 1365, 1389, 1405, 1410, 1424, 1430, 1438, 1440, 1442, 1485, 1490, 1497, 1498, 1499, 1510, 1546, 1552, 1554, 1557, 1573, 1604, 1605, 1615, 1638, 1641, 1642, 1643, 1644, 1649, 1654, 1655, 1658, 1669, 1704, 1714, 1742, 1743, 1746, 1749, 1753, 1755, 1756, 1757, 1760, 1766, 1768, 1770, 1771, 1776, 1781, 1785, 1789, 1790, 1795, 1799, 1800, 1824, 1828, 1832, 1837, 1841, 1842, 1844], "convergenceerror": 1827, "convergnec": [1714, 1842], "convers": [106, 377, 562, 1204, 1704, 1706, 1739, 1743, 1767, 1773, 1783, 1784, 1797, 1828, 1844], "convert": [14, 100, 128, 130, 145, 148, 150, 314, 318, 319, 331, 334, 363, 367, 368, 369, 377, 380, 385, 461, 497, 566, 679, 1199, 1200, 1205, 1206, 1704, 1711, 1714, 1737, 1738, 1764, 1767, 1768, 1791, 1797, 1800, 1801, 1802, 1828, 1832, 1838, 1842, 1844], "convolut": [377, 1797, 1841], "cookbook": [400, 1842], "cooler": 1810, "coord": [81, 103, 106, 388, 1226, 1360, 1704, 1714, 1833, 1842], "coordiant": 1767, "coordin": [15, 81, 103, 106, 149, 384, 388, 389, 572, 574, 592, 596, 617, 618, 619, 632, 637, 679, 683, 707, 1156, 1170, 1206, 1221, 1231, 1298, 1299, 1304, 1306, 1308, 1313, 1314, 1334, 1337, 1339, 1340, 1343, 1349, 1351, 1352, 1364, 1365, 1623, 1704, 1708, 1711, 1714, 1743, 1759, 1767, 1768, 1772, 1782, 1786, 1791, 1798, 1799, 1828, 1832, 1835, 1836, 1838, 1842, 1844], "coordsi": 1802, "copi": [2, 12, 64, 76, 88, 100, 106, 148, 150, 151, 262, 288, 289, 295, 329, 339, 340, 344, 380, 384, 993, 1215, 1704, 1708, 1714, 1730, 1738, 1746, 1764, 1766, 1767, 1768, 1785, 1788, 1797, 1809, 1810, 1817, 1835, 1842, 1844], "coplanar": [1692, 1752], "copy_file_to_scratch": [288, 339], "copy_lower_to_upp": 100, "copy_pymol": 1770, "copy_pymol2": 1770, "copy_upper_to_low": 100, "copyright": 1787, "corannulen": [1692, 1752], "core": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 268, 274, 275, 284, 293, 295, 298, 306, 307, 314, 331, 348, 370, 371, 374, 395, 406, 463, 503, 593, 602, 623, 625, 638, 641, 644, 650, 651, 660, 765, 809, 837, 904, 1125, 1126, 1148, 1197, 1199, 1200, 1206, 1209, 1210, 1212, 1221, 1230, 1231, 1454, 1563, 1695, 1696, 1697, 1698, 1700, 1704, 1708, 1711, 1714, 1715, 1738, 1739, 1740, 1742, 1743, 1754, 1755, 1756, 1757, 1758, 1763, 1764, 1766, 1767, 1768, 1770, 1771, 1777, 1781, 1785, 1787, 1788, 1790, 1791, 1792, 1797, 1798, 1800, 1801, 1809, 1814, 1818, 1824, 1828, 1829, 1832, 1837, 1841, 1842, 1844], "core_hamiltonian_grad": 103, "coriani": [377, 1734], "corl": [284, 1740, 1741, 1743], "corl_alpha": [284, 1740], "corl_basi": [284, 1740, 1741, 1743, 1832], "corl_schem": [284, 295, 318, 319, 1740, 1741, 1766, 1800, 1832], "corl_wfn": [284, 1740, 1741], "corl_xtpl_helgaker_2": [284, 1740, 1741, 1743, 1832], "corminboeuf": [1734, 1781], "cornerston": 1838, "corr": [103, 295, 318, 319, 1231, 1524, 1695, 1698, 1699, 1703, 1704, 1758, 1766, 1800, 1837, 1843], "corr_ansatz": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "corr_ccsd_t": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "corr_charg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "corr_multp": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "corr_wfn": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "correcli": 1817, "correct": [2, 68, 84, 100, 106, 138, 145, 148, 265, 267, 284, 295, 314, 318, 319, 329, 356, 394, 400, 446, 484, 574, 597, 605, 677, 701, 758, 874, 889, 900, 903, 961, 1041, 1199, 1200, 1206, 1208, 1210, 1212, 1213, 1218, 1225, 1229, 1230, 1231, 1256, 1406, 1420, 1447, 1451, 1452, 1467, 1472, 1507, 1521, 1522, 1523, 1524, 1525, 1526, 1541, 1582, 1669, 1670, 1675, 1680, 1684, 1690, 1691, 1692, 1695, 1696, 1698, 1699, 1700, 1702, 1703, 1704, 1706, 1708, 1710, 1711, 1714, 1715, 1716, 1726, 1730, 1734, 1738, 1740, 1741, 1743, 1748, 1752, 1753, 1755, 1756, 1766, 1767, 1770, 1771, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1788, 1790, 1791, 1798, 1800, 1805, 1821, 1829, 1831, 1832, 1833, 1834, 1837, 1838, 1842, 1843], "correctli": [1714, 1738, 1743, 1764, 1817, 1828, 1832, 1842, 1844], "correl": [0, 1, 2, 20, 62, 103, 138, 150, 284, 286, 294, 295, 296, 318, 319, 337, 345, 441, 478, 517, 541, 625, 626, 658, 675, 678, 680, 703, 999, 1125, 1127, 1128, 1148, 1149, 1199, 1200, 1202, 1203, 1206, 1215, 1221, 1229, 1231, 1402, 1513, 1530, 1668, 1669, 1670, 1671, 1673, 1674, 1675, 1676, 1680, 1683, 1684, 1689, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1714, 1734, 1740, 1741, 1742, 1743, 1746, 1752, 1753, 1755, 1756, 1757, 1758, 1759, 1760, 1763, 1766, 1769, 1771, 1776, 1781, 1789, 1799, 1800, 1828, 1829, 1832, 1834, 1837, 1838, 1842, 1844], "correlationfactor": [77, 1827], "correlationt": 1827, "correspond": [0, 8, 13, 92, 106, 115, 150, 267, 277, 318, 319, 342, 356, 380, 568, 574, 590, 603, 625, 662, 664, 669, 671, 672, 681, 704, 727, 729, 795, 1206, 1208, 1210, 1229, 1231, 1405, 1499, 1556, 1704, 1714, 1733, 1738, 1749, 1753, 1757, 1759, 1761, 1768, 1771, 1775, 1776, 1782, 1794, 1798, 1799, 1800, 1802, 1817, 1829, 1833, 1836, 1837, 1838, 1841, 1842], "corrupt": 1801, "cosmo": [769, 1209, 1704, 1754], "cost": [0, 2, 259, 575, 704, 727, 1206, 1208, 1230, 1435, 1436, 1704, 1714, 1730, 1742, 1753, 1754, 1757, 1763, 1771, 1789, 1796, 1817, 1837, 1838, 1842], "costli": [150, 314, 1755, 1757, 1791], "cosx": [18, 721, 1166, 1207, 1221, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1704, 1790], "cosx_basis_toler": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cosx_density_toler": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cosx_ints_toler": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cosx_maxiter_fin": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cosx_overlap_fit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cosx_pruning_schem": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cosx_radial_points_fin": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cosx_radial_points_initi": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cosx_spherical_points_fin": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cosx_spherical_points_initi": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cotton": [15, 300, 301, 302, 1065, 1123, 1168, 1189, 1219, 1221, 1222, 1229, 1433, 1704, 1772, 1801, 1833], "could": [272, 329, 359, 609, 786, 827, 833, 1206, 1210, 1231, 1499, 1704, 1738, 1740, 1743, 1748, 1759, 1779, 1785, 1817, 1824, 1828, 1832, 1833, 1844], "coulomb": [76, 103, 1231, 1509, 1704, 1757, 1790, 1817], "count": [5, 277, 342, 356, 1767, 1785, 1794], "counter": [1787, 1802], "counterpart": [713, 1206, 1704, 1714, 1743, 1763, 1767, 1794, 1798, 1802, 1837, 1838, 1842], "counterpois": [1711, 1714, 1743, 1752, 1776, 1778, 1779, 1781, 1794, 1832, 1833, 1842], "coup": 1837, "coupl": [0, 1, 2, 95, 140, 160, 161, 162, 164, 165, 166, 167, 232, 284, 295, 318, 319, 381, 382, 436, 437, 440, 442, 457, 518, 530, 542, 598, 614, 655, 669, 690, 745, 788, 794, 831, 832, 835, 972, 1041, 1044, 1070, 1071, 1120, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1206, 1208, 1214, 1218, 1219, 1221, 1222, 1230, 1404, 1441, 1669, 1673, 1682, 1688, 1704, 1706, 1714, 1724, 1730, 1733, 1735, 1739, 1740, 1741, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1777, 1779, 1780, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1790, 1791, 1792, 1794, 1795, 1797, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "coupled_induct": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "coupling_term": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cours": [603, 611, 615, 648, 679, 696, 1206, 1226, 1323, 1704, 1743, 1776, 1798, 1801, 1802, 1828, 1832, 1844], "courtesi": 1738, "couterpois": 1828, "coval": [106, 1226, 1230, 1299, 1303, 1341, 1689, 1704, 1763, 1770, 1781, 1832], "covalent_connect": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cover": [2, 284, 285, 336, 351, 1158, 1221, 1704, 1740, 1748, 1764, 1770, 1781, 1788, 1794, 1822, 1828, 1844], "coverag": [2, 1714, 1738, 1822, 1842], "cowork": [1692, 1752], "cp": [288, 289, 339, 340, 900, 1212, 1231, 1507, 1692, 1704, 1714, 1715, 1743, 1752, 1776, 1779, 1794, 1828, 1832, 1842, 1843, 1844], "cp_energy_body_dict": 1794, "cp_gradient_body_dict": 1794, "cp_hessian_body_dict": 1794, "cpc": 1781, "cphf": [84, 400, 594, 595, 704, 715, 1029, 1062, 1206, 1218, 1230, 1231, 1435, 1441, 1442, 1457, 1638, 1639, 1704, 1705, 1714, 1725, 1823, 1837, 1838, 1842], "cphf_converg": 84, "cphf_hx": 84, "cphf_mem_safety_factor": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cphf_r_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "cphf_solv": 84, "cphf_task": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cpk": [1230, 1231, 1442, 1638, 1639, 1704, 1837], "cplett": 1734, "cpp": [1738, 1790, 1822], "cppe": [1738, 1777, 1780, 1817], "cppe_dir": 1749, "cppeconfig": 1749, "cpscf": 84, "cpu": [704, 1206, 1704, 1838], "cpuinfo": 1738, "cpython": 1738, "cr": [1707, 1731, 1738], "cr00031a008": 1781, "cr0505627": 1734, "craft": 1757, "crai": [575, 1206, 1704, 1736, 1767], "crash": [87, 1714, 1742, 1755, 1842], "crashclean": 87, "crawdad": 1781, "crawford": [1714, 1734, 1742, 1781, 1786, 1798, 1803, 1842], "cray_add_rpath": 1738, "craype_link_typ": 1738, "creat": [2, 100, 101, 115, 132, 148, 150, 304, 329, 346, 946, 996, 1213, 1215, 1225, 1281, 1704, 1735, 1737, 1738, 1743, 1746, 1748, 1750, 1751, 1752, 1757, 1764, 1767, 1777, 1782, 1785, 1787, 1791, 1797, 1801, 1802, 1804, 1814, 1817, 1819, 1823, 1824, 1828, 1833, 1834, 1844], "create_matric": [16, 108], "create_matrix": 101, "create_psi4_string_from_molecul": 106, "creation": [1748, 1802, 1817, 1833], "creator": 372, "credenti": 372, "crit": [1714, 1743, 1842], "criteria": [2, 439, 473, 737, 818, 850, 924, 967, 971, 973, 975, 976, 1079, 1131, 1140, 1199, 1200, 1208, 1210, 1213, 1214, 1219, 1221, 1224, 1225, 1226, 1229, 1231, 1233, 1257, 1312, 1324, 1410, 1487, 1488, 1489, 1497, 1552, 1621, 1622, 1627, 1704, 1742, 1743, 1755, 1757, 1763, 1771, 1789, 1790, 1798, 1799], "criterion": [432, 439, 455, 467, 473, 491, 499, 500, 529, 552, 582, 594, 632, 664, 684, 737, 739, 747, 818, 850, 854, 876, 924, 930, 949, 953, 958, 1029, 1079, 1174, 1178, 1199, 1200, 1202, 1203, 1206, 1208, 1210, 1213, 1218, 1219, 1222, 1224, 1225, 1226, 1229, 1230, 1231, 1233, 1257, 1266, 1285, 1287, 1290, 1349, 1350, 1351, 1364, 1365, 1410, 1424, 1442, 1497, 1552, 1604, 1605, 1704, 1742, 1755, 1771, 1789, 1798, 1802, 1837, 1838, 1841], "criterium": 1802, "critic": [1730, 1738, 1757, 1768, 1810, 1822], "crontab": 1788, "cross": [114, 149, 1106, 1107, 1146, 1147, 1221, 1704, 1706, 1748, 1757, 1798], "crossov": 1763, "crude": [106, 1225, 1279, 1704, 1754, 1798, 1838], "csam": [1167, 1221, 1231, 1569, 1704, 1838], "csh": [1738, 1748, 1767], "csx": [1714, 1833, 1842], "csy": 1833, "csz": 1833, "ct": [130, 295, 1689, 1766, 1776, 1837], "ct300780u": 1781, "ct301078q": 1781, "ct400250u": 1781, "ct500186j": 1781, "ct500231c": 1781, "ct500634": [1734, 1781], "ct500724p": 1781, "ct6002737": 1776, "ct7": [1692, 1752], "ct800246v": [295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "ctest": [1736, 1767, 1777, 1785, 1788, 1842], "ctest_label": 2, "ctest_runn": [2, 1788], "cu": [394, 1706, 1707, 1731], "cu_x_unit": 1706, "cube": [2, 21, 76, 291, 314, 341, 1035, 1036, 1037, 1108, 1109, 1111, 1218, 1221, 1704, 1714, 1777, 1790, 1791, 1831, 1842], "cubefil": 1750, "cubeprop": [21, 1714, 1777, 1831, 1842], "cubeprop_basis_funct": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cubeprop_filepath": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cubeprop_isocontour_threshold": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cubeprop_orbit": [0, 1, 2, 291, 341, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cubeprop_task": [0, 1, 2, 291, 341, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cubeproperti": 1827, "cubic": [573, 574, 1206, 1229, 1403, 1704], "cubic_basis_toler": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cubic_block_max_point": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cubic_grid_overag": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cubic_grid_spac": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cubicscalargrid": [1030, 1031, 1032, 1033, 1113, 1114, 1115, 1116, 1218, 1221, 1704, 1750], "cuda": [1231, 1629, 1704, 1738], "cuhf": [1231, 1599, 1704, 1714, 1757, 1781, 1827, 1838, 1842], "cuk": 1757, "cumbersom": [1808, 1824], "cumul": [173, 295, 318, 319, 381, 382, 726, 736, 739, 746, 747, 749, 759, 1208, 1671, 1704, 1714, 1766, 1776, 1777, 1790, 1794, 1800, 1826, 1842], "cunha": 1734, "curl": [1748, 1788], "current": [0, 1, 3, 18, 73, 84, 86, 87, 92, 100, 106, 114, 150, 191, 214, 227, 228, 262, 265, 281, 284, 295, 296, 310, 318, 319, 321, 335, 351, 354, 357, 361, 370, 371, 378, 390, 407, 430, 444, 474, 482, 488, 570, 573, 577, 586, 592, 597, 601, 652, 657, 664, 676, 685, 690, 692, 697, 701, 706, 729, 739, 742, 882, 934, 948, 1025, 1026, 1027, 1097, 1197, 1199, 1200, 1206, 1208, 1210, 1213, 1217, 1220, 1224, 1225, 1226, 1229, 1231, 1241, 1248, 1293, 1327, 1405, 1499, 1578, 1651, 1668, 1669, 1670, 1671, 1673, 1675, 1676, 1677, 1678, 1679, 1680, 1682, 1684, 1685, 1688, 1689, 1704, 1706, 1708, 1714, 1730, 1735, 1738, 1740, 1743, 1748, 1750, 1752, 1753, 1754, 1755, 1757, 1766, 1767, 1768, 1769, 1771, 1772, 1774, 1775, 1776, 1781, 1782, 1786, 1788, 1791, 1794, 1796, 1797, 1800, 1801, 1802, 1808, 1809, 1810, 1817, 1828, 1829, 1832, 1834, 1837, 1838, 1841, 1842], "current_afock": 133, "current_ci_energi": 133, "current_docc_energi": 133, "current_ifock": 133, "current_total_energi": 133, "curtiss": [1734, 1771], "curv": [1692, 1726, 1743, 1752, 1761, 1790, 1798], "curvilinear": [596, 1206, 1704], "custom": [106, 150, 267, 283, 333, 771, 1126, 1209, 1221, 1225, 1226, 1283, 1293, 1294, 1352, 1674, 1676, 1684, 1704, 1714, 1718, 1730, 1738, 1743, 1754, 1757, 1759, 1770, 1776, 1777, 1783, 1832, 1838, 1842], "custom_coord": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "custom_cxxstandard": 1738, "custom_funct": 1757, "customari": [1730, 1733, 1740, 1759, 1772, 1794], "customis": 1754, "customiz": 1788, "cut": [1714, 1750, 1770, 1824, 1842], "cutlass": [1231, 1629, 1704], "cutoff": [0, 1, 2, 100, 106, 442, 518, 542, 927, 1030, 1084, 1085, 1113, 1137, 1199, 1202, 1203, 1218, 1219, 1221, 1230, 1231, 1478, 1514, 1520, 1538, 1543, 1545, 1650, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cutoff_amps_print": [2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "cv": [0, 295, 381, 382, 1739, 1742, 1756, 1757, 1766, 1771, 1781, 1798, 1826, 1843], "cxx": [1738, 1808], "cxx_standard": 1738, "cycl": [2, 84, 279, 318, 319, 595, 611, 633, 706, 1206, 1229, 1426, 1704, 1711, 1743, 1800, 1808, 1828, 1844], "d": [0, 18, 21, 68, 76, 84, 92, 103, 106, 110, 267, 284, 295, 306, 318, 319, 329, 384, 628, 692, 804, 819, 830, 842, 1112, 1206, 1210, 1221, 1230, 1231, 1469, 1521, 1694, 1695, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1707, 1708, 1714, 1715, 1716, 1729, 1730, 1731, 1732, 1733, 1734, 1737, 1738, 1740, 1748, 1750, 1757, 1758, 1759, 1763, 1766, 1768, 1776, 1777, 1780, 1781, 1785, 1786, 1788, 1798, 1800, 1802, 1804, 1809, 1810, 1817, 1828, 1829, 1836, 1838, 1841, 1842, 1844], "d09": [295, 318, 319, 1695, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "d1": [267, 1669, 1680, 1759, 1776], "d10": [295, 318, 319, 1695, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "d2": [106, 267, 696, 993, 1206, 1215, 1669, 1704, 1714, 1715, 1746, 1757, 1759, 1776, 1781, 1833, 1842], "d2h": [696, 993, 1206, 1215, 1704, 1746, 1833], "d3": [106, 267, 295, 318, 319, 1695, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1729, 1757, 1758, 1759, 1766, 1770, 1781, 1800, 1837], "d32b": 1759, "d3bj": [106, 267, 295, 318, 319, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1757, 1758, 1759, 1766, 1800], "d3bj2b": [267, 295, 318, 319, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1758, 1759, 1766, 1800], "d3bjatm": [267, 295, 318, 319, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1758, 1759, 1766, 1800], "d3m": 1759, "d3m2b": 1759, "d3mbj": [295, 318, 319, 1695, 1697, 1698, 1699, 1703, 1758, 1759, 1766, 1800, 1837], "d3mbj2b": [267, 295, 318, 319, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1703, 1758, 1759, 1766, 1800], "d3mbjatm": [267, 295, 318, 319, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1703, 1758, 1759, 1766, 1800], "d3mzero": 1759, "d3mzero2b": [267, 295, 318, 319, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1703, 1758, 1759, 1766, 1800], "d3mzeroatm": [267, 295, 318, 319, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1703, 1758, 1759, 1766, 1800], "d3zero": [1757, 1759], "d3zero2b": [267, 295, 318, 319, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1758, 1759, 1766, 1800], "d3zeroatm": [267, 295, 318, 319, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1758, 1759, 1766, 1800], "d4": [295, 1695, 1698, 1700, 1701, 1716, 1758, 1759, 1766, 1770, 1781], "d4bj": 1759, "d4bjeeqatm": [267, 1759], "d_": [329, 685, 698, 1206, 1704, 1730, 1757, 1763, 1833, 1838], "d_2": 1833, "d_conv": [84, 276], "d_converg": [0, 1, 2, 684, 1206, 1604, 1654, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "d_e": 1832, "d_gaussian": [968, 1214, 1231, 1532, 1704], "d_slater": [968, 1214, 1231, 1532, 1704], "d_vector": 13, "d_x": [1033, 1116, 1218, 1221, 1704, 1750], "d_y": [1033, 1116, 1218, 1221, 1704, 1750], "d_z": [1033, 1116, 1218, 1221, 1704, 1750], "da": [111, 131, 150, 314, 1112, 1221, 1704, 1750, 1770, 1791], "da_mo": [314, 1791], "da_so": [314, 1791], "da_subset": 150, "daddon_dir": 1738, "dagger": [1763, 1798, 1836], "dagger_a": 1829, "dagger_b": 1829, "dai": [1786, 1788, 1824], "dam": 1781, "damp": [685, 729, 1013, 1015, 1018, 1206, 1208, 1216, 1225, 1228, 1229, 1231, 1271, 1385, 1386, 1387, 1388, 1405, 1498, 1499, 1704, 1714, 1757, 1759, 1785, 1837, 1838, 1842], "damp_induc": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "damp_multipol": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dampen": 92, "damping_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "damping_factor_induc": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "damping_factor_multipol": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "damping_percentag": [0, 1, 2, 685, 1206, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "damping_upd": 84, "dancoff": [1231, 1656, 1704, 1841], "daniel": [1734, 1740, 1742, 1755, 1757, 1760, 1789, 1794, 1797, 1803, 1837, 1841], "dany_addl_cmake_v": 1748, "dao": 147, "darwin": [677, 1206, 1704], "darwin13": 1738, "das2009": [267, 1759], "das2010": [106, 267, 1759], "dash": [373, 391, 601, 1206, 1704, 1754, 1806, 1828, 1833, 1835, 1844], "dashcoeff": [106, 267, 1759], "dashcoeff_suppl": [267, 1759], "dashlevel": [267, 1759], "dashlevel_cit": [267, 1759], "dashlvl": [106, 1759], "dashparam": [106, 267, 1759], "dashparams_cit": [267, 1759], "dat": [170, 1738, 1764, 1767, 1770, 1788, 1799, 1801, 1805, 1806, 1808, 1828, 1844], "data": [0, 14, 84, 88, 100, 128, 130, 145, 148, 150, 255, 265, 285, 287, 295, 296, 329, 331, 336, 338, 342, 356, 384, 386, 412, 467, 1043, 1046, 1052, 1097, 1104, 1198, 1200, 1218, 1220, 1221, 1231, 1584, 1704, 1714, 1738, 1740, 1743, 1752, 1754, 1755, 1761, 1766, 1767, 1769, 1770, 1772, 1775, 1780, 1788, 1794, 1801, 1810, 1817, 1824, 1832, 1837, 1838, 1841, 1842], "data_fil": 1801, "databas": [284, 318, 319, 350, 1692, 1711, 1714, 1715, 1726, 1738, 1740, 1743, 1751, 1764, 1767, 1776, 1777, 1779, 1781, 1795, 1796, 1800, 1828, 1831, 1832, 1840, 1842, 1844], "database_group": [1692, 1752], "database_noncov": [1692, 1752], "database_therm_bh": [1692, 1752], "datafil": [303, 1775], "datafram": 1832, "datakei": 1788, "date": [1, 1786, 1788], "datum": [2, 383, 384, 386, 388, 389], "daunt": 1808, "david": [1755, 1789, 1791], "davidson": [0, 356, 470, 473, 476, 491, 496, 499, 500, 609, 751, 754, 757, 808, 811, 832, 835, 842, 874, 876, 889, 1005, 1200, 1206, 1208, 1210, 1215, 1704, 1742, 1746, 1755, 1817, 1838, 1841], "davidson_solv": 329, "daxpi": 1810, "db": [111, 131, 150, 314, 1112, 1221, 1704, 1750, 1752, 1763, 1779, 1791, 1840], "db1": [1711, 1714, 1743, 1842], "db3": [1714, 1842], "db_func": [1752, 1779], "db_mode": 1779, "db_name": [1752, 1776], "db_rgt": 1752, "db_rxn": 1752, "db_subset": 150, "dblas_typ": 1738, "dboc": [597, 1206, 1704, 1737], "dbuild_libint2_gener": 1783, "dbuild_shared_lib": [1738, 1783], "dc": [730, 742, 750, 1208, 1704, 1714, 1734, 1753, 1781, 1842], "dcalc": 12, "dcccn": 1833, "dcft": 1781, "dchemps2_dir": 1746, "dcmake_ar": 1746, "dcmake_build_typ": 1738, "dcmake_c_compil": 1738, "dcmake_c_flag": 1738, "dcmake_cxx_compil": 1738, "dcmake_cxx_flag": 1738, "dcmake_disable_find_package_chemps2": 1746, "dcmake_disable_find_package_dkh": 1762, "dcmake_disable_find_package_ecpint": 1765, "dcmake_disable_find_package_gau2grid": 1773, "dcmake_disable_find_package_gdma": 1775, "dcmake_disable_find_package_libefp": 1782, "dcmake_disable_find_package_libint2": 1783, "dcmake_disable_find_package_libxc": 1784, "dcmake_disable_find_package_simint": 1839, "dcmake_fortran_compil": 1738, "dcmake_fortran_flag": 1738, "dcmake_install_path": 1738, "dcmake_install_prefix": 1738, "dcmake_prefix_path": [1738, 1746, 1762, 1765, 1773, 1775, 1782, 1783, 1784, 1839], "dcmake_ranlib": 1746, "dcon": 1838, "dcopi": 1810, "dct": [295, 296, 318, 319, 381, 382, 400, 598, 726, 730, 731, 732, 733, 738, 745, 753, 1206, 1704, 1705, 1708, 1709, 1714, 1766, 1769, 1776, 1777, 1790, 1800, 1809, 1826, 1842], "dct1": [1714, 1842], "dct10": [1714, 1842], "dct11": [1714, 1842], "dct12": [1714, 1842], "dct2": [1714, 1842], "dct3": [1714, 1842], "dct4": [1714, 1842], "dct5": [1714, 1842], "dct6": [1714, 1842], "dct7": [1714, 1842], "dct8": [1714, 1842], "dct9": [1714, 1842], "dct_function": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dct_guess": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dct_type": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dcuhna": 1841, "dd": [0, 1672, 1692, 1752, 1776, 1780], "dd_density_integr": 110, "ddd": [1714, 1842], "ddkh_dir": 1762, "ddot": [1810, 1838], "ddsolvat": 1738, "ddx": [0, 1, 2, 400, 760, 767, 768, 775, 776, 777, 1704, 1705, 1709, 1730, 1733, 1735, 1738, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ddx_diis_max_vec": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ddx_eta": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ddx_fmm": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ddx_fmm_local_lmax": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ddx_fmm_multipole_lmax": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ddx_incor": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ddx_lmax": [0, 1, 2, 764, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ddx_logfil": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ddx_maxit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ddx_model": [0, 1, 2, 781, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ddx_n_lebedev": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ddx_radii": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ddx_radii_sc": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ddx_radii_set": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ddx_shift": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ddx_solute_radial_point": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ddx_solute_spherical_point": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ddx_solvation_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ddx_solvent": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ddx_solvent_epsilon": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ddx_solvent_epsilon_opt": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ddx_solvent_kappa": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "de": [106, 344, 520, 1202, 1231, 1650, 1704, 1708, 1734, 1743, 1757, 1759, 1761, 1767, 1774, 1832, 1841], "deactivate_all_frag": 106, "deal": [1737, 1750, 1757, 1781, 1790, 1832], "dealt": [1757, 1828, 1844], "debug": [0, 1, 75, 147, 296, 644, 767, 906, 1153, 1206, 1209, 1212, 1231, 1576, 1591, 1620, 1636, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "debugg": 1813, "deby": [781, 1209, 1704, 1706, 1754], "dec": [575, 1206, 1704, 1738, 1838], "decacen": [1692, 1752], "decad": [368, 369], "decai": [1231, 1532, 1704, 1757, 1776, 1838], "decalin": 1735, "decemb": 1748, "decid": [306, 307, 1772, 1785, 1786, 1800, 1809], "decim": [2, 285, 287, 336, 338, 389, 1795, 1821, 1828, 1844], "decis": [1737, 1824], "declar": [1743, 1796, 1809, 1810, 1812, 1814, 1819, 1832], "decompos": [1714, 1739, 1742, 1756, 1757, 1771, 1781, 1798, 1838, 1842], "decomposit": [874, 915, 916, 1072, 1076, 1209, 1210, 1213, 1219, 1231, 1486, 1600, 1603, 1672, 1704, 1714, 1726, 1738, 1754, 1771, 1776, 1781, 1798, 1803, 1810, 1837, 1838, 1842], "decon": [8, 1730, 1836], "decontract": [1103, 1221, 1704, 1714, 1832, 1836, 1842], "decor": 2, "decoupl": [1801, 1836], "decpint_dir": 1765, "decreas": [0, 1738, 1747, 1750, 1757, 1828, 1838, 1844], "dedic": 1767, "deduc": 1821, "deduct": 1821, "deep": [2, 150], "deep_copi": 150, "deepdiff": 1738, "deeper": 1767, "def": [2, 1788, 1809, 1834], "def2": [106, 1231, 1485, 1694, 1704, 1707, 1714, 1730, 1731, 1732, 1733, 1740, 1772, 1774, 1794, 1842], "default": [0, 1, 2, 8, 61, 62, 86, 87, 92, 101, 106, 195, 197, 200, 210, 265, 267, 284, 288, 289, 297, 300, 301, 302, 304, 318, 319, 339, 340, 347, 354, 370, 377, 381, 382, 389, 390, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1704, 1708, 1714, 1730, 1733, 1735, 1738, 1740, 1743, 1746, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1759, 1760, 1762, 1763, 1767, 1768, 1770, 1772, 1774, 1775, 1779, 1782, 1788, 1789, 1790, 1791, 1792, 1794, 1796, 1800, 1801, 1802, 1803, 1808, 1809, 1826, 1828, 1832, 1833, 1836, 1837, 1839, 1840, 1841, 1842, 1843, 1844], "default_benchmark_nam": [1692, 1752], "default_polici": [265, 1740, 1794], "defer": 1824, "defi": 1822, "defin": [8, 63, 64, 83, 98, 106, 243, 265, 267, 275, 284, 295, 297, 300, 301, 302, 312, 318, 319, 323, 329, 347, 356, 381, 382, 581, 592, 622, 643, 662, 708, 1206, 1226, 1231, 1312, 1336, 1497, 1521, 1539, 1540, 1564, 1582, 1692, 1704, 1714, 1726, 1738, 1740, 1748, 1750, 1751, 1752, 1753, 1754, 1756, 1757, 1759, 1760, 1763, 1766, 1767, 1768, 1771, 1772, 1774, 1776, 1777, 1782, 1786, 1794, 1798, 1800, 1802, 1808, 1810, 1824, 1826, 1828, 1832, 1833, 1835, 1837, 1838, 1842, 1844], "definit": [100, 106, 130, 138, 265, 267, 279, 284, 295, 335, 356, 372, 389, 445, 522, 546, 575, 632, 647, 1199, 1202, 1203, 1206, 1226, 1326, 1704, 1730, 1733, 1738, 1740, 1746, 1757, 1759, 1764, 1766, 1772, 1780, 1784, 1785, 1794, 1801, 1804, 1833, 1837, 1838, 1841], "deflect": 106, "deform": 1752, "deg": 1776, "degen": 20, "degener": [576, 697, 1206, 1704], "degeneraci": [20, 386, 1057, 1218, 1704, 1772, 1805], "degenerci": 20, "degrad": [1742, 1755], "degre": [295, 386, 617, 763, 764, 766, 1024, 1188, 1206, 1209, 1217, 1222, 1704, 1713, 1730, 1733, 1754, 1757, 1766, 1772, 1776, 1798, 1802, 1833, 1837], "del_array_vari": 150, "del_potential_vari": 150, "del_scalar_vari": 150, "del_vari": [150, 174, 175], "delai": [1743, 1832], "delet": [2, 86, 87, 279, 295, 434, 559, 601, 626, 682, 1199, 1204, 1206, 1704, 1738, 1742, 1743, 1766, 1767, 1786, 1788, 1810, 1833, 1838], "delete_tei": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "deleteri": 1804, "deliber": [2, 1759], "delic": 1770, "delimit": [1743, 1764, 1801], "deloc": [1763, 1770], "delta": [6, 76, 100, 284, 295, 318, 319, 377, 823, 1210, 1230, 1444, 1467, 1704, 1714, 1740, 1743, 1766, 1770, 1800, 1802, 1817, 1828, 1837, 1838, 1842, 1844], "delta1": [284, 1740], "delta2": [284, 1740], "delta2_basi": [284, 1740, 1741], "delta2_schem": [284, 1740, 1741], "delta2_wfn": [284, 1740, 1741], "delta2_wfn_less": [284, 1740, 1741], "delta3_basi": [284, 1740, 1741], "delta3_schem": [284, 1740, 1741], "delta3_wfn": [284, 1740, 1741], "delta3_wfn_less": [284, 1740, 1741], "delta4_basi": [284, 1740, 1741], "delta4_schem": [284, 1740, 1741], "delta4_wfn": [284, 1740, 1741], "delta4_wfn_less": [284, 1740, 1741], "delta5_basi": [284, 1740, 1741], "delta5_schem": [284, 1740, 1741], "delta5_wfn": [284, 1740, 1741], "delta5_wfn_less": [284, 1740, 1741], "delta_": [284, 1740, 1741, 1757, 1763, 1771, 1837], "delta_alpha": [284, 1740], "delta_basi": [284, 1740, 1741, 1743], "delta_i": 1771, "delta_schem": [284, 1740, 1741], "delta_v": [277, 342, 356], "delta_wfn": [284, 1740, 1741, 1743], "delta_wfn_less": [284, 1740, 1741], "deltan_": 1740, "demand": [703, 1206, 1704, 1771, 1837], "demo": [1714, 1842], "demonstr": [1714, 1730, 1775, 1798, 1799, 1808, 1817, 1832, 1833, 1838, 1841, 1842], "den": [1714, 1842], "denable_adcc": 1, "denable_chemps2": 1746, "denable_cpp": 1749, "denable_ddx": 1754, "denable_dkh": 1762, "denable_ecpint": 1765, "denable_gdma": [1738, 1775], "denable_libefp": 1782, "denable_pcmsolv": 1803, "denable_simint": 1839, "denomin": [95, 100, 140, 744, 759, 956, 1208, 1213, 1226, 1229, 1230, 1231, 1328, 1427, 1443, 1444, 1651, 1704, 1837, 1839, 1841], "denominator_algorithm": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "denominator_delta": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "denominator_occ": [95, 140], "denominator_vir": [95, 140], "denot": [0, 495, 774, 1200, 1209, 1704, 1730, 1742, 1753, 1754, 1757, 1802, 1817, 1837], "dens": [100, 148, 331, 888, 1210, 1704, 1797], "densiti": [2, 13, 21, 26, 61, 74, 75, 76, 84, 92, 103, 138, 143, 147, 150, 160, 173, 179, 217, 276, 284, 285, 291, 295, 296, 300, 301, 302, 303, 314, 318, 319, 336, 341, 352, 356, 381, 382, 413, 416, 417, 609, 614, 627, 665, 669, 675, 678, 684, 686, 697, 726, 729, 733, 736, 738, 739, 743, 747, 749, 759, 810, 828, 872, 887, 888, 892, 899, 909, 910, 963, 998, 1002, 1035, 1076, 1110, 1112, 1120, 1167, 1174, 1198, 1204, 1206, 1208, 1211, 1212, 1213, 1214, 1215, 1218, 1219, 1221, 1222, 1230, 1231, 1445, 1446, 1488, 1497, 1498, 1499, 1500, 1501, 1502, 1510, 1520, 1538, 1567, 1569, 1572, 1591, 1603, 1604, 1622, 1671, 1674, 1675, 1690, 1704, 1706, 1708, 1714, 1730, 1733, 1734, 1735, 1738, 1739, 1740, 1742, 1743, 1744, 1745, 1750, 1754, 1755, 1759, 1760, 1763, 1766, 1767, 1769, 1770, 1772, 1775, 1776, 1777, 1784, 1785, 1790, 1791, 1798, 1799, 1800, 1806, 1808, 1823, 1824, 1826, 1828, 1832, 1837, 1842, 1844], "density_a": [314, 1791], "density_b": [314, 1791], "density_cutoff": [80, 96], "density_integr": 110, "density_toler": 138, "dep": [1738, 1759, 1794], "depend": [0, 1, 8, 11, 100, 115, 148, 324, 342, 356, 368, 369, 432, 539, 669, 672, 772, 977, 1199, 1203, 1206, 1209, 1214, 1225, 1231, 1232, 1283, 1294, 1602, 1620, 1666, 1669, 1704, 1710, 1714, 1730, 1734, 1735, 1739, 1742, 1743, 1746, 1748, 1749, 1753, 1754, 1757, 1762, 1763, 1764, 1765, 1767, 1771, 1773, 1775, 1776, 1777, 1781, 1782, 1783, 1784, 1785, 1788, 1790, 1794, 1797, 1802, 1803, 1808, 1810, 1817, 1821, 1833, 1836, 1837, 1838, 1839, 1842, 1843], "deploi": [1770, 1788], "deploy": 1748, "depopul": [671, 1206, 1704], "deprec": [96, 100, 150, 192, 193, 203, 204, 206, 253, 263, 264, 279, 281, 295, 304, 375, 396, 1231, 1588, 1704, 1766, 1767, 1828], "deprinc": [1734, 1771, 1777, 1780, 1781, 1782, 1786], "depscach": 1748, "depsmklcach": 1748, "depth": [2, 476, 1200, 1704], "der": [106, 1759, 1781, 1832, 1837], "dergam": [621, 1206, 1704], "derint": [621, 1206, 1704], "deriv": [0, 7, 89, 103, 106, 138, 267, 268, 269, 300, 301, 302, 310, 361, 378, 386, 568, 570, 586, 590, 599, 600, 608, 615, 647, 665, 667, 673, 702, 704, 707, 904, 1119, 1206, 1212, 1217, 1221, 1226, 1231, 1370, 1538, 1704, 1708, 1714, 1738, 1743, 1753, 1757, 1759, 1768, 1772, 1774, 1776, 1796, 1798, 1802, 1809, 1819, 1823, 1824, 1827, 1828, 1835, 1836, 1837, 1838, 1839, 1842, 1844], "deriv_calc_typ": 61, "deriv_dens": 61, "deriv_level": 1817, "derivative_int": 268, "derivcalctyp": [61, 1827], "derricott": [1734, 1781, 1836], "dertyp": [0, 1, 2, 106, 300, 301, 302, 318, 319, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "descend": 63, "descent": [1225, 1279, 1704, 1798, 1802], "describ": [106, 132, 266, 268, 269, 270, 276, 277, 278, 279, 280, 329, 356, 661, 693, 1156, 1206, 1221, 1224, 1230, 1231, 1240, 1437, 1586, 1704, 1714, 1730, 1733, 1740, 1742, 1750, 1753, 1755, 1757, 1761, 1767, 1770, 1771, 1772, 1775, 1776, 1779, 1781, 1782, 1786, 1792, 1794, 1795, 1798, 1802, 1804, 1817, 1824, 1828, 1829, 1831, 1832, 1833, 1834, 1835, 1837, 1838, 1841, 1842, 1844], "descript": [2, 11, 68, 80, 138, 265, 267, 285, 287, 296, 336, 338, 386, 1206, 1692, 1695, 1696, 1697, 1699, 1700, 1701, 1702, 1706, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1740, 1749, 1752, 1753, 1754, 1755, 1757, 1758, 1759, 1768, 1769, 1771, 1772, 1776, 1781, 1792, 1794, 1796, 1798, 1801, 1802, 1803, 1832, 1837, 1842], "descriptive_filenam": 1767, "descriptor": 1750, "deseri": 150, "deshawresearch": [1738, 1806], "design": [2, 87, 100, 691, 1206, 1704, 1714, 1733, 1743, 1751, 1755, 1757, 1767, 1770, 1779, 1804, 1817, 1824, 1828, 1833, 1836, 1838, 1842, 1844], "desir": [0, 138, 329, 342, 356, 446, 454, 484, 523, 547, 550, 551, 616, 823, 829, 884, 930, 958, 1077, 1199, 1200, 1202, 1203, 1206, 1210, 1213, 1219, 1225, 1266, 1290, 1704, 1738, 1742, 1748, 1750, 1753, 1755, 1770, 1771, 1775, 1786, 1788, 1798, 1802, 1805, 1824, 1838, 1841], "despit": [388, 1746, 1759, 1762, 1765, 1773, 1775, 1782, 1783, 1784, 1839, 1841], "destin": [2, 150, 296, 314, 1769, 1791, 1838], "detail": [0, 1, 2, 8, 138, 292, 295, 300, 301, 302, 318, 319, 343, 1106, 1107, 1146, 1147, 1220, 1221, 1224, 1226, 1236, 1324, 1681, 1704, 1714, 1730, 1735, 1736, 1746, 1750, 1752, 1753, 1754, 1755, 1759, 1763, 1766, 1767, 1770, 1772, 1780, 1781, 1788, 1793, 1797, 1799, 1800, 1802, 1803, 1805, 1806, 1809, 1810, 1817, 1821, 1823, 1824, 1828, 1832, 1833, 1836, 1837, 1838, 1839, 1842, 1844], "detca": [891, 1210, 1704], "detci": [150, 295, 314, 400, 806, 838, 861, 882, 883, 887, 891, 1158, 1221, 1704, 1705, 1708, 1709, 1714, 1725, 1739, 1766, 1776, 1781, 1789, 1790, 1791, 1805, 1809, 1834, 1842], "detci__calc_s_squar": 1755, "detci_freeze_cor": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "detci_psivar": 1764, "detect": [2, 106, 1730, 1735, 1738, 1746, 1749, 1759, 1762, 1765, 1768, 1773, 1774, 1775, 1782, 1783, 1784, 1785, 1802, 1803, 1833, 1838, 1839], "determin": [0, 16, 100, 106, 143, 144, 148, 150, 177, 314, 331, 390, 432, 573, 574, 575, 579, 609, 616, 639, 647, 648, 660, 662, 707, 823, 824, 825, 826, 827, 829, 833, 861, 869, 884, 885, 914, 932, 934, 966, 1025, 1026, 1027, 1065, 1099, 1199, 1206, 1210, 1213, 1214, 1217, 1219, 1220, 1224, 1225, 1226, 1229, 1230, 1231, 1236, 1238, 1243, 1267, 1303, 1404, 1416, 1431, 1434, 1472, 1578, 1704, 1708, 1714, 1740, 1742, 1750, 1754, 1755, 1757, 1761, 1763, 1764, 1770, 1771, 1772, 1775, 1776, 1781, 1782, 1788, 1789, 1791, 1794, 1797, 1798, 1801, 1802, 1805, 1810, 1817, 1824, 1829, 1835, 1837, 1838, 1841, 1842], "determinedli": 1743, "deuterium": 1833, "deuteron": 1706, "deuteron_electron_mag_mom_ratio": 1706, "deuteron_electron_mass_ratio": 1706, "deuteron_g_factor": 1706, "deuteron_mag_mom": 1706, "deuteron_mag_mom_to_bohr_magneton_ratio": 1706, "deuteron_mag_mom_to_nuclear_magneton_ratio": 1706, "deuteron_mass": 1706, "deuteron_mass_energy_equival": 1706, "deuteron_mass_energy_equivalent_in_mev": 1706, "deuteron_mass_in_u": 1706, "deuteron_molar_mass": 1706, "deuteron_neutron_mag_mom_ratio": 1706, "deuteron_proton_mag_mom_ratio": 1706, "deuteron_proton_mass_ratio": 1706, "deuteron_rms_charge_radiu": 1706, "dev": [153, 372, 1736, 1737, 1738, 1743, 1752, 1767, 1786, 1788], "dev1": [1786, 1788], "dev17": 1786, "dev249": 1748, "dev417": 1786, "dev525": 1767, "devel": 1738, "develop": [0, 1, 2, 284, 351, 370, 381, 382, 430, 444, 482, 521, 545, 704, 835, 1199, 1200, 1202, 1203, 1206, 1210, 1704, 1734, 1735, 1736, 1737, 1740, 1743, 1747, 1748, 1749, 1752, 1754, 1755, 1757, 1759, 1764, 1767, 1768, 1770, 1775, 1777, 1781, 1782, 1783, 1785, 1786, 1788, 1791, 1802, 1803, 1806, 1816, 1817, 1818, 1819, 1825, 1826, 1829, 1833, 1837, 1838, 1839, 1840], "deviat": [386, 1752, 1757, 1760, 1772, 1776, 1837, 1838], "devic": [672, 1206, 1704], "devis": 1838, "devot": 1770, "devtool": [1748, 1764], "df": [2, 73, 92, 178, 241, 242, 381, 382, 721, 732, 851, 858, 902, 917, 927, 962, 1075, 1106, 1132, 1146, 1147, 1166, 1207, 1208, 1210, 1212, 1213, 1219, 1221, 1230, 1231, 1436, 1455, 1481, 1507, 1609, 1620, 1704, 1708, 1714, 1715, 1720, 1730, 1738, 1739, 1742, 1749, 1750, 1752, 1754, 1757, 1763, 1767, 1770, 1771, 1777, 1781, 1785, 1789, 1790, 1798, 1803, 1806, 1809, 1826, 1828, 1832, 1837, 1838, 1842, 1844], "df_basis_cc": [0, 1, 2, 8, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "df_basis_dct": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "df_basis_elst": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "df_basis_ep2": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "df_basis_guess": [0, 1, 2, 295, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "df_basis_mcscf": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "df_basis_mp2": [0, 1, 2, 8, 326, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "df_basis_sad": [0, 1, 2, 8, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "df_basis_sapt": [0, 1, 2, 1445, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "df_basis_scf": [0, 1, 2, 8, 92, 327, 376, 397, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "df_bump_r0": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "df_bump_r1": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "df_domain": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "df_fitting_condit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "df_ints_io": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "df_ints_num_thread": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "df_metric": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "df_scf_guess": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "df_theta": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dfa": 1757, "dfcasscf": [1714, 1842], "dfcc": [0, 1, 2, 1704, 1708, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dfccd": [1714, 1842], "dfccd1": [1714, 1842], "dfccdl1": [1714, 1842], "dfccsd": [1714, 1842], "dfccsd1": [1714, 1842], "dfccsdat": [1734, 1798], "dfccsdat1": [1714, 1842], "dfccsdat2": [1714, 1842], "dfccsdgrad": [1734, 1798], "dfccsdl1": [1714, 1842], "dfccsdt1": [1714, 1842], "dfccsdt2": [1714, 1842], "dfccsdtgrad": [1734, 1798], "dfdirj": [721, 1166, 1207, 1221, 1704, 1838], "dfdl": 1757, "dfep2": [400, 1704, 1705, 1714, 1842], "dfep2wavefunct": 1827, "dfh": 102, "dfhelper": [102, 1821, 1827], "dfile": [830, 1210, 1704], "dfj": 1838, "dfmp2": [372, 400, 1158, 1221, 1704, 1705, 1708, 1709, 1711, 1714, 1725, 1739, 1743, 1767, 1771, 1808, 1809, 1832, 1833, 1838, 1842], "dfmp2_1": [1714, 1842], "dfmp2_mem_factor": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dfmp2_p2_toler": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dfmp2_p_toler": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dfmp2_wfn": 1809, "dfocc": [400, 930, 949, 958, 1158, 1221, 1704, 1705, 1708, 1709, 1714, 1738, 1790, 1842], "dfoccd": [1734, 1798], "dfolccd": [1734, 1798], "dfomp2": [1714, 1842], "dfomp2grad": [1734, 1798], "dfomp2p5": [1714, 1842], "dfomp3": [1714, 1734, 1798, 1842], "dfomp3grad": [1734, 1798], "dforemp": [1714, 1842], "dfrasscf": [1714, 1842], "dfremp": [1714, 1842], "dfscf": [1714, 1842], "dfsomcscf": 1827, "dft": [84, 92, 106, 110, 147, 150, 267, 295, 296, 300, 301, 302, 306, 314, 318, 319, 400, 739, 1104, 1208, 1221, 1442, 1448, 1450, 1470, 1471, 1512, 1513, 1514, 1518, 1527, 1529, 1530, 1690, 1698, 1703, 1704, 1710, 1714, 1715, 1716, 1718, 1724, 1735, 1739, 1754, 1756, 1759, 1764, 1766, 1767, 1768, 1769, 1772, 1773, 1774, 1776, 1777, 1781, 1790, 1791, 1798, 1800, 1803, 1836, 1838, 1841, 1842], "dft1": [1714, 1842], "dft2": [1714, 1842], "dft3": [1714, 1842], "dft_alpha": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_alpha_c": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_basis_toler": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_block_max_point": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_block_max_radiu": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_block_min_point": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_block_schem": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_bs_radius_alpha": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_builder": 1757, "dft_density_toler": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_dict": 1759, "dft_dispersion_paramet": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_function": [1757, 1798], "dft_grac_alpha": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_grac_beta": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_grac_c_func": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_grac_shift": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_grac_x_func": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_grid_nam": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_nuclear_schem": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_omega": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_omega_c": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_pruning_alpha": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_pruning_schem": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_radial_point": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_radial_schem": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_remove_distant_point": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_spherical_point": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_spherical_schem": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_v2_rho_cutoff": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_vv10_b": [0, 1, 2, 1704, 1714, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "dft_vv10_c": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_vv10_postscf": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_vv10_radial_point": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_vv10_rho_cutoff": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_vv10_spherical_point": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dft_weights_toler": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dftd3": [2, 106, 267, 400, 1738, 1757, 1767, 1770, 1774, 1777, 1780, 1781, 1842], "dftd4": [106, 267, 400, 1738, 1770, 1774, 1780, 1781, 1842], "dftensor": 1827, "dftgrid": [110, 147, 1827], "dga": 1713, "dgasmith": 1751, "dgau2grid_dir": 1773, "dgauss": [1694, 1707, 1731, 1732], "dgdma_dir": 1775, "dgeev": 1810, "dgemm": [1756, 1767, 1810], "dgemv": 1810, "dger": 1810, "dgesv": 1810, "dgesvd": 1810, "dgetr": 1810, "dgetrf": 1810, "dgetri": 1810, "dgma": 1775, "dh": [295, 1695, 1696, 1697, 1698, 1700, 1739, 1757, 1758, 1766, 1776, 1781], "dhccc1": 1833, "dhccc2": 1833, "dhccc3": 1833, "dhdf": [1714, 1842], "dhf": 76, "di": [1121, 1221, 1704, 1734, 1777, 1780, 1781, 1782, 1786, 1804, 1833, 1841], "di6": [1692, 1752], "diag": [835, 842, 1210, 1704], "diag_h": 13, "diag_method": [0, 1, 2, 837, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "diagnost": [11, 1669, 1680, 1776], "diagon": [63, 100, 148, 329, 331, 334, 342, 356, 501, 597, 606, 609, 655, 660, 664, 665, 738, 751, 754, 757, 805, 811, 835, 836, 874, 1005, 1171, 1172, 1200, 1206, 1208, 1215, 1222, 1225, 1229, 1279, 1406, 1407, 1420, 1704, 1708, 1746, 1753, 1755, 1757, 1763, 1771, 1781, 1797, 1798, 1802, 1810, 1824, 1829, 1837, 1838, 1841], "diagonal_ccsd_t": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "diagonalis": [0, 1, 408, 1197, 1704], "diagonalize_heff": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "diagonalizeord": [100, 1827], "diagram": [1069, 1219, 1704, 1771, 1798, 1810], "diagrammat": [0, 1, 295, 381, 382, 1197, 1668, 1738, 1766, 1810, 1826], "diatom": [1231, 1505, 1704, 1777, 1782, 1831], "dichroism": [368, 377, 1790], "dicitonari": [1226, 1304, 1704], "dict": [2, 7, 8, 11, 29, 75, 76, 80, 92, 96, 100, 106, 119, 138, 147, 148, 150, 152, 187, 216, 217, 220, 239, 263, 265, 267, 277, 284, 294, 298, 308, 310, 318, 319, 342, 345, 346, 348, 356, 359, 361, 370, 371, 372, 375, 376, 377, 378, 383, 384, 386, 388, 389, 390, 396, 397, 399, 1714, 1740, 1757, 1759, 1761, 1767, 1768, 1772, 1794, 1800, 1842], "dict_func": 1757, "dictat": 1810, "dictionari": [2, 96, 100, 106, 148, 150, 152, 220, 239, 267, 268, 277, 284, 294, 296, 298, 310, 318, 319, 345, 346, 348, 359, 361, 370, 371, 372, 375, 376, 377, 383, 384, 386, 396, 397, 399, 1226, 1336, 1704, 1740, 1743, 1752, 1757, 1759, 1761, 1767, 1768, 1769, 1794, 1800, 1802, 1809, 1828, 1832, 1835, 1843, 1844], "did": 97, "didn": [1786, 1794, 1828, 1844], "die": [1230, 1480, 1704, 1837], "die_if_not_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dielectr": [779, 780, 1209, 1704, 1754], "dielectric_const": 1754, "diff": [1747, 1770, 1786, 1788], "diff1": [1714, 1842], "differ": [2, 130, 158, 265, 267, 278, 284, 300, 301, 302, 306, 307, 318, 319, 329, 439, 473, 603, 615, 616, 617, 618, 619, 632, 666, 679, 737, 818, 835, 850, 881, 887, 924, 1023, 1024, 1028, 1079, 1150, 1166, 1199, 1200, 1206, 1208, 1210, 1213, 1217, 1219, 1221, 1224, 1225, 1226, 1229, 1231, 1232, 1233, 1257, 1313, 1401, 1410, 1497, 1552, 1666, 1692, 1704, 1706, 1713, 1714, 1724, 1726, 1727, 1738, 1740, 1742, 1743, 1748, 1752, 1753, 1755, 1756, 1757, 1759, 1763, 1764, 1767, 1768, 1771, 1772, 1776, 1782, 1783, 1785, 1788, 1789, 1790, 1794, 1796, 1798, 1800, 1801, 1802, 1803, 1809, 1810, 1815, 1817, 1821, 1823, 1824, 1828, 1829, 1832, 1833, 1834, 1836, 1837, 1838, 1840, 1842, 1843, 1844], "differenti": [615, 666, 707, 1206, 1704, 1714, 1824, 1842], "difficult": [672, 1206, 1704, 1757, 1799, 1802, 1824, 1833, 1834, 1837, 1838], "difficulti": [2, 1767, 1782, 1802, 1838], "diffus": [275, 1730, 1743, 1757, 1763, 1828, 1838, 1844], "digit": [2, 285, 287, 336, 338, 1757, 1795, 1828, 1844], "dihedr": [1226, 1309, 1315, 1320, 1358, 1371, 1704, 1802], "dii": [0, 1, 2, 14, 84, 128, 130, 145, 584, 647, 686, 687, 688, 699, 734, 735, 736, 760, 813, 814, 815, 816, 845, 846, 847, 848, 911, 912, 919, 931, 990, 991, 1001, 1077, 1173, 1176, 1206, 1208, 1209, 1213, 1215, 1219, 1225, 1229, 1230, 1250, 1251, 1252, 1279, 1408, 1409, 1430, 1456, 1458, 1547, 1548, 1550, 1557, 1571, 1615, 1616, 1617, 1704, 1708, 1714, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "diis_enabled_": 84, "diis_freq": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "diis_manager_": 84, "diis_max_vec": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "diis_min_vec": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "diis_rms_error": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "diis_start": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "diis_start_": 84, "diis_start_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "diis_start_it": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dim": [64, 88, 115, 148, 1797], "dim1": [100, 148, 331, 1797], "dim2": [100, 148, 331, 1797], "dimens": [2, 13, 16, 88, 100, 101, 106, 115, 137, 148, 150, 183, 184, 259, 262, 263, 329, 331, 342, 356, 367, 1231, 1551, 1595, 1704, 1743, 1797, 1812, 1814, 1817, 1827, 1828, 1844], "dimension": [150, 262, 263, 1838, 1841], "dimensionless": [572, 1206, 1704], "dimer": [295, 1226, 1336, 1692, 1704, 1708, 1711, 1714, 1722, 1728, 1743, 1752, 1766, 1770, 1776, 1794, 1798, 1806, 1809, 1828, 1832, 1833, 1835, 1837, 1842, 1844], "dimer_wfn": 237, "dimerfrag": 1802, "dimerintro_": 1802, "dimersection_": 1802, "dimethylcyclohexan": 1754, "dimm": [374, 395], "dimpi": [88, 148], "diol": 1833, "dipder": [386, 1714, 1842], "dipmom": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dipmom_au2deby": 1706, "dipmom_au2si": 1706, "dipmom_debye2si": 1706, "dipol": [0, 65, 89, 103, 106, 111, 150, 262, 317, 365, 368, 369, 377, 381, 382, 386, 402, 454, 539, 551, 598, 608, 615, 669, 690, 817, 985, 1078, 1197, 1199, 1203, 1206, 1210, 1214, 1219, 1231, 1586, 1588, 1589, 1657, 1669, 1673, 1685, 1692, 1704, 1706, 1714, 1724, 1726, 1742, 1743, 1752, 1755, 1770, 1771, 1776, 1798, 1799, 1803, 1817, 1826, 1838, 1841, 1842], "dipole_field": 106, "dipole_grad": 103, "dipole_i": [1231, 1589, 1704], "dipole_x": [1231, 1589, 1704], "dipole_z": [1231, 1589, 1704], "dipoleint": [1817, 1827], "dir": [1736, 1738, 1748, 1750, 1767, 1770, 1785, 1787, 1788, 1808], "dir1": 1770, "dir2": 1770, "dirac": [1103, 1221, 1704, 1714, 1781, 1836, 1838, 1842], "dirad": [1829, 1838], "direct": [0, 92, 106, 120, 134, 149, 278, 280, 284, 411, 430, 513, 557, 574, 609, 620, 627, 640, 641, 677, 679, 681, 721, 935, 961, 1166, 1198, 1199, 1202, 1204, 1206, 1207, 1213, 1221, 1225, 1226, 1228, 1231, 1270, 1296, 1346, 1394, 1510, 1586, 1609, 1704, 1714, 1735, 1737, 1738, 1740, 1743, 1748, 1749, 1754, 1757, 1767, 1770, 1781, 1785, 1786, 1788, 1790, 1798, 1801, 1803, 1809, 1810, 1814, 1816, 1819, 1823, 1832, 1840, 1842, 1844], "directclon": 1738, "directjk": [1817, 1827], "directli": [0, 150, 265, 329, 359, 568, 623, 1130, 1206, 1221, 1225, 1226, 1296, 1341, 1704, 1714, 1715, 1716, 1737, 1738, 1740, 1743, 1754, 1770, 1772, 1779, 1782, 1792, 1794, 1798, 1800, 1802, 1817, 1828, 1832, 1833, 1837, 1838, 1842, 1844], "directori": [2, 202, 380, 1043, 1046, 1052, 1109, 1218, 1221, 1704, 1730, 1735, 1736, 1743, 1746, 1748, 1749, 1750, 1752, 1762, 1764, 1765, 1767, 1768, 1770, 1773, 1775, 1781, 1782, 1783, 1784, 1786, 1787, 1788, 1803, 1805, 1806, 1814, 1819, 1823, 1824, 1828, 1832, 1835, 1839, 1842, 1844], "directory_nam": 2, "dirnam": 1748, "dirti": 1786, "disabl": [1231, 1490, 1545, 1629, 1663, 1704, 1735, 1748, 1752, 1757, 1759, 1764, 1822, 1838, 1839], "disallow": [374, 395, 819, 1210, 1704, 1738], "disappear": [786, 1210, 1704], "disc": [1226, 1373, 1704], "discard": [100, 148, 150, 314, 331, 875, 1085, 1145, 1210, 1219, 1221, 1230, 1462, 1704, 1763, 1771, 1791, 1797, 1833, 1837, 1838], "discontinu": [1757, 1776, 1798], "discount": [1024, 1217, 1704], "discourag": [656, 1206, 1704, 1737, 1770, 1810, 1838], "discov": 1837, "discrep": 1837, "discretis": [1780, 1803], "discuss": [0, 608, 1206, 1704, 1738, 1757, 1759, 1770, 1771, 1772, 1781, 1786, 1798, 1800, 1801, 1804, 1813, 1828, 1832, 1837, 1838, 1844], "disengag": [1748, 1786], "disjoint": 2, "disk": [62, 75, 86, 87, 148, 150, 157, 411, 430, 474, 493, 510, 513, 554, 557, 568, 623, 627, 638, 639, 641, 644, 647, 679, 699, 703, 710, 727, 802, 803, 811, 836, 842, 883, 961, 991, 1010, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1206, 1208, 1210, 1213, 1215, 1223, 1226, 1230, 1372, 1435, 1436, 1704, 1714, 1735, 1738, 1742, 1746, 1747, 1750, 1753, 1755, 1756, 1763, 1767, 1801, 1809, 1823, 1824, 1837, 1838, 1842], "disk_df": [1166, 1221, 1231, 1507, 1609, 1620, 1704, 1714, 1838, 1842], "diskdf": [1714, 1842], "diskdfjk": [1231, 1507, 1704], "disksomcscf": 1827, "disp": [76, 106, 267, 346, 1230, 1444, 1454, 1469, 1470, 1475, 1678, 1679, 1689, 1704, 1714, 1743, 1759, 1770, 1776, 1802, 1828, 1837, 1842, 1844], "disp2": [346, 1230, 1470, 1689, 1704, 1776, 1837], "disp20": [346, 1679, 1689, 1714, 1776, 1828, 1837, 1842, 1844], "disp21": [1689, 1776, 1837], "disp22": [346, 1689, 1776, 1837], "disp30": [1689, 1776, 1837], "disp_siz": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dispar": [1226, 1341, 1704], "dispe20": 76, "dispers": [76, 106, 138, 267, 295, 394, 400, 1012, 1013, 1039, 1216, 1218, 1230, 1231, 1447, 1448, 1451, 1460, 1468, 1470, 1476, 1477, 1481, 1521, 1582, 1690, 1692, 1695, 1696, 1698, 1699, 1700, 1701, 1702, 1704, 1714, 1734, 1752, 1766, 1770, 1774, 1776, 1780, 1781, 1790, 1827, 1828, 1837, 1842, 1844], "dispersionless": [295, 318, 319, 1695, 1698, 1700, 1702, 1703, 1714, 1758, 1766, 1800, 1842], "displac": [15, 16, 134, 386, 388, 551, 573, 1023, 1150, 1203, 1206, 1217, 1221, 1226, 1349, 1364, 1692, 1704, 1706, 1714, 1742, 1752, 1802, 1824, 1828, 1842, 1844], "displai": [0, 1738, 1767, 1781, 1833, 1838], "disregard": [1229, 1419, 1704, 1735, 1798], "dissoci": [1692, 1714, 1743, 1752, 1832, 1842], "distanc": [106, 149, 299, 309, 349, 360, 1226, 1299, 1303, 1310, 1321, 1326, 1341, 1359, 1704, 1714, 1759, 1802, 1828, 1837, 1842, 1844], "distance_matrix": 106, "distant": 1763, "distinct": [0, 329, 1752, 1794, 1810, 1817, 1828, 1835, 1844], "distinguish": [2, 1034, 1218, 1704, 1837], "distort": [1714, 1833, 1842], "distribut": [271, 350, 351, 1220, 1231, 1551, 1606, 1661, 1681, 1704, 1714, 1719, 1734, 1736, 1737, 1738, 1743, 1752, 1767, 1770, 1776, 1777, 1780, 1781, 1787, 1789, 1794, 1806, 1808, 1814, 1824, 1832, 1842], "distributed_matrix": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ditto": 1738, "diverg": 1782, "divers": 1824, "divert": 1794, "divid": [12, 1752, 1757, 1770], "dk": [1694, 1707, 1714, 1731, 1732, 1733, 1762, 1836, 1842], "dkh": [103, 284, 400, 1103, 1221, 1704, 1736, 1738, 1740, 1777, 1780, 1785, 1836, 1842], "dkh_dir": 1762, "dkh_mangl": 1762, "dkh_order": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dkhconfig": 1762, "dl": [724, 1207, 1694, 1704, 1707, 1731, 1732, 1733], "dlapack_include_dir": 1738, "dlapack_librari": 1738, "dlapack_typ": 1738, "dlbtn": 1788, "dldf": [295, 318, 319, 1695, 1698, 1700, 1702, 1703, 1714, 1758, 1766, 1800, 1842], "dlibefp_dir": 1782, "dlibint_dir2": 1783, "dlibxc_dir": 1784, "dlpno": [295, 400, 964, 975, 1704, 1705, 1709, 1714, 1766, 1777, 1781, 1790, 1842], "dlpno_algorithm": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dlpno_local_orbit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dlpno_maxit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dlpnomp2": [1714, 1763, 1842], "dm": 1776, "dma": [303, 1098, 1099, 1101, 1220, 1681, 1704, 1775, 1776], "dma_result": 1775, "dmax_am_eri": 1738, "dmp2": [267, 295, 1689, 1714, 1759, 1766, 1776, 1837, 1842], "dmrcc": [1767, 1792], "dmrg": [295, 400, 986, 989, 990, 993, 995, 997, 999, 1000, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1704, 1705, 1709, 1712, 1738, 1766, 1776, 1780], "dmrg_": 1746, "dmrg_caspt2_calc": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dmrg_caspt2_imag": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dmrg_caspt2_ipea": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dmrg_caspt2_orb": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dmrg_dii": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dmrg_diis_writ": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dmrg_excit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dmrg_irrep": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dmrg_local_init": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dmrg_molden_writ": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dmrg_mps_write": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dmrg_multipl": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dmrg_opdm_ao_print": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dmrg_print_corr": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dmrg_scf_active_spac": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dmrg_scf_diis_thr": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dmrg_scf_grad_thr": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dmrg_scf_max_it": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dmrg_scf_state_avg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dmrg_sweep_dvdson_rtol": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dmrg_sweep_energy_conv": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dmrg_sweep_max_sweep": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dmrg_sweep_noise_prefac": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dmrg_sweep_stat": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dmrg_unitary_writ": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dmrgscf": [986, 989, 1215, 1704, 1746], "dna": 1781, "dne": [655, 665, 1206, 1704], "dnrm2": 1810, "do": [0, 2, 8, 11, 84, 92, 106, 138, 150, 314, 324, 329, 335, 374, 395, 417, 424, 425, 426, 427, 429, 438, 440, 441, 448, 451, 453, 457, 458, 459, 460, 463, 468, 477, 478, 481, 486, 493, 494, 498, 501, 503, 509, 510, 515, 517, 520, 530, 532, 534, 536, 538, 540, 541, 544, 554, 555, 586, 644, 656, 660, 664, 675, 688, 697, 713, 718, 786, 787, 788, 792, 795, 799, 801, 802, 803, 804, 807, 809, 812, 813, 817, 821, 822, 823, 831, 836, 838, 839, 846, 855, 859, 860, 861, 863, 864, 865, 866, 867, 872, 875, 882, 883, 885, 886, 887, 888, 909, 910, 913, 915, 917, 919, 920, 921, 922, 925, 934, 940, 941, 942, 945, 952, 954, 956, 986, 1011, 1012, 1014, 1016, 1017, 1019, 1020, 1022, 1024, 1025, 1026, 1027, 1038, 1039, 1042, 1044, 1045, 1047, 1064, 1069, 1073, 1074, 1076, 1083, 1087, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1124, 1157, 1171, 1172, 1173, 1175, 1179, 1182, 1183, 1186, 1198, 1199, 1200, 1201, 1202, 1203, 1206, 1207, 1210, 1212, 1213, 1215, 1216, 1217, 1218, 1219, 1221, 1222, 1225, 1226, 1229, 1230, 1231, 1244, 1252, 1258, 1259, 1260, 1261, 1262, 1264, 1268, 1270, 1276, 1277, 1278, 1280, 1288, 1295, 1298, 1300, 1316, 1317, 1330, 1334, 1361, 1369, 1370, 1404, 1406, 1407, 1411, 1413, 1414, 1415, 1418, 1419, 1420, 1428, 1430, 1431, 1434, 1435, 1436, 1447, 1451, 1452, 1459, 1460, 1461, 1480, 1491, 1510, 1546, 1557, 1558, 1560, 1566, 1570, 1578, 1585, 1587, 1593, 1594, 1596, 1606, 1610, 1612, 1643, 1647, 1704, 1714, 1736, 1737, 1742, 1746, 1750, 1753, 1754, 1755, 1756, 1757, 1767, 1768, 1770, 1771, 1772, 1781, 1785, 1787, 1789, 1791, 1798, 1801, 1808, 1810, 1814, 1817, 1824, 1828, 1829, 1832, 1833, 1837, 1838, 1839, 1841, 1842, 1844], "do_ccd_disp": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "do_cd": 1809, "do_cub": 76, "do_dii": [0, 1, 2, 1279, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "do_disp_exch_sinf": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "do_incfock_it": [18, 66], "do_ind30_exch_sinf": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "do_ind_exch_sinf": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "do_level_shift": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "do_mbpt_disp": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "do_mirror": 106, "do_plot": 106, "do_resort": 106, "do_rot": 106, "do_sc": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "do_shift": 106, "do_so": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "do_third_ord": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "do_virtu": 150, "do_wk": 92, "doc": [268, 323, 1736, 1737, 1738, 1748, 1764, 1786, 1787, 1788, 1804, 1808, 1810, 1814, 1815, 1823, 1828], "docc": [0, 1, 2, 13, 1168, 1172, 1704, 1714, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "doccpi": 150, "doccupi": [589, 1206, 1704], "docker": 1787, "dockerhub": 1788, "docstr": [3, 6, 7, 8, 9, 12, 13, 14, 18, 19, 21, 22, 23, 24, 25, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 66, 67, 68, 75, 77, 78, 80, 84, 85, 86, 90, 92, 96, 102, 105, 108, 111, 114, 119, 123, 128, 129, 130, 131, 133, 138, 145, 146, 147, 150, 183, 184, 233, 1764, 1808], "doctsr": [30, 147], "document": [0, 1, 3, 5, 6, 7, 8, 9, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 26, 27, 29, 30, 61, 62, 63, 64, 66, 68, 70, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 86, 87, 88, 89, 90, 91, 92, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 108, 110, 111, 112, 113, 114, 115, 118, 119, 120, 122, 126, 128, 130, 131, 132, 133, 134, 135, 137, 138, 139, 140, 141, 143, 144, 145, 147, 148, 149, 150, 183, 184, 267, 275, 292, 321, 322, 323, 324, 325, 326, 327, 329, 343, 671, 1206, 1704, 1734, 1738, 1743, 1750, 1752, 1754, 1756, 1757, 1759, 1767, 1770, 1777, 1781, 1782, 1787, 1795, 1796, 1803, 1804, 1805, 1806, 1808, 1815, 1817, 1823, 1828, 1831, 1832, 1833, 1837, 1838], "document_psivari": 1764, "doe": [2, 8, 84, 106, 138, 150, 255, 278, 284, 329, 351, 380, 640, 661, 738, 761, 774, 874, 887, 946, 1121, 1124, 1206, 1208, 1209, 1210, 1213, 1221, 1224, 1225, 1240, 1281, 1704, 1714, 1730, 1736, 1738, 1740, 1743, 1748, 1754, 1755, 1756, 1767, 1768, 1770, 1774, 1781, 1785, 1801, 1802, 1817, 1824, 1828, 1829, 1833, 1837, 1838, 1842, 1843, 1844], "doesn": [153, 370, 605, 697, 1206, 1704, 1714, 1735, 1738, 1740, 1743, 1748, 1770, 1774, 1786, 1788, 1801, 1809, 1842], "doi": [297, 347, 377, 967, 968, 969, 970, 980, 981, 982, 1231, 1616, 1617, 1692, 1704, 1714, 1734, 1740, 1752, 1761, 1762, 1776, 1781, 1842], "doi_": 1763, "doi_basis_toler": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "doi_pruning_schem": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "doi_radial_point": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "doi_spherical_point": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dollar": [1764, 1832], "domain": [295, 322, 324, 325, 443, 445, 479, 519, 522, 543, 546, 978, 979, 980, 982, 983, 1199, 1200, 1202, 1203, 1209, 1214, 1231, 1505, 1672, 1704, 1738, 1754, 1766, 1776, 1777, 1782, 1790, 1803, 1828, 1844], "domin": [2, 342, 1692, 1752, 1828, 1837, 1838, 1844], "domo": 1750, "don": [2, 84, 786, 1210, 1704, 1737, 1738, 1743, 1748, 1757, 1764, 1785, 1786, 1788, 1801, 1809, 1810, 1828, 1838, 1844], "donchev": 1734, "done": [277, 295, 342, 356, 570, 664, 764, 986, 989, 1206, 1209, 1215, 1704, 1714, 1738, 1743, 1746, 1748, 1753, 1754, 1756, 1760, 1763, 1766, 1767, 1781, 1801, 1804, 1808, 1828, 1836, 1838, 1842, 1844], "dopenmp_cxx_flag": 1738, "dopenmp_library_dir": 1738, "doption": 1808, "dot": [11, 100, 148, 149, 329, 1738, 1740, 1810, 1835], "doubl": [0, 1, 89, 92, 95, 103, 114, 150, 159, 171, 175, 176, 211, 212, 238, 239, 246, 248, 254, 255, 262, 284, 295, 318, 319, 376, 381, 382, 397, 400, 401, 408, 415, 432, 436, 437, 439, 442, 443, 449, 450, 455, 470, 472, 473, 479, 491, 496, 499, 500, 518, 519, 529, 542, 543, 552, 666, 714, 722, 729, 736, 737, 738, 739, 740, 744, 747, 752, 754, 759, 761, 772, 774, 777, 779, 780, 781, 818, 835, 841, 850, 852, 854, 856, 857, 873, 876, 884, 893, 902, 903, 904, 905, 907, 908, 916, 923, 924, 928, 930, 933, 936, 937, 938, 939, 943, 949, 953, 955, 957, 958, 967, 971, 972, 973, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 987, 988, 1001, 1002, 1023, 1029, 1030, 1034, 1051, 1053, 1054, 1055, 1058, 1067, 1068, 1072, 1079, 1081, 1082, 1084, 1085, 1086, 1101, 1110, 1113, 1131, 1135, 1137, 1140, 1174, 1178, 1184, 1188, 1196, 1197, 1198, 1199, 1200, 1202, 1203, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1245, 1246, 1247, 1256, 1257, 1265, 1266, 1269, 1271, 1272, 1273, 1274, 1275, 1283, 1285, 1287, 1289, 1290, 1294, 1299, 1301, 1303, 1326, 1328, 1331, 1332, 1335, 1340, 1341, 1343, 1344, 1345, 1348, 1349, 1350, 1351, 1353, 1362, 1364, 1365, 1366, 1382, 1387, 1388, 1389, 1396, 1405, 1410, 1424, 1427, 1438, 1440, 1442, 1444, 1455, 1462, 1469, 1473, 1474, 1476, 1478, 1481, 1482, 1486, 1487, 1488, 1489, 1497, 1498, 1499, 1503, 1504, 1506, 1511, 1512, 1513, 1514, 1516, 1519, 1520, 1522, 1523, 1525, 1529, 1530, 1531, 1538, 1539, 1540, 1543, 1545, 1552, 1555, 1556, 1567, 1569, 1570, 1571, 1572, 1573, 1588, 1598, 1600, 1602, 1603, 1604, 1605, 1616, 1617, 1618, 1621, 1622, 1627, 1638, 1644, 1648, 1650, 1654, 1660, 1665, 1667, 1669, 1674, 1675, 1676, 1680, 1684, 1690, 1695, 1697, 1698, 1700, 1702, 1704, 1714, 1740, 1741, 1743, 1744, 1745, 1746, 1748, 1749, 1754, 1755, 1764, 1766, 1770, 1775, 1776, 1785, 1789, 1792, 1793, 1795, 1800, 1801, 1806, 1809, 1810, 1817, 1826, 1828, 1829, 1837, 1838, 1841, 1842, 1843, 1844], "doublet": [100, 314, 576, 1206, 1704, 1714, 1791, 1837, 1838, 1842], "doubli": [150, 1123, 1127, 1164, 1177, 1221, 1222, 1692, 1704, 1742, 1750, 1752, 1755, 1776, 1789, 1801, 1810, 1829, 1833, 1838], "doubt": [1838, 1843], "dougla": [1122, 1221, 1704, 1730, 1762], "douglass": 1836, "dovirtu": [104, 314, 1791], "dowload": 1806, "down": [2, 342, 1231, 1508, 1704, 1738, 1743, 1767, 1770, 1774, 1786, 1804, 1837, 1838, 1841], "downhil": [1828, 1844], "download": [1735, 1736, 1737, 1738, 1743, 1749, 1750, 1759, 1767, 1773, 1774, 1782, 1783, 1784, 1785, 1787, 1803, 1805, 1806, 1824], "download_command": 1738, "downloads_updat": 1788, "downsampl": 1788, "downstream": [1, 1738, 1746, 1749, 1754, 1762, 1765, 1773, 1775, 1782, 1783, 1784, 1788, 1803, 1839], "doxygen": [993, 1215, 1704, 1746], "dozen": [1742, 1755, 1782], "dpd": [728, 849, 1208, 1210, 1704, 1708], "dpd_id": 90, "dpd_info": 187, "dpdbuf4": 1827, "dpdfile2": 1827, "dpotr": 1810, "dpotrf": 1810, "dpotri": 1810, "dpt": [677, 1206, 1704], "dpt2": [677, 1206, 1704], "dpt4": [677, 1206, 1704], "dpt6": [677, 1206, 1704], "dpython_execut": 1738, "dpython_include_dir": 1738, "dpython_librari": 1738, "dq0": [386, 1772], "dqg": 1729, "dr": [1757, 1788], "draft": 1788, "draw": 1804, "drawback": 1837, "drc": 13, "dreuw": [0, 1734, 1781], "dreuw2005": [1734, 1841], "drink": [605, 1206, 1704], "drive": [342, 356, 1743, 1767, 1801, 1802, 1824, 1843], "driven": [1743, 1807, 1823, 1824], "driver": [2, 84, 106, 150, 235, 236, 250, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 1070, 1076, 1088, 1219, 1231, 1629, 1704, 1711, 1714, 1730, 1735, 1736, 1740, 1743, 1752, 1755, 1757, 1759, 1761, 1764, 1767, 1768, 1769, 1771, 1777, 1779, 1785, 1794, 1797, 1800, 1808, 1812, 1819, 1828, 1831, 1832, 1834, 1837, 1838, 1841, 1842, 1843, 1844], "driver_cb": [284, 1740, 1794], "driver_cbs_help": 1740, "driver_findif": [1772, 1794], "driver_nbodi": [1768, 1794], "driver_nbody_multilevel": 1794, "driverenum": [265, 1740, 1768, 1772, 1794], "drop": [0, 344, 601, 1043, 1046, 1052, 1206, 1218, 1704, 1738, 1743, 1763, 1781, 1788], "dropped_docc": 1810, "dropped_uocc": 1810, "drot": 1810, "drv": 13, "dsd": [295, 1695, 1696, 1697, 1698, 1700, 1702, 1714, 1758, 1766, 1842], "dsimint_dir": 1839, "dsyev": 1810, "dsymm": 1810, "dsymv": 1810, "dt": [284, 295, 1112, 1221, 1704, 1708, 1714, 1740, 1741, 1743, 1750, 1766, 1779, 1832, 1842], "dto": 1833, "dtq": [284, 1733, 1740], "dtq5": 1733, "dtq56": [1730, 1733], "dtrmm": 1810, "dtrmv": 1810, "dtrsm": 1810, "dtype": [106, 1768], "du": [1734, 1841], "dual": [1707, 1730, 1731, 1750, 1838], "dual_descriptor": [1112, 1221, 1704, 1750], "dual_n_homo": [1112, 1221, 1704, 1750], "dub": 1840, "due": [586, 727, 1206, 1208, 1226, 1231, 1335, 1626, 1629, 1634, 1704, 1714, 1724, 1743, 1748, 1753, 1756, 1757, 1763, 1782, 1799, 1802, 1808, 1810, 1824, 1829, 1837, 1838, 1841, 1842], "dum": 98, "dummi": [106, 318, 319, 380, 386, 1714, 1726, 1740, 1768, 1772, 1785, 1788, 1794, 1800, 1802, 1835, 1842], "dump": [21, 644, 767, 1104, 1206, 1209, 1221, 1704, 1754, 1788, 1801], "dun": [1707, 1730, 1731, 1836], "duplic": [150, 263, 344], "durat": 1743, "dure": [84, 87, 92, 106, 656, 679, 699, 706, 756, 972, 982, 1002, 1005, 1006, 1007, 1009, 1099, 1179, 1206, 1208, 1214, 1215, 1220, 1222, 1231, 1565, 1641, 1642, 1704, 1711, 1714, 1737, 1738, 1746, 1757, 1759, 1767, 1768, 1770, 1774, 1775, 1799, 1802, 1817, 1824, 1828, 1833, 1838, 1842, 1844], "duti": 1738, "dvec": [867, 1210, 1673, 1704, 1776], "dvipng": 1764, "dvirtual": [589, 1206, 1704], "dx": [388, 1231, 1583, 1589, 1704, 1714, 1842], "dy": [388, 1714, 1842], "dyld_library_path": 1808, "dylib": 1738, "dyn": [673, 1206, 1704], "dyn_hyp": [669, 1206, 1704], "dyn_pol": [669, 1206, 1704], "dynam": [293, 669, 673, 1206, 1226, 1305, 1344, 1345, 1704, 1714, 1738, 1756, 1763, 1802, 1822, 1838, 1842], "dynamic_level": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "dz": [388, 1694, 1707, 1714, 1730, 1731, 1732, 1733, 1802, 1842], "dzp": [1694, 1707, 1711, 1714, 1731, 1732, 1733, 1743, 1802, 1842], "dzvp": [1694, 1707, 1731, 1732], "e": [0, 2, 8, 11, 74, 76, 81, 84, 106, 139, 150, 226, 265, 266, 267, 268, 270, 276, 285, 287, 288, 289, 291, 295, 296, 297, 300, 301, 302, 314, 317, 318, 319, 322, 325, 336, 338, 339, 340, 341, 346, 347, 354, 356, 365, 374, 377, 386, 393, 395, 433, 444, 466, 482, 507, 514, 574, 575, 586, 609, 668, 669, 680, 697, 781, 795, 823, 875, 884, 893, 1002, 1106, 1107, 1147, 1199, 1200, 1201, 1202, 1206, 1209, 1210, 1211, 1215, 1221, 1224, 1225, 1226, 1228, 1229, 1230, 1231, 1232, 1235, 1241, 1242, 1327, 1380, 1434, 1438, 1453, 1478, 1490, 1506, 1543, 1658, 1666, 1692, 1704, 1706, 1708, 1713, 1714, 1722, 1730, 1734, 1737, 1738, 1740, 1743, 1746, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1759, 1760, 1763, 1764, 1766, 1767, 1768, 1769, 1770, 1772, 1774, 1776, 1777, 1779, 1780, 1782, 1785, 1786, 1787, 1789, 1791, 1792, 1794, 1795, 1799, 1800, 1802, 1804, 1805, 1808, 1809, 1812, 1814, 1817, 1824, 1828, 1829, 1832, 1833, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "e0": [390, 1706], "e10": 1706, "e11": 1706, "e12": 1706, "e13": 1706, "e14": 1706, "e15": 1706, "e17": 1706, "e18": 1706, "e19": 1706, "e2014": 1781, "e21": 1706, "e22": 1706, "e23": 1706, "e24": 1706, "e25": 1706, "e25945": 1734, "e26": 1706, "e32": 1706, "e33": 1706, "e34": 1706, "e35": 1706, "e39": 1706, "e3_scal": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "e4": 1706, "e41": 1706, "e5": 1706, "e50": 1706, "e6": 1706, "e7": 1706, "e8": 1706, "e9": 1706, "e_": [284, 864, 1029, 1210, 1218, 1230, 1442, 1444, 1454, 1704, 1740, 1741, 1753, 1756, 1757, 1759, 1760, 1763, 1776, 1837, 1838], "e_0": 1771, "e_c": 1771, "e_conv": [84, 276], "e_converg": [0, 1, 2, 326, 432, 930, 958, 1086, 1266, 1290, 1605, 1704, 1730, 1733, 1735, 1739, 1740, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "e_h": [1706, 1776, 1795], "e_int": [1828, 1844], "e_mp2": [1832, 1834], "e_mp25": 1834, "e_mp3": 1834, "e_scf": 1834, "e_scs_mp2": 1832, "e_tdm_len": [1231, 1657, 1704, 1841], "e_tdm_vel": [1231, 1657, 1704, 1841], "ea": [104, 1714, 1777, 1780, 1842], "ea_pol": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "each": [0, 2, 92, 106, 110, 111, 154, 155, 156, 157, 158, 159, 182, 259, 277, 284, 286, 295, 298, 318, 319, 327, 329, 337, 342, 348, 356, 470, 551, 569, 593, 609, 659, 660, 784, 787, 794, 819, 823, 842, 897, 1032, 1033, 1069, 1097, 1115, 1116, 1125, 1126, 1200, 1203, 1206, 1210, 1211, 1218, 1219, 1220, 1221, 1224, 1229, 1230, 1231, 1241, 1431, 1432, 1434, 1462, 1650, 1704, 1714, 1730, 1733, 1738, 1740, 1742, 1743, 1750, 1752, 1753, 1754, 1757, 1759, 1763, 1764, 1766, 1767, 1768, 1770, 1771, 1772, 1775, 1776, 1779, 1781, 1782, 1786, 1794, 1798, 1799, 1800, 1801, 1802, 1808, 1809, 1810, 1817, 1824, 1828, 1829, 1832, 1833, 1835, 1837, 1838, 1841, 1842, 1844], "earli": [2, 1231, 1490, 1499, 1704, 1757, 1781, 1783, 1817, 1824, 1837, 1838], "earlier": [170, 1738, 1759, 1770], "earliest": [1738, 1824], "eas": [1730, 1781], "easi": [1737, 1740, 1752, 1757, 1764, 1767, 1770, 1778, 1786, 1797, 1817, 1824, 1838], "easier": [1102, 1221, 1704, 1736, 1738, 1755, 1767, 1798, 1799, 1810, 1819, 1828, 1833, 1838, 1844], "easiest": [2, 1738, 1755], "easili": [2, 1751, 1753, 1755, 1759, 1767, 1804, 1810, 1824, 1828, 1836, 1844], "easiset": 1844, "eb": [104, 374, 395], "ecc": [586, 1206, 1704, 1711, 1743], "ecd": [377, 1841], "ecd_residu": 1841, "ecd_spectrum": 1841, "echo": [1738, 1748, 1767, 1808], "ecosystem": [1786, 1787, 1824, 1832], "ecp": [8, 106, 1125, 1221, 1228, 1392, 1704, 1714, 1738, 1743, 1765, 1771, 1774, 1790, 1828, 1832, 1837, 1842, 1844], "ecp2": [1714, 1842], "ecp3": [1714, 1842], "ecp_shel": 8, "ecp_shell_on_cent": 8, "ecpint": [1738, 1765], "ecpint_dir": 1765, "ed": [1692, 1743, 1752, 1770, 1781], "edeprince3": 1738, "edf1": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "edf2": [295, 318, 319, 1695, 1698, 1700, 1703, 1758, 1766, 1800], "edfmp2": 1832, "edg": [0, 1750, 1781], "edii": [1231, 1550, 1615, 1704, 1714, 1838, 1842], "edim": 1837, "edit": [2, 1734, 1738, 1759, 1764, 1767, 1774, 1783, 1785, 1786, 1788, 1804, 1808, 1834, 1835], "editor": [1777, 1814, 1844], "edu": [2, 285, 296, 336, 1692, 1748, 1750, 1752, 1769, 1781], "edward": [1783, 1837], "eff": 1829, "effect": [8, 106, 111, 130, 247, 284, 295, 441, 471, 477, 478, 517, 574, 602, 611, 632, 633, 634, 639, 652, 656, 677, 694, 746, 810, 827, 1070, 1076, 1088, 1096, 1199, 1200, 1201, 1202, 1206, 1208, 1210, 1216, 1219, 1229, 1407, 1412, 1413, 1414, 1519, 1615, 1678, 1704, 1738, 1740, 1742, 1748, 1753, 1757, 1759, 1762, 1766, 1770, 1771, 1781, 1788, 1790, 1794, 1798, 1801, 1802, 1804, 1810, 1821, 1829, 1832, 1836, 1837, 1839], "effici": [106, 356, 471, 635, 652, 726, 1200, 1206, 1208, 1229, 1230, 1231, 1431, 1432, 1443, 1663, 1704, 1734, 1738, 1739, 1753, 1755, 1756, 1757, 1759, 1763, 1767, 1774, 1781, 1798, 1802, 1810, 1817, 1821, 1824, 1831, 1833, 1837, 1838, 1841], "effort": [1757, 1763, 1767, 1771, 1822, 1838], "efp": [103, 295, 318, 319, 400, 1011, 1012, 1014, 1015, 1016, 1017, 1019, 1020, 1022, 1704, 1705, 1709, 1722, 1738, 1766, 1767, 1776, 1780, 1781, 1785, 1800, 1809, 1832, 1838], "efp_disp": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "efp_disp_damp": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "efp_elst": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "efp_elst_damp": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "efp_exch": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "efp_ind": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "efp_ind_damp": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "efp_pol": [1017, 1216, 1704], "efp_pol_damp": [1018, 1216, 1704], "efp_qm_elst": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "efp_qm_ind": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "efpfrag": 1785, "efzc": 150, "eg": [284, 1740], "egidi": 1734, "eh": [106, 267, 377, 386, 390, 399, 1752, 1756, 1759, 1761, 1774, 1776, 1828, 1844], "ehlert": 1734, "ehrlich": 1734, "ei": 1799, "eigen": [1735, 1738], "eigendecomposit": [1714, 1838, 1842], "eigenfunct": [1757, 1838], "eigenpair": 342, "eigenproblem": [0, 1841], "eigensolv": 1841, "eigenvalu": [0, 63, 115, 150, 277, 297, 329, 342, 347, 356, 603, 609, 640, 656, 681, 756, 799, 811, 1206, 1208, 1210, 1230, 1231, 1462, 1506, 1602, 1690, 1704, 1755, 1756, 1776, 1798, 1810, 1829, 1837, 1838, 1841], "eigenvector": [342, 356, 389, 603, 635, 638, 652, 667, 681, 830, 1206, 1210, 1226, 1231, 1362, 1556, 1649, 1669, 1704, 1708, 1757, 1776, 1785, 1810, 1829, 1838, 1841], "eight": [1692, 1752, 1838], "eigvalu": 100, "eigvector": 100, "einstein": [1669, 1753, 1776], "einsum": [185, 1738], "either": [2, 75, 92, 100, 106, 148, 208, 209, 210, 318, 319, 350, 371, 569, 577, 593, 660, 666, 706, 781, 845, 889, 1156, 1206, 1209, 1210, 1221, 1226, 1228, 1229, 1231, 1339, 1368, 1384, 1433, 1655, 1704, 1714, 1730, 1735, 1738, 1748, 1749, 1752, 1754, 1757, 1764, 1767, 1774, 1781, 1785, 1788, 1795, 1797, 1800, 1801, 1802, 1803, 1808, 1809, 1810, 1817, 1828, 1833, 1837, 1838, 1841, 1842, 1844], "ek": 1737, "ekt": [1225, 1295, 1704], "ekt_ea": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ekt_ip": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "elabor": [279, 701, 1206, 1704, 1832, 1833], "elbl": [106, 1768], "elea": [106, 1768], "elec": 1843, "electon": 1776, "electostat": 1837, "electr": [71, 89, 103, 402, 539, 604, 669, 674, 709, 711, 712, 776, 1197, 1203, 1206, 1209, 1231, 1657, 1704, 1706, 1714, 1742, 1754, 1770, 1776, 1799, 1817, 1841, 1842], "electric_const": 1706, "electric_field": [89, 103], "electric_field_valu": 103, "electricfieldint": [1817, 1827], "electron": [0, 2, 8, 13, 26, 69, 76, 84, 90, 94, 103, 112, 128, 144, 150, 268, 284, 285, 286, 294, 295, 297, 298, 300, 301, 302, 306, 307, 317, 318, 319, 336, 337, 345, 347, 348, 365, 368, 377, 386, 390, 422, 476, 531, 559, 608, 613, 619, 625, 669, 671, 677, 679, 693, 695, 727, 745, 782, 785, 789, 790, 796, 797, 798, 835, 858, 859, 860, 875, 877, 878, 879, 890, 895, 942, 1125, 1156, 1167, 1198, 1200, 1202, 1204, 1206, 1208, 1210, 1211, 1213, 1221, 1225, 1230, 1258, 1261, 1263, 1278, 1459, 1461, 1690, 1704, 1706, 1711, 1714, 1730, 1734, 1738, 1739, 1740, 1742, 1750, 1753, 1755, 1756, 1757, 1760, 1762, 1766, 1767, 1768, 1770, 1772, 1776, 1777, 1781, 1785, 1786, 1789, 1790, 1791, 1792, 1798, 1800, 1803, 1805, 1809, 1810, 1823, 1824, 1828, 1829, 1833, 1835, 1836, 1837, 1838, 1839, 1842, 1843, 1844], "electron_charge_to_mass_quoti": 1706, "electron_deuteron_mag_mom_ratio": 1706, "electron_deuteron_mass_ratio": 1706, "electron_g_factor": 1706, "electron_gyromag_ratio": 1706, "electron_gyromag_ratio_over_2_pi": 1706, "electron_helion_mass_ratio": 1706, "electron_mag_mom": 1706, "electron_mag_mom_anomali": 1706, "electron_mag_mom_to_bohr_magneton_ratio": 1706, "electron_mag_mom_to_nuclear_magneton_ratio": 1706, "electron_mass": 1706, "electron_mass_energy_equival": 1706, "electron_mass_energy_equivalent_in_mev": 1706, "electron_mass_in_u": 1706, "electron_molar_mass": 1706, "electron_muon_mag_mom_ratio": 1706, "electron_muon_mass_ratio": 1706, "electron_neutron_mag_mom_ratio": 1706, "electron_neutron_mass_ratio": 1706, "electron_proton_mag_mom_ratio": 1706, "electron_proton_mass_ratio": 1706, "electron_schem": 1750, "electron_tau_mass_ratio": 1706, "electron_to_alpha_particle_mass_ratio": 1706, "electron_to_shielded_helion_mag_mom_ratio": 1706, "electron_to_shielded_proton_mag_mom_ratio": 1706, "electron_triton_mass_ratio": 1706, "electron_volt": 1706, "electron_volt_atomic_mass_unit_relationship": 1706, "electron_volt_hartree_relationship": 1706, "electron_volt_hertz_relationship": 1706, "electron_volt_inverse_meter_relationship": 1706, "electron_volt_joule_relationship": 1706, "electron_volt_kelvin_relationship": 1706, "electron_volt_kilogram_relationship": 1706, "electrophil": 1750, "electrostat": [72, 76, 89, 103, 111, 150, 1014, 1015, 1019, 1216, 1230, 1464, 1692, 1704, 1714, 1730, 1733, 1750, 1752, 1770, 1776, 1791, 1799, 1803, 1828, 1837, 1842, 1844], "electrostatic_potential_valu": 103, "electrostaticint": [1817, 1827], "eleg": 1844, "elem": [106, 1768], "element": [0, 2, 13, 64, 88, 100, 106, 137, 148, 295, 300, 301, 302, 318, 319, 329, 388, 400, 509, 550, 575, 615, 627, 667, 684, 836, 874, 1126, 1201, 1203, 1206, 1210, 1221, 1225, 1230, 1279, 1445, 1704, 1730, 1733, 1740, 1742, 1753, 1754, 1756, 1757, 1759, 1763, 1766, 1768, 1770, 1772, 1774, 1777, 1782, 1794, 1798, 1800, 1802, 1803, 1810, 1817, 1823, 1829, 1833, 1835, 1837, 1838, 1843, 1844], "elementari": [1706, 1755, 1777], "elementary_charg": 1706, "elementary_charge_over_h": 1706, "elev": 323, "elez": [106, 1768], "elf": [1112, 1221, 1704, 1750], "elfa": [1112, 1221, 1704, 1750], "elfb": [1112, 1221, 1704, 1750], "elif": 1809, "elimin": [73, 628, 794, 833, 885, 1206, 1210, 1704, 1817, 1838], "ell_": 1733, "elong": 1817, "els": [86, 106, 200, 875, 934, 1025, 1026, 1027, 1210, 1213, 1217, 1231, 1578, 1704, 1759, 1763, 1772, 1774, 1775, 1787, 1788, 1791, 1809], "elsewher": [1736, 1767, 1815], "elst": [76, 346, 1678, 1679, 1689, 1714, 1770, 1776, 1837, 1842], "elst10": [346, 1230, 1445, 1679, 1689, 1704, 1776, 1828, 1837, 1844], "elst12": [1689, 1776, 1837], "elst13": [1689, 1776, 1837], "elucid": [1757, 1838], "em": [1231, 1534, 1633, 1704], "emb": 1775, "embarrass": [1777, 1786, 1831], "embarrassingli": [1752, 1824, 1840], "embed": [73, 1152, 1221, 1228, 1687, 1704, 1738, 1752, 1770, 1776, 1780, 1781, 1794, 1817, 1824], "embedding_charg": 1794, "embellish": 1832, "embpot": [1231, 1589, 1704], "emerg": 1824, "emiss": 1776, "eml": 1710, "emona": 1837, "emonb": 1837, "emphas": [282, 332, 1781, 1838], "emphasi": 1757, "empir": [267, 394, 1757, 1774, 1780, 1802, 1837], "empirical_disp": 1770, "empirical_dispers": [1757, 1759, 1827], "empirical_dispersion_resourc": [267, 1759], "empiricaldispers": [1759, 1827], "emploi": [0, 106, 284, 662, 835, 863, 1206, 1210, 1230, 1444, 1704, 1740, 1743, 1752, 1754, 1781, 1801, 1802, 1836, 1837, 1838, 1841], "empti": [8, 100, 148, 171, 267, 331, 1108, 1111, 1221, 1704, 1714, 1738, 1743, 1750, 1759, 1774, 1797, 1808, 1842], "emsl": [1730, 1785], "emul": [342, 356], "en": [1738, 1748, 1821], "enabl": [1, 18, 84, 1095, 1105, 1219, 1221, 1228, 1230, 1231, 1385, 1386, 1468, 1498, 1615, 1704, 1717, 1738, 1746, 1748, 1749, 1754, 1759, 1762, 1765, 1771, 1772, 1775, 1782, 1783, 1785, 1798, 1803, 1817, 1822, 1824, 1837, 1838, 1839], "enable_": [1785, 1788], "enable_adcc": [1, 1738], "enable_ambit": 1738, "enable_brianqc": [1735, 1738], "enable_bs": 1738, "enable_ccsort": 1738, "enable_cct3": 1738, "enable_chemps2": [1738, 1746], "enable_cpp": [1738, 1749], "enable_ddx": [1738, 1754], "enable_dkh": [1738, 1762], "enable_ecpint": [1738, 1765], "enable_efp": [106, 1768], "enable_einsum": 1738, "enable_gauxc": [1738, 1838], "enable_gdma": [1738, 1775], "enable_gpu_dfcc": 1738, "enable_libefp": [1738, 1782], "enable_mdi": 1738, "enable_pastur": 1738, "enable_pcmsolv": [1738, 1803], "enable_psi4fockci": 1738, "enable_qm": [106, 1768], "enable_simint": [1738, 1839], "enable_snsmp2": 1738, "enable_transqt2": 1738, "enable_v2rdm_casscf": 1738, "enantiom": [1714, 1842], "encapsul": [1757, 1838], "enclos": 1743, "encod": [106, 1740, 1764, 1782, 1808], "encompass": 1802, "encount": [0, 656, 726, 1206, 1208, 1704, 1730, 1733, 1755, 1756, 1810, 1833, 1838], "encourag": [697, 1206, 1704, 1748, 1770, 1786], "end": [0, 2, 5, 137, 700, 844, 849, 934, 1025, 1026, 1027, 1206, 1210, 1213, 1217, 1231, 1490, 1555, 1578, 1649, 1704, 1736, 1738, 1740, 1743, 1748, 1750, 1752, 1757, 1767, 1772, 1776, 1781, 1785, 1788, 1791, 1794, 1801, 1810, 1824, 1828, 1832, 1833, 1834, 1836, 1838, 1841, 1843, 1844], "endif": 1738, "energet": [0, 1770, 1836, 1838], "energi": [0, 2, 11, 26, 73, 76, 84, 95, 106, 140, 150, 161, 167, 190, 262, 265, 267, 268, 276, 284, 286, 287, 291, 294, 296, 297, 298, 300, 301, 302, 307, 312, 314, 317, 318, 319, 337, 338, 341, 345, 346, 347, 348, 356, 365, 368, 369, 377, 378, 386, 390, 413, 439, 446, 453, 473, 484, 499, 562, 568, 574, 581, 586, 597, 599, 601, 608, 610, 615, 617, 626, 635, 641, 657, 658, 660, 665, 667, 681, 692, 698, 707, 726, 727, 737, 738, 741, 753, 758, 801, 818, 833, 835, 841, 850, 856, 862, 876, 921, 922, 924, 941, 971, 985, 986, 989, 1006, 1012, 1014, 1015, 1016, 1017, 1019, 1020, 1079, 1089, 1090, 1091, 1121, 1125, 1175, 1178, 1198, 1199, 1200, 1204, 1205, 1206, 1208, 1210, 1213, 1214, 1215, 1216, 1217, 1219, 1221, 1222, 1224, 1225, 1226, 1229, 1230, 1231, 1233, 1236, 1241, 1244, 1254, 1255, 1256, 1257, 1259, 1260, 1277, 1293, 1350, 1410, 1441, 1444, 1552, 1605, 1619, 1658, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1704, 1706, 1711, 1713, 1714, 1715, 1716, 1721, 1723, 1726, 1727, 1730, 1734, 1735, 1738, 1739, 1740, 1741, 1742, 1743, 1746, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1767, 1768, 1769, 1770, 1771, 1772, 1774, 1776, 1777, 1779, 1781, 1782, 1785, 1789, 1791, 1792, 1794, 1795, 1796, 1798, 1799, 1800, 1802, 1803, 1805, 1806, 1808, 1809, 1823, 1824, 1828, 1829, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1840, 1841, 1842, 1843, 1844], "energy1": [1714, 1842], "energy2": [1714, 1842], "energy_": 150, "energy_body_dict": 1794, "energy_level_shift": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "eneronli": [615, 635, 1206, 1704], "eneyn": 1833, "enforc": [1755, 1786, 1801, 1802, 1817, 1832, 1837, 1841], "engag": [1748, 1788], "engel": 1734, "engin": [267, 312, 318, 319, 329, 342, 356, 1759, 1800, 1802], "engrad": [1714, 1842], "enhanc": [583, 1206, 1704, 1757, 1777, 1804, 1810, 1838], "enlighten": 1740, "enorm": [1757, 1781], "enough": [574, 1206, 1230, 1480, 1704, 1752, 1755, 1763, 1767, 1824, 1828, 1832, 1837, 1838, 1844], "ensu": 1833, "ensur": [2, 329, 575, 1125, 1206, 1221, 1226, 1306, 1704, 1735, 1738, 1755, 1767, 1769, 1770, 1771, 1775, 1792, 1799, 1801, 1804, 1817, 1821, 1832, 1837, 1838, 1841], "ensure_bt_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "entail": 1763, "enter": [284, 569, 593, 660, 1206, 1704, 1738, 1740, 1743, 1755, 1763, 1770, 1788, 1824, 1828], "enthalphi": 1843, "enthalpi": [1691, 1776, 1828, 1843, 1844], "entir": [8, 86, 446, 484, 811, 833, 837, 1199, 1200, 1210, 1231, 1490, 1704, 1742, 1743, 1753, 1755, 1763, 1767, 1770, 1781, 1782, 1785, 1802, 1823, 1824, 1832, 1833, 1837, 1838], "entireti": 1743, "entiti": 1808, "entri": [11, 73, 86, 106, 150, 170, 183, 184, 263, 328, 344, 357, 384, 385, 574, 609, 628, 1206, 1704, 1714, 1743, 1770, 1794, 1799, 1801, 1810, 1833, 1842], "entropi": [1828, 1843, 1844], "enuc": [298, 348], "enum": [265, 1740, 1772, 1794], "enumer": [384, 1743, 1776], "env": [1738, 1748, 1764, 1788], "enviro": 1808, "environ": [2, 357, 661, 1206, 1224, 1240, 1704, 1730, 1734, 1736, 1737, 1743, 1748, 1750, 1752, 1755, 1756, 1757, 1759, 1764, 1774, 1777, 1780, 1782, 1788, 1808, 1818, 1828], "environment": 1767, "envis": 1738, "envoron": 1735, "enyl": 1833, "eom": [295, 318, 319, 342, 381, 382, 471, 473, 474, 475, 476, 491, 495, 496, 498, 499, 500, 508, 605, 606, 608, 610, 613, 1200, 1201, 1206, 1224, 1236, 1704, 1714, 1742, 1766, 1781, 1800, 1826, 1842], "eom_cc2": [506, 1200, 1704], "eom_cc3": [503, 506, 1200, 1704], "eom_ccsd": [506, 1200, 1704], "eom_guess": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "eom_refer": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "eomcc": [607, 608, 1206, 1704], "eome": [605, 613, 1206, 1704], "eomea": [605, 613, 1206, 1704], "eomip": [605, 613, 1206, 1704], "ep": [1225, 1261, 1262, 1704], "ep2": [26, 295, 892, 897, 1211, 1704, 1766, 1781], "ep2_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ep2_maxit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ep2_num_ea": [0, 1, 2, 897, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ep2_num_ip": [0, 1, 2, 897, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ep2_orbit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ep_add": 1738, "ep_ea_pol": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ep_ip_pol": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ep_maxit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "epic": 1838, "epjd": 1781, "eponym": 1740, "epsilon": [298, 348, 1756, 1838], "epsilon_": [368, 369, 377, 1757, 1763, 1771], "epsilon_a": [150, 1756, 1763], "epsilon_a_subset": 150, "epsilon_b": [150, 1756, 1763], "epsilon_b_subset": 150, "epsilon_i": 1756, "epsilon_j": 1756, "eq": [1135, 1221, 1226, 1357, 1358, 1359, 1360, 1692, 1704, 1752, 1776, 1810, 1837], "eqn": 1761, "eqn_descript": [266, 270, 276], "equal": [2, 84, 139, 267, 368, 369, 383, 635, 652, 664, 794, 842, 1206, 1210, 1704, 1740, 1743, 1759, 1761, 1776, 1817, 1828, 1837, 1838, 1844], "equal_nan": 2, "equal_phas": 2, "equat": [0, 76, 84, 162, 164, 284, 295, 318, 319, 335, 381, 382, 447, 455, 457, 509, 529, 548, 552, 582, 583, 584, 585, 594, 595, 607, 639, 645, 646, 647, 658, 684, 736, 741, 746, 747, 750, 913, 929, 946, 1103, 1181, 1199, 1200, 1201, 1202, 1203, 1206, 1208, 1213, 1221, 1222, 1225, 1230, 1281, 1435, 1441, 1704, 1714, 1740, 1741, 1742, 1753, 1756, 1763, 1766, 1771, 1776, 1798, 1800, 1808, 1810, 1826, 1836, 1837, 1838, 1841, 1842], "equilibrium": [780, 1209, 1692, 1704, 1752, 1753, 1781, 1803], "equiv": 1763, "equival": [2, 283, 284, 333, 383, 574, 608, 617, 632, 696, 874, 1206, 1210, 1229, 1431, 1432, 1704, 1706, 1714, 1730, 1740, 1748, 1750, 1755, 1757, 1760, 1767, 1771, 1776, 1810, 1832, 1833, 1836, 1838, 1841, 1842], "eras": [1692, 1752, 1808], "erd": 81, "erd_coef": 81, "erf": [89, 103, 1196, 1223, 1704, 1714, 1757, 1842], "erf_complement_eri": 89, "erf_eri": 89, "erfc": [103, 1196, 1223, 1704, 1817], "eri": [89, 92, 103, 143, 144, 298, 310, 348, 361, 810, 915, 916, 1072, 1096, 1210, 1213, 1219, 1231, 1486, 1572, 1704, 1714, 1749, 1754, 1756, 1771, 1790, 1798, 1803, 1817, 1827, 1842], "eri2": [310, 361], "eri3": [310, 361], "eri_": 1817, "eric": [356, 1734], "erisiev": 1817, "erkal": 1838, "ernzerhof": [295, 318, 319, 1695, 1697, 1698, 1699, 1703, 1758, 1766, 1800], "error": [2, 5, 11, 106, 150, 192, 193, 195, 197, 200, 203, 204, 265, 266, 267, 268, 269, 270, 271, 272, 273, 276, 277, 278, 279, 280, 285, 287, 321, 336, 338, 383, 594, 656, 734, 735, 736, 747, 814, 815, 845, 876, 903, 904, 1176, 1206, 1208, 1210, 1212, 1222, 1225, 1226, 1229, 1230, 1231, 1245, 1246, 1247, 1250, 1251, 1253, 1254, 1255, 1265, 1272, 1273, 1274, 1275, 1367, 1408, 1421, 1422, 1444, 1491, 1547, 1548, 1549, 1568, 1571, 1616, 1617, 1670, 1692, 1704, 1708, 1714, 1740, 1742, 1743, 1746, 1752, 1755, 1757, 1759, 1763, 1764, 1767, 1768, 1774, 1776, 1781, 1782, 1785, 1786, 1792, 1794, 1797, 1798, 1802, 1808, 1809, 1810, 1828, 1837, 1838, 1842, 1844], "error_correct": [265, 1740, 1794], "errorcorrectionprotocol": [265, 1740, 1794], "escap": 1764, "escf": 1832, "escsmp2": 1832, "esp": [70, 1112, 1221, 1685, 1704, 1714, 1726, 1750, 1770, 1776, 1791, 1799, 1842], "esp_at_nuclei": [111, 150, 1799], "especi": [0, 2, 106, 726, 882, 1208, 1210, 1230, 1455, 1704, 1738, 1742, 1743, 1753, 1755, 1770, 1788, 1798, 1817, 1821, 1824, 1837, 1838], "esppropcalc": 1827, "essenti": [610, 1206, 1692, 1704, 1738, 1750, 1752, 1755, 1757, 1759, 1764, 1770, 1773, 1774, 1783, 1784, 1801, 1810, 1817, 1832, 1833, 1834, 1838, 1841], "essl": 1738, "est": [346, 1689, 1776, 1837], "establish": [1764, 1788], "estate_prop": [608, 1206, 1704], "estim": [808, 930, 949, 958, 1210, 1213, 1225, 1226, 1266, 1290, 1327, 1704, 1742, 1763, 1798, 1837, 1838], "et": [1, 786, 885, 1210, 1225, 1271, 1692, 1704, 1714, 1734, 1752, 1754, 1763, 1802, 1805, 1806, 1837, 1841, 1842], "etc": [2, 11, 76, 92, 106, 268, 284, 295, 300, 301, 302, 314, 318, 319, 381, 382, 389, 457, 581, 599, 603, 641, 667, 669, 691, 700, 813, 819, 900, 948, 992, 1126, 1130, 1158, 1170, 1199, 1206, 1210, 1212, 1213, 1215, 1221, 1224, 1225, 1231, 1235, 1248, 1507, 1704, 1708, 1714, 1733, 1738, 1740, 1742, 1743, 1746, 1748, 1752, 1754, 1755, 1757, 1763, 1764, 1766, 1767, 1770, 1772, 1776, 1779, 1780, 1781, 1782, 1788, 1791, 1792, 1794, 1799, 1800, 1801, 1802, 1804, 1808, 1809, 1810, 1820, 1821, 1825, 1826, 1828, 1829, 1832, 1833, 1837, 1842], "ethan": [1710, 1728, 1833], "ethanol": 1754, "ethen": [295, 1692, 1714, 1752, 1766, 1798, 1828, 1833, 1842, 1844], "ethin": [1692, 1714, 1752, 1842, 1844], "ethylen": [1714, 1828, 1842, 1844], "ethyn": [1714, 1828, 1833, 1842], "euclidean": 149, "eugen": [1771, 1782], "euler": 1782, "eur": 1781, "ev": [377, 550, 1203, 1704, 1706, 1742, 1841], "eval": 115, "evalu": [265, 277, 291, 317, 329, 341, 342, 356, 365, 568, 597, 604, 608, 615, 616, 666, 679, 707, 887, 1031, 1089, 1090, 1091, 1114, 1206, 1210, 1218, 1219, 1221, 1230, 1231, 1444, 1454, 1459, 1460, 1461, 1481, 1515, 1517, 1619, 1704, 1714, 1740, 1750, 1753, 1755, 1756, 1757, 1760, 1763, 1771, 1777, 1781, 1790, 1794, 1798, 1802, 1817, 1828, 1837, 1838, 1842, 1844], "evangelista": [1734, 1750, 1781, 1786, 1829, 1836], "evangelisti": [835, 874, 1210, 1704], "even": [106, 295, 318, 319, 342, 350, 356, 440, 570, 590, 614, 665, 707, 1199, 1206, 1224, 1226, 1230, 1231, 1238, 1312, 1464, 1465, 1466, 1565, 1606, 1704, 1738, 1742, 1755, 1756, 1757, 1763, 1764, 1766, 1767, 1768, 1771, 1782, 1785, 1786, 1788, 1800, 1802, 1828, 1832, 1833, 1838, 1844], "evenli": 1761, "event": [1742, 1747], "eventu": [2, 786, 1210, 1704, 1743, 1757, 1838], "ever": [1738, 1772, 1800, 1808, 1828, 1844], "everi": [2, 100, 111, 284, 359, 370, 390, 611, 700, 813, 1125, 1206, 1210, 1221, 1226, 1231, 1323, 1327, 1565, 1568, 1704, 1714, 1735, 1737, 1738, 1740, 1743, 1747, 1764, 1767, 1771, 1781, 1788, 1802, 1808, 1823, 1837, 1838, 1842, 1843], "everyon": 1804, "everyth": [84, 342, 356, 661, 1206, 1224, 1240, 1704, 1738, 1767, 1785, 1786, 1809, 1828, 1844], "evid": 1757, "evp": 356, "ewald": [1231, 1509, 1511, 1704, 1817], "ex": [318, 319, 1224, 1235, 1704, 1748, 1785, 1788, 1799, 1800, 1837], "ex_allow": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ex_level": [0, 1, 2, 819, 821, 859, 860, 875, 890, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ex_lvl": [794, 1210, 1704], "exact": [2, 100, 138, 608, 707, 835, 874, 1206, 1210, 1225, 1231, 1283, 1294, 1510, 1512, 1704, 1706, 1734, 1753, 1757, 1781, 1817, 1833, 1836, 1837, 1838], "exactli": [2, 284, 833, 1210, 1704, 1714, 1730, 1740, 1753, 1754, 1759, 1763, 1782, 1794, 1809, 1833, 1837, 1838, 1842], "examin": [1726, 1738, 1743, 1770, 1781, 1837], "exampl": [0, 1, 2, 11, 92, 100, 106, 148, 150, 262, 275, 278, 284, 288, 289, 291, 295, 296, 297, 300, 301, 302, 303, 306, 307, 314, 317, 318, 319, 326, 327, 331, 339, 340, 341, 346, 347, 365, 374, 376, 381, 382, 384, 386, 395, 397, 569, 574, 593, 601, 609, 616, 628, 660, 664, 671, 1126, 1206, 1221, 1704, 1714, 1723, 1726, 1730, 1735, 1738, 1740, 1741, 1742, 1743, 1746, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1781, 1782, 1783, 1784, 1785, 1788, 1789, 1790, 1791, 1792, 1794, 1795, 1796, 1797, 1799, 1800, 1801, 1802, 1803, 1808, 1810, 1817, 1823, 1824, 1826, 1828, 1832, 1833, 1834, 1835, 1838, 1839, 1841, 1842, 1844], "example_psi4rc_fil": 1767, "exc": [0, 1742], "exce": [859, 860, 875, 1095, 1210, 1219, 1231, 1535, 1704, 1767, 1771, 1794], "exceed": [318, 319, 755, 1208, 1704, 1800, 1802, 1838], "exceedingli": 1757, "excel": [1756, 1767, 1808, 1823, 1837], "except": [2, 84, 87, 106, 266, 268, 269, 270, 271, 272, 273, 276, 277, 278, 279, 280, 284, 318, 319, 393, 608, 611, 632, 633, 634, 641, 652, 656, 664, 665, 1125, 1206, 1221, 1704, 1714, 1730, 1738, 1740, 1742, 1743, 1746, 1755, 1756, 1757, 1764, 1770, 1771, 1776, 1795, 1796, 1800, 1801, 1809, 1821, 1827, 1828, 1832, 1837, 1838, 1842, 1844], "excess": [0, 568, 1206, 1704, 1797, 1837], "exch": [76, 346, 1230, 1231, 1444, 1454, 1469, 1470, 1475, 1526, 1678, 1679, 1689, 1704, 1714, 1770, 1776, 1837, 1842], "exch10": [1230, 1445, 1453, 1679, 1689, 1704, 1776, 1837], "exch11": [1689, 1776, 1837], "exch12": [1689, 1776, 1837], "exch_scale_alpha": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "exchang": [76, 92, 138, 295, 318, 319, 1016, 1041, 1042, 1046, 1064, 1216, 1218, 1230, 1231, 1441, 1448, 1449, 1450, 1453, 1464, 1470, 1512, 1663, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1714, 1730, 1733, 1734, 1743, 1757, 1758, 1763, 1766, 1770, 1776, 1781, 1790, 1800, 1817, 1828, 1842, 1844], "exchscal": 346, "excit": [0, 1, 84, 162, 295, 356, 368, 369, 377, 410, 418, 473, 474, 476, 488, 495, 498, 499, 520, 525, 526, 544, 549, 568, 608, 609, 610, 612, 613, 641, 659, 662, 665, 679, 692, 791, 794, 795, 800, 819, 820, 828, 859, 860, 868, 890, 992, 1071, 1127, 1164, 1197, 1198, 1200, 1202, 1203, 1206, 1210, 1215, 1219, 1221, 1224, 1229, 1231, 1235, 1236, 1419, 1430, 1579, 1581, 1650, 1655, 1668, 1690, 1704, 1714, 1730, 1733, 1743, 1746, 1755, 1757, 1763, 1766, 1771, 1776, 1781, 1785, 1790, 1795, 1798, 1803, 1805, 1810, 1828, 1829, 1833, 1841, 1842, 1844], "excitation_rang": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "excitedst": 0, "exclam": 1730, "exclud": [2, 106, 827, 1071, 1210, 1219, 1704, 1738, 1771, 1829], "exclus": 1837, "exec": [370, 1786, 1834], "execut": [0, 2, 87, 106, 267, 283, 333, 374, 395, 616, 1206, 1224, 1231, 1241, 1626, 1704, 1714, 1715, 1736, 1743, 1746, 1747, 1748, 1750, 1753, 1756, 1759, 1764, 1767, 1768, 1774, 1775, 1776, 1777, 1778, 1782, 1786, 1788, 1792, 1808, 1824, 1828, 1832, 1838, 1842], "exelist": 1788, "exercis": [1715, 1716], "exhaust": 106, "exhibit": [1753, 1757, 1763, 1789], "exist": [2, 86, 106, 150, 255, 292, 295, 343, 1737, 1738, 1740, 1742, 1743, 1748, 1757, 1764, 1766, 1767, 1768, 1770, 1788, 1808, 1817, 1823, 1824, 1828, 1833, 1836, 1837, 1838, 1844], "exit": [188, 235, 236, 328, 357, 1748, 1750, 1838], "exot": [476, 1200, 1704, 1714, 1842], "exp": [81, 1810], "expand": [100, 476, 1200, 1704, 1714, 1738, 1780, 1798, 1841, 1842], "expand_cbs_method": [1768, 1777], "expans": [0, 342, 356, 583, 607, 811, 835, 1097, 1099, 1206, 1210, 1220, 1228, 1395, 1704, 1742, 1755, 1768, 1775, 1781, 1789, 1794, 1829, 1837, 1841], "expect": [2, 103, 106, 285, 286, 287, 329, 336, 337, 338, 377, 383, 608, 610, 1206, 1226, 1304, 1352, 1704, 1713, 1714, 1738, 1743, 1753, 1754, 1757, 1767, 1770, 1776, 1779, 1786, 1799, 1801, 1802, 1810, 1828, 1837, 1838, 1842, 1844], "expedit": 1824, "expens": [0, 295, 704, 874, 1206, 1210, 1704, 1742, 1753, 1755, 1766, 1769, 1770, 1789, 1792, 1793, 1824, 1838], "experi": [1751, 1781], "experienc": [1767, 1771, 1786], "experiment": [150, 265, 576, 578, 604, 624, 693, 793, 799, 801, 827, 1125, 1126, 1206, 1210, 1221, 1704, 1740, 1757, 1771, 1794, 1837], "expert": [2, 84, 106, 114, 150, 295, 318, 319, 430, 1226, 1300, 1532, 1704, 1738, 1743, 1744, 1745, 1754, 1757, 1766, 1767, 1785, 1800, 1801, 1810, 1832, 1838], "expertis": 1804, "expir": 279, "explain": [1753, 1767, 1770, 1815], "explan": [640, 1206, 1704, 1748, 1767, 1828, 1844], "explanatori": [574, 1206, 1704], "explicit": [281, 304, 718, 1207, 1704, 1714, 1738, 1740, 1743, 1748, 1749, 1759, 1767, 1814, 1819, 1832, 1841, 1842], "explicit_hamiltonian": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "explicitli": [8, 150, 291, 314, 341, 586, 611, 625, 676, 684, 685, 689, 691, 874, 897, 946, 1157, 1206, 1210, 1211, 1213, 1221, 1224, 1225, 1235, 1281, 1704, 1714, 1738, 1739, 1742, 1743, 1750, 1754, 1756, 1757, 1767, 1770, 1771, 1776, 1781, 1788, 1791, 1798, 1801, 1803, 1810, 1833, 1837, 1838, 1841, 1842], "exploit": [573, 702, 1206, 1704, 1749, 1754, 1763, 1781, 1803, 1838], "explor": [1757, 1828], "explos": 1756, "expon": [2, 8, 19, 77, 81, 103, 285, 336, 374, 395, 1101, 1220, 1704, 1714, 1743, 1775, 1810, 1837, 1842], "exponenti": [1740, 1742, 1757, 1789, 1798], "export": [86, 106, 803, 1210, 1704, 1730, 1735, 1738, 1748, 1750, 1764, 1767, 1772, 1786, 1823, 1824, 1833], "export_": [1785, 1823], "expos": [1818, 1824], "express": [0, 2, 106, 285, 287, 336, 338, 368, 369, 380, 801, 1099, 1210, 1220, 1704, 1740, 1743, 1753, 1757, 1763, 1764, 1768, 1775, 1776, 1779, 1781, 1798, 1837], "ext": [1714, 1770, 1842], "ext_force_bend": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ext_force_cartesian": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ext_force_dihedr": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ext_force_dist": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ext_force_oofp": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ext_will_vari": 1738, "extend": [5, 106, 295, 697, 786, 925, 1206, 1210, 1213, 1225, 1231, 1259, 1260, 1535, 1704, 1743, 1757, 1759, 1766, 1768, 1774, 1779, 1781, 1817, 1836, 1838], "extens": [8, 532, 540, 555, 1202, 1203, 1704, 1714, 1730, 1738, 1742, 1743, 1753, 1755, 1757, 1759, 1761, 1767, 1768, 1770, 1771, 1777, 1781, 1782, 1832, 1833, 1838, 1842, 1844], "extent": [150, 1032, 1115, 1218, 1221, 1704, 1750, 1757, 1799, 1831, 1838], "extern": [0, 1, 2, 73, 84, 150, 205, 247, 267, 275, 390, 586, 642, 668, 679, 709, 711, 712, 793, 1024, 1124, 1206, 1210, 1217, 1221, 1225, 1226, 1268, 1270, 1307, 1308, 1309, 1310, 1311, 1583, 1598, 1660, 1679, 1704, 1714, 1730, 1733, 1735, 1738, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1790, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1839, 1840, 1841, 1842, 1843, 1844], "extern1": [1714, 1838, 1842], "extern2": [275, 1714, 1842], "extern3": [1714, 1842], "extern4": [1714, 1842], "external_": 1785, "external_cpscf_perturb": 84, "external_pot": 150, "external_potenti": [84, 275, 1838], "external_potential_symmetri": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "externalpotenti": [150, 274, 275, 1231, 1553, 1704, 1827], "externalproject_add": 1785, "extinct": [368, 369], "extra": [100, 106, 148, 150, 262, 263, 267, 293, 313, 318, 319, 331, 364, 367, 727, 1208, 1226, 1299, 1704, 1738, 1743, 1748, 1759, 1770, 1786, 1787, 1797, 1800, 1802, 1817], "extra_infil": 1788, "extract": [0, 1, 74, 355, 378, 386, 401, 1197, 1704, 1743, 1759, 1764, 1809, 1837, 1838, 1841, 1844], "extract_subset": [106, 1833, 1837], "extrapol": [284, 295, 318, 319, 321, 438, 515, 538, 584, 688, 734, 735, 736, 812, 813, 814, 815, 839, 840, 841, 846, 919, 1173, 1175, 1176, 1199, 1202, 1203, 1206, 1208, 1210, 1213, 1222, 1225, 1229, 1231, 1250, 1251, 1252, 1279, 1408, 1409, 1430, 1546, 1547, 1548, 1557, 1704, 1711, 1714, 1741, 1743, 1753, 1766, 1768, 1779, 1781, 1785, 1798, 1800, 1831, 1832, 1838, 1842], "extrem": [672, 1206, 1704, 1754, 1756, 1757, 1770, 1781, 1798, 1838], "extrpol": 321, "exval": [111, 1799], "ey": 106, "eyval": [111, 1799], "ez": 1799, "ezval": [111, 1799], "f": [0, 76, 84, 110, 284, 389, 1038, 1039, 1042, 1043, 1044, 1045, 1046, 1064, 1218, 1229, 1427, 1694, 1704, 1706, 1707, 1714, 1730, 1731, 1732, 1733, 1734, 1738, 1739, 1740, 1741, 1742, 1743, 1750, 1756, 1757, 1761, 1764, 1771, 1776, 1777, 1780, 1781, 1783, 1786, 1788, 1790, 1794, 1798, 1802, 1821, 1832, 1836, 1837, 1838, 1841, 1842], "f12": [89, 103, 1694, 1707, 1731, 1732], "f12_cgtg": 103, "f12_double_commut": 89, "f12_squar": 89, "f12g12": [89, 103], "f2": [1714, 1842], "f7": 1738, "f_": [1756, 1757, 1759, 1763, 1837, 1838], "f_a": 1837, "f_b": 1837, "f_cut": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "f_formchk": [2, 285, 296, 336, 1769], "f_p": 1753, "fa": [150, 1770], "fa_subset": 150, "face": [359, 1817], "facil": 1824, "facilit": [1738, 1824, 1833], "facor": 329, "fact": [329, 368, 369, 1757, 1810, 1817, 1838], "facto": [1757, 1767], "factor": [94, 95, 100, 103, 106, 140, 324, 329, 603, 681, 714, 772, 943, 1051, 1067, 1068, 1081, 1082, 1093, 1132, 1206, 1207, 1209, 1213, 1218, 1219, 1221, 1225, 1226, 1228, 1230, 1231, 1232, 1271, 1299, 1387, 1388, 1469, 1470, 1519, 1618, 1666, 1704, 1706, 1738, 1750, 1754, 1756, 1757, 1771, 1801, 1810, 1828, 1837, 1838, 1843, 1844], "factori": [16, 103, 115, 1817], "faegri": 1781, "fail": [2, 266, 270, 276, 277, 278, 318, 319, 1231, 1554, 1704, 1714, 1738, 1743, 1786, 1788, 1800, 1802, 1835, 1838, 1842], "fail_on_maxit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "failur": [2, 126, 342, 356, 383, 1231, 1490, 1704, 1746, 1757, 1838], "fair": 1804, "fairli": [247, 1755, 1757, 1789, 1828, 1838, 1844], "fake": 1788, "fall": [2, 594, 606, 645, 1206, 1704, 1730, 1746, 1762, 1765, 1773, 1775, 1782, 1783, 1784, 1786, 1803, 1809, 1838, 1839], "fallen": 1755, "fals": [2, 8, 13, 61, 84, 89, 96, 100, 103, 106, 148, 150, 182, 235, 236, 250, 251, 252, 259, 263, 265, 267, 273, 282, 283, 284, 288, 289, 296, 308, 314, 323, 332, 333, 339, 340, 342, 350, 370, 374, 383, 389, 395, 416, 417, 424, 425, 426, 427, 429, 440, 441, 448, 453, 457, 458, 459, 460, 462, 463, 468, 471, 477, 478, 488, 493, 494, 498, 501, 503, 509, 510, 517, 530, 532, 534, 536, 540, 541, 544, 555, 562, 576, 579, 597, 598, 602, 604, 605, 625, 626, 639, 648, 653, 657, 658, 672, 678, 679, 680, 682, 692, 694, 695, 699, 718, 742, 743, 745, 749, 753, 765, 786, 787, 788, 792, 801, 802, 803, 807, 817, 821, 822, 823, 831, 838, 839, 859, 860, 861, 863, 865, 866, 867, 872, 875, 882, 883, 885, 886, 887, 888, 909, 913, 915, 917, 921, 922, 925, 934, 940, 941, 942, 952, 956, 986, 990, 995, 996, 998, 999, 1022, 1025, 1026, 1027, 1035, 1036, 1037, 1040, 1041, 1044, 1059, 1061, 1064, 1069, 1071, 1073, 1076, 1078, 1083, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1096, 1105, 1117, 1124, 1125, 1145, 1151, 1152, 1171, 1172, 1173, 1179, 1182, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1206, 1207, 1208, 1209, 1210, 1212, 1213, 1215, 1216, 1217, 1218, 1219, 1221, 1222, 1225, 1226, 1228, 1229, 1230, 1231, 1244, 1254, 1255, 1258, 1259, 1260, 1261, 1262, 1264, 1268, 1270, 1276, 1277, 1278, 1300, 1306, 1312, 1315, 1316, 1317, 1327, 1334, 1337, 1355, 1356, 1361, 1367, 1369, 1370, 1372, 1373, 1374, 1378, 1381, 1385, 1386, 1390, 1392, 1407, 1411, 1414, 1415, 1419, 1421, 1428, 1430, 1435, 1436, 1441, 1447, 1448, 1449, 1450, 1452, 1453, 1454, 1464, 1465, 1466, 1483, 1485, 1500, 1541, 1553, 1558, 1564, 1565, 1566, 1578, 1583, 1585, 1587, 1591, 1593, 1594, 1596, 1612, 1613, 1614, 1623, 1636, 1637, 1643, 1647, 1656, 1663, 1704, 1735, 1740, 1742, 1743, 1746, 1749, 1750, 1753, 1754, 1755, 1756, 1757, 1759, 1767, 1768, 1769, 1770, 1771, 1772, 1786, 1788, 1791, 1794, 1795, 1796, 1797, 1798, 1803, 1817, 1828, 1837, 1838, 1841], "falsi": 1757, "falter": 1738, "famili": [400, 1730, 1738, 1771, 1774], "familiar": [1737, 1771, 1817, 1844], "fanci": 1740, "fannfann": [1692, 1752], "faonfann": [1692, 1752], "faonfaon": [1692, 1752], "faoofann": [1692, 1752], "faoofaon": [1692, 1752], "faoofaoo": [1692, 1752], "faq": [1767, 1777, 1819], "far": [0, 2, 297, 347, 576, 764, 1206, 1209, 1704, 1743, 1754, 1757, 1763, 1770, 1783, 1824, 1828, 1838], "faradai": 1706, "faraday_const": 1706, "faraday_constant_for_conventional_electric_curr": 1706, "farm": [1752, 1824], "fashion": [1752, 1760, 1782, 1792, 1806], "fast": [762, 1209, 1704, 1738, 1754, 1755, 1767, 1810, 1838], "fastdf": [1231, 1505, 1509, 1511, 1704], "faster": [590, 623, 765, 1095, 1206, 1209, 1219, 1704, 1736, 1753, 1754, 1757, 1759, 1763, 1767, 1771, 1774, 1789, 1798, 1810, 1828, 1837, 1838, 1844], "fastest": [1708, 1743], "fault": 1742, "faulti": 106, "faver": [1692, 1752], "favg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "favg_ccsd_t": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "favg_start": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "favor": [281, 304, 1231, 1589, 1704, 1753, 1755, 1810, 1833], "favorit": [1692, 1752], "fb": [150, 1770], "fb_subset": 150, "fc": [295, 318, 319, 614, 1206, 1695, 1696, 1698, 1699, 1700, 1703, 1704, 1711, 1714, 1758, 1766, 1800, 1809, 1842], "fcae": [268, 1809], "fcfo": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "fcharg": 106, "fchk": [2, 74, 285, 303, 336, 1775, 1777, 1780, 1823], "fchkwriter": 1827, "fci": [0, 1, 2, 150, 284, 295, 314, 381, 382, 822, 1673, 1704, 1714, 1725, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "fci_str": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "fcidump": [2, 187, 286, 298, 337, 348, 1714, 1842], "fcidump_from_fil": [294, 345], "fcmfinal": [679, 1206, 1704], "fcmint": [706, 1206, 1704], "fco": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "fctl": [267, 1690, 1776, 1795], "fctldash": [267, 1759], "fd": [1713, 1714, 1718, 1724, 1772, 1803, 1842], "fd_irrep": [616, 1206, 1704], "fd_project": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "fdc202e": 1786, "fdd": [75, 1230, 1476, 1477, 1478, 1704, 1837], "fdds_dispers": 1827, "fdisp": 76, "fe": [1707, 1731], "featur": [0, 1, 2, 106, 284, 351, 370, 381, 382, 657, 1126, 1206, 1221, 1231, 1520, 1704, 1730, 1737, 1738, 1740, 1743, 1746, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1757, 1762, 1765, 1767, 1771, 1772, 1775, 1777, 1781, 1782, 1788, 1799, 1803, 1808, 1819, 1824, 1826, 1832, 1837, 1838, 1839, 1840], "feb": [1694, 1707, 1731, 1732, 1733], "februari": [1782, 1837], "feedback": 1825, "feedstock": 1788, "feel": 1828, "felst": 76, "fermann": [1781, 1783], "fermi": [614, 669, 1206, 1704, 1706], "fermi_coupling_const": 1706, "fetch": [1, 75, 1746, 1749, 1754, 1762, 1765, 1773, 1775, 1782, 1783, 1784, 1786, 1788, 1803, 1833, 1839], "few": [0, 2, 342, 605, 1206, 1692, 1704, 1738, 1742, 1743, 1748, 1752, 1756, 1757, 1759, 1761, 1764, 1774, 1785, 1795, 1798, 1808, 1809, 1810, 1815, 1824, 1828, 1833, 1835, 1837, 1838, 1841, 1843, 1844], "fewer": [1771, 1794], "fexch": 76, "feynman": 1798, "ffer": [1734, 1781], "fh": [1714, 1842], "fi": [1714, 1776, 1838, 1842], "fiddl": 1810, "field": [1, 2, 70, 71, 73, 89, 103, 106, 111, 150, 265, 275, 284, 285, 287, 295, 296, 318, 319, 336, 338, 381, 382, 383, 386, 388, 550, 571, 572, 574, 614, 617, 622, 669, 674, 690, 693, 707, 709, 711, 712, 763, 764, 776, 1040, 1124, 1203, 1206, 1209, 1210, 1218, 1221, 1228, 1231, 1386, 1388, 1394, 1586, 1673, 1690, 1704, 1706, 1708, 1714, 1734, 1740, 1742, 1753, 1754, 1755, 1766, 1768, 1769, 1770, 1772, 1776, 1777, 1781, 1788, 1790, 1794, 1799, 1800, 1804, 1817, 1826, 1829, 1835, 1838, 1842], "figur": [1755, 1788, 1828, 1844], "file": [0, 8, 16, 21, 64, 74, 75, 76, 86, 87, 88, 100, 106, 115, 148, 150, 168, 172, 187, 189, 202, 205, 221, 227, 228, 229, 230, 234, 252, 265, 267, 271, 282, 285, 286, 287, 288, 289, 291, 295, 296, 297, 298, 303, 306, 307, 314, 318, 319, 332, 336, 337, 338, 339, 340, 341, 347, 348, 350, 351, 354, 374, 380, 393, 395, 399, 400, 575, 577, 592, 614, 620, 621, 628, 638, 641, 668, 680, 682, 706, 716, 720, 804, 830, 836, 867, 934, 954, 1021, 1025, 1026, 1027, 1035, 1036, 1037, 1043, 1046, 1052, 1097, 1104, 1108, 1109, 1111, 1118, 1130, 1145, 1153, 1170, 1186, 1206, 1207, 1213, 1216, 1217, 1218, 1220, 1221, 1222, 1225, 1226, 1227, 1228, 1230, 1231, 1268, 1270, 1356, 1377, 1393, 1463, 1578, 1583, 1584, 1704, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1733, 1735, 1736, 1740, 1743, 1747, 1748, 1749, 1752, 1754, 1757, 1759, 1761, 1763, 1764, 1766, 1768, 1771, 1772, 1775, 1776, 1777, 1778, 1780, 1781, 1782, 1785, 1786, 1788, 1790, 1791, 1792, 1794, 1795, 1796, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1810, 1815, 1819, 1823, 1828, 1831, 1833, 1834, 1835, 1836, 1837, 1838, 1840, 1842], "file1": 1767, "file2": 1767, "filebas": 1738, "filen": 1833, "filenam": [8, 74, 100, 104, 148, 150, 288, 289, 295, 296, 303, 314, 323, 339, 340, 354, 392, 934, 1025, 1026, 1027, 1170, 1213, 1217, 1221, 1231, 1578, 1704, 1733, 1761, 1766, 1767, 1768, 1769, 1772, 1775, 1788, 1791, 1801, 1835], "fileno": [86, 87, 100, 354], "filenumb": [150, 1767], "filepath": [323, 1043, 1046, 1052, 1218, 1704], "filesystem": [21, 1738, 1750, 1832], "fill": [64, 183, 184, 1126, 1221, 1704, 1743, 1764, 1788, 1794, 1810, 1817], "fillin": [1231, 1628, 1704], "filter": [2, 304, 380, 481, 520, 544, 823, 824, 825, 827, 1200, 1202, 1203, 1210, 1704, 1714, 1738, 1768, 1794, 1817, 1842], "filter_guess": [0, 1, 2, 824, 825, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "filter_guess_det1": [0, 1, 2, 823, 826, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "filter_guess_det2": [0, 1, 2, 823, 826, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "filter_guess_sign": [0, 1, 2, 823, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "filter_nonvib": 386, "filter_zero_det": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "final": [2, 84, 92, 106, 147, 150, 267, 285, 314, 336, 386, 495, 550, 1200, 1203, 1226, 1230, 1231, 1362, 1463, 1490, 1493, 1495, 1704, 1714, 1723, 1730, 1740, 1742, 1743, 1747, 1748, 1757, 1763, 1764, 1767, 1776, 1779, 1782, 1787, 1791, 1794, 1798, 1801, 1802, 1804, 1817, 1828, 1832, 1834, 1836, 1837, 1838, 1842, 1844], "finalize_energi": 84, "find": [2, 76, 106, 296, 299, 349, 356, 609, 635, 652, 833, 871, 881, 1181, 1206, 1210, 1222, 1231, 1649, 1704, 1730, 1736, 1743, 1748, 1750, 1755, 1757, 1764, 1767, 1769, 1782, 1783, 1785, 1787, 1788, 1801, 1802, 1814, 1822, 1837, 1838], "find_highest_point_group": 106, "find_occup": 84, "find_point_group": 106, "findabl": 1767, "findif": [400, 616, 619, 707, 1206, 1704, 1705, 1743, 1776], "findifrec": [1772, 1794], "findpython": 1738, "fine": [1706, 1738, 1748, 1754, 1756, 1786, 1788, 1808, 1817, 1821], "fine_structure_const": 1706, "finish": [76, 170, 295, 1738, 1757, 1766, 1767, 1770], "finit": [265, 267, 300, 301, 302, 306, 307, 318, 319, 614, 615, 617, 618, 619, 666, 679, 690, 701, 1023, 1024, 1028, 1150, 1206, 1217, 1221, 1704, 1713, 1714, 1724, 1740, 1742, 1743, 1756, 1757, 1768, 1772, 1794, 1796, 1798, 1800, 1802, 1803, 1809, 1824, 1833, 1834, 1838, 1840, 1842, 1843], "finitediffer": [1768, 1772], "finitedifferencecomput": [1768, 1772, 1794], "fink": [1734, 1736, 1767, 1798], "firework": 1788, "fireworks_slide_v182": 1788, "first": [2, 3, 5, 8, 90, 103, 106, 115, 137, 150, 259, 265, 279, 284, 286, 295, 300, 301, 302, 309, 314, 318, 319, 337, 360, 381, 382, 384, 386, 390, 434, 571, 575, 599, 608, 609, 615, 616, 662, 669, 679, 685, 687, 749, 824, 992, 1011, 1119, 1125, 1190, 1199, 1206, 1208, 1210, 1215, 1216, 1221, 1222, 1226, 1230, 1231, 1361, 1464, 1582, 1692, 1704, 1706, 1713, 1714, 1722, 1723, 1730, 1738, 1740, 1742, 1743, 1746, 1750, 1752, 1753, 1756, 1757, 1761, 1763, 1764, 1766, 1767, 1768, 1771, 1772, 1774, 1775, 1776, 1781, 1782, 1785, 1786, 1787, 1790, 1791, 1792, 1794, 1795, 1796, 1798, 1800, 1801, 1802, 1810, 1817, 1826, 1828, 1832, 1833, 1835, 1838, 1841, 1842, 1844], "first10": [1692, 1752], "first3": [1692, 1752], "first5": [1692, 1752], "first_ord": [669, 1206, 1704], "first_radiation_const": 1706, "first_radiation_constant_for_spectral_radi": 1706, "first_rs_shell_block": 1817, "firstli": [1752, 1799], "fisapt": [400, 1051, 1230, 1475, 1704, 1705, 1709, 1714, 1770, 1827, 1837, 1842], "fisapt0": [295, 1766, 1770], "fisapt_charge_complet": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "fisapt_cube_densmat": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "fisapt_cube_linkibo": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "fisapt_cube_linkiho": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "fisapt_do_fsapt": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "fisapt_do_fsapt_disp": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "fisapt_do_plot": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "fisapt_exch_parperp": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "fisapt_fsapt_exch_scal": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "fisapt_fsapt_filepath": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "fisapt_fsapt_ind_respons": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "fisapt_fsapt_ind_scal": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "fisapt_fssapt_filepath": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "fisapt_link_assign": [0, 1, 2, 1048, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "fisapt_link_ortho": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "fisapt_link_select": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "fisapt_manual_link": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "fisapt_mem_safety_factor": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "fisapt_plot_filepath": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "fischer": [1226, 1342, 1704, 1734, 1802], "fischer_lik": [1226, 1338, 1704], "fit": [11, 26, 61, 84, 92, 103, 150, 179, 255, 284, 295, 318, 319, 377, 381, 382, 733, 810, 892, 899, 963, 1076, 1120, 1204, 1208, 1210, 1211, 1212, 1213, 1214, 1219, 1221, 1230, 1231, 1445, 1446, 1491, 1500, 1501, 1502, 1505, 1506, 1509, 1510, 1674, 1675, 1704, 1707, 1708, 1714, 1730, 1731, 1735, 1738, 1739, 1740, 1742, 1743, 1744, 1745, 1750, 1759, 1761, 1763, 1764, 1766, 1767, 1768, 1770, 1777, 1781, 1785, 1790, 1798, 1800, 1806, 1808, 1817, 1823, 1824, 1826, 1828, 1829, 1832, 1837, 1842, 1844], "fitrol": 8, "fittedslatercorrelationfactor": 1827, "fittingmetr": 1827, "five": [1692, 1752, 1753, 1802], "fix": [2, 106, 267, 792, 793, 1210, 1226, 1230, 1231, 1339, 1469, 1470, 1663, 1704, 1714, 1736, 1737, 1753, 1755, 1759, 1767, 1768, 1780, 1787, 1802, 1803, 1833, 1837, 1842], "fix_com": [106, 1768], "fix_orient": [106, 1768], "fix_symmetri": [106, 1768], "fixed_": [1226, 1360, 1704], "fixed_bend": [1226, 1357, 1704], "fixed_coord": 1802, "fixed_dihedr": [1226, 1358, 1704], "fixed_dist": [1226, 1359, 1704], "fixeds": [106, 139, 150], "fl": [295, 318, 319, 1694, 1695, 1698, 1699, 1703, 1707, 1731, 1732, 1733, 1758, 1766, 1800], "flabel": 106, "flag": [2, 273, 295, 658, 1071, 1206, 1219, 1704, 1738, 1766, 1767, 1771, 1785, 1788, 1801, 1838], "flaki": [882, 1210, 1704], "flat": [363, 367, 968, 1214, 1231, 1532, 1704, 1802, 1817], "flavor": [265, 1714, 1740, 1757, 1772, 1794, 1838, 1842], "flaw": 1743, "fledg": [1748, 1833], "fletcher": [1225, 1284, 1704], "fletcher_reev": [948, 1213, 1225, 1284, 1704], "flexibl": [267, 577, 671, 1206, 1226, 1312, 1704, 1730, 1743, 1748, 1752, 1757, 1759, 1785, 1824, 1832, 1833, 1837, 1838], "flexibla": 1738, "flexible_g_converg": [0, 1, 2, 1324, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "flexibli": 1738, "flin": [929, 1213, 1704], "flip": [0, 13, 295, 692, 885, 1206, 1210, 1704, 1743, 1766, 1777, 1780, 1790, 1838], "float": [2, 6, 8, 12, 13, 14, 22, 23, 25, 26, 27, 31, 33, 34, 35, 39, 43, 44, 45, 48, 49, 50, 51, 52, 53, 57, 59, 68, 73, 75, 76, 77, 78, 80, 81, 84, 89, 90, 91, 92, 96, 100, 103, 106, 111, 114, 115, 128, 130, 133, 138, 139, 145, 147, 148, 149, 150, 154, 155, 156, 157, 158, 159, 160, 162, 165, 167, 181, 183, 184, 185, 186, 187, 237, 238, 239, 240, 246, 248, 254, 255, 262, 263, 267, 276, 284, 285, 287, 294, 295, 300, 301, 302, 318, 319, 322, 324, 325, 329, 335, 336, 338, 342, 345, 356, 363, 367, 368, 369, 374, 377, 383, 385, 386, 388, 390, 395, 1740, 1743, 1750, 1752, 1759, 1761, 1766, 1768, 1771, 1772, 1774, 1794, 1800, 1832, 1844], "flocal": 76, "flop": 1757, "floppi": 1802, "florida": [1692, 1752], "flow": 1824, "flpath": 354, "fluctuat": 1837, "fluoromethan": 1728, "flush": 189, "flux": 1706, "fly": [430, 627, 836, 882, 935, 1199, 1206, 1210, 1213, 1228, 1393, 1704, 1749, 1781, 1837, 1838], "fm": 1706, "fmass": 106, "fmm": [763, 764, 1209, 1228, 1394, 1395, 1704, 1754], "fn": [106, 1774], "fname": [187, 297, 298, 347, 348], "fno": [190, 284, 295, 1084, 1085, 1219, 1704, 1714, 1740, 1766, 1781, 1790, 1798, 1842], "fnocc": [400, 1078, 1158, 1221, 1704, 1705, 1709, 1714, 1739, 1777, 1790, 1809, 1842], "fnocc1": [1714, 1842], "fnocc2": [1714, 1842], "fnocc3": [1714, 1842], "fnocc4": [1714, 1842], "fnocc5": [1714, 1842], "fnocc6": [1714, 1842], "fnocc7": [1714, 1842], "fnocc_wfn": 1809, "focal": [1740, 1768], "fock": [18, 66, 84, 130, 150, 295, 300, 301, 302, 318, 319, 442, 483, 518, 542, 623, 664, 665, 667, 676, 738, 904, 972, 1171, 1172, 1179, 1180, 1199, 1200, 1202, 1203, 1206, 1208, 1212, 1214, 1222, 1225, 1229, 1231, 1296, 1411, 1566, 1567, 1568, 1663, 1690, 1695, 1697, 1698, 1700, 1703, 1704, 1734, 1735, 1740, 1743, 1744, 1745, 1749, 1753, 1754, 1755, 1756, 1757, 1758, 1763, 1766, 1769, 1770, 1771, 1772, 1776, 1777, 1778, 1780, 1790, 1798, 1800, 1803, 1810, 1817, 1821, 1823, 1824, 1832, 1836, 1837], "fockci": 1738, "focu": 2, "focus": [2, 1824], "foil": 1738, "fold": 1755, "folder": [2, 1738, 1747, 1757, 1770, 1788, 1823, 1833], "foldi": [1734, 1836], "follow": [0, 2, 11, 106, 111, 284, 288, 289, 314, 339, 340, 356, 368, 369, 468, 577, 603, 614, 635, 640, 641, 652, 680, 681, 829, 1200, 1206, 1226, 1231, 1354, 1361, 1363, 1485, 1555, 1556, 1575, 1649, 1692, 1704, 1714, 1730, 1735, 1737, 1738, 1740, 1741, 1742, 1743, 1747, 1748, 1749, 1752, 1753, 1754, 1755, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1767, 1770, 1771, 1774, 1775, 1781, 1782, 1785, 1788, 1789, 1791, 1792, 1797, 1798, 1799, 1801, 1802, 1803, 1805, 1808, 1809, 1810, 1817, 1823, 1828, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1840, 1841, 1842, 1844], "follow_root": [0, 1, 2, 829, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "follow_step_incr": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "follow_step_scal": [0, 1, 2, 1555, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "follow_vector": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "font": [1738, 1750], "fontsiz": 1750, "footnot": [1692, 1733, 1752, 1759, 1802, 1838], "fopenmp": 1738, "forc": [2, 8, 106, 307, 386, 562, 571, 572, 573, 574, 596, 615, 617, 618, 664, 665, 679, 697, 698, 707, 1101, 1182, 1204, 1206, 1220, 1222, 1226, 1230, 1231, 1307, 1308, 1309, 1310, 1311, 1338, 1342, 1351, 1365, 1480, 1507, 1606, 1623, 1704, 1706, 1714, 1734, 1735, 1738, 1743, 1746, 1752, 1755, 1757, 1759, 1762, 1765, 1772, 1773, 1775, 1781, 1782, 1783, 1784, 1788, 1798, 1802, 1803, 1810, 1817, 1828, 1833, 1837, 1838, 1839, 1842, 1844], "force_c1": 106, "force_comput": 119, "force_occpi": 150, "force_restart": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "force_standa": [665, 1206, 1704], "force_twocon": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "force_unit": 106, "forcexyz": 350, "forcibli": [1231, 1620, 1704], "foreach": 1767, "foremost": 1838, "forg": [1736, 1737, 1738, 1747, 1748, 1754, 1759, 1774, 1781, 1788], "forget": [1767, 1788], "forgiv": [2, 383], "forgo": 1737, "fork": [1736, 1738, 1767, 1784, 1786, 1788], "form": [2, 75, 84, 103, 106, 141, 265, 283, 284, 306, 307, 333, 354, 356, 370, 378, 392, 494, 574, 621, 708, 811, 829, 833, 838, 855, 997, 1200, 1206, 1210, 1215, 1231, 1524, 1526, 1704, 1714, 1726, 1738, 1740, 1743, 1746, 1752, 1754, 1755, 1756, 1757, 1759, 1764, 1767, 1772, 1776, 1782, 1785, 1788, 1789, 1797, 1799, 1800, 1802, 1810, 1829, 1832, 1835, 1837, 1838, 1841, 1842], "form_aux_matric": 75, "form_c": 84, "form_cfor": 130, "form_cholesky_invers": 78, "form_d": 84, "form_eig_invers": 78, "form_f": 84, "form_fdsmsdf": 84, "form_fitting_metr": 78, "form_full_invers": 78, "form_g": 84, "form_h": 84, "form_initial_c": 84, "form_initial_f": 84, "form_opdm": 13, "form_qr_invers": 78, "form_rotation_matrix": 133, "form_shalf": 84, "form_symmetry_inform": 106, "form_tpdm": 13, "form_unc_amplitud": 75, "form_v": 84, "formal": [106, 267, 874, 1210, 1704, 1738, 1755, 1756, 1759, 1771, 1838, 1841], "formaldehyd": 1833, "formalisim": 1829, "formamid": [1692, 1714, 1752, 1842], "formamidin": [1692, 1752], "format": [0, 8, 75, 100, 104, 106, 111, 150, 187, 267, 282, 285, 287, 296, 297, 314, 318, 319, 332, 336, 338, 347, 350, 380, 388, 389, 390, 592, 609, 614, 829, 995, 1027, 1206, 1210, 1215, 1217, 1226, 1230, 1304, 1436, 1704, 1708, 1711, 1714, 1730, 1738, 1743, 1746, 1756, 1757, 1764, 1767, 1768, 1769, 1772, 1775, 1777, 1782, 1785, 1786, 1791, 1794, 1799, 1800, 1802, 1814, 1822, 1823, 1824, 1828, 1832, 1833, 1837, 1838, 1841, 1842, 1843, 1844], "format_molecule_for_mol": 106, "formatt": 1747, "former": [2, 1714, 1738, 1753, 1757, 1764, 1785, 1810, 1837, 1841, 1842], "formerli": [267, 1738, 1746, 1748, 1759, 1768, 1794], "formic": [1692, 1711, 1714, 1752, 1842], "formul": [377, 665, 1206, 1704, 1755, 1781, 1829, 1837], "formula": [2, 295, 318, 319, 864, 889, 1013, 1015, 1018, 1210, 1216, 1226, 1307, 1308, 1309, 1310, 1311, 1704, 1714, 1740, 1756, 1759, 1766, 1800, 1802, 1837, 1838, 1842], "fort": [1224, 1233, 1235, 1236, 1237, 1238, 1239, 1241, 1704], "forth": 1838, "fortran": [1714, 1736, 1748, 1754, 1759, 1762, 1767, 1774, 1775, 1803, 1810, 1842], "fortun": [1738, 1770, 1828, 1844], "forum": [1717, 1738, 1757, 1781, 1816, 1838], "forward": [150, 192, 193, 203, 204, 1226, 1346, 1704, 1743, 1754, 1767], "foster": [973, 974, 1214, 1704, 1763], "found": [0, 2, 106, 285, 287, 336, 338, 811, 993, 1210, 1215, 1231, 1649, 1704, 1730, 1733, 1738, 1740, 1743, 1746, 1748, 1749, 1750, 1752, 1755, 1756, 1757, 1759, 1760, 1762, 1764, 1765, 1767, 1771, 1772, 1773, 1774, 1775, 1779, 1781, 1782, 1783, 1784, 1785, 1792, 1797, 1802, 1803, 1805, 1817, 1823, 1828, 1832, 1833, 1837, 1838, 1839, 1842, 1844], "found_": 1785, "found_libefp": 1785, "foundat": 1832, "four": [0, 2, 95, 286, 291, 337, 341, 430, 433, 466, 507, 514, 609, 627, 652, 727, 1199, 1200, 1201, 1202, 1206, 1208, 1225, 1230, 1242, 1455, 1704, 1714, 1726, 1742, 1743, 1748, 1750, 1753, 1759, 1767, 1776, 1782, 1801, 1802, 1829, 1832, 1835, 1837, 1838, 1842], "fourier": 1824, "fourth": [609, 616, 631, 677, 1206, 1229, 1413, 1704, 1730, 1753, 1771, 1799], "fpa": 1740, "fprintf": 1810, "fr": 388, "frac": [84, 368, 369, 377, 1182, 1222, 1231, 1557, 1704, 1714, 1742, 1753, 1756, 1757, 1759, 1763, 1768, 1771, 1776, 1798, 1829, 1836, 1837, 1838, 1841, 1842], "frac_dii": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "frac_load": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "frac_nuk": [1757, 1768, 1777], "frac_occ": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "frac_performed_": 84, "frac_renorm": [0, 1, 2, 84, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "frac_start": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "frac_travers": [1757, 1768, 1777], "frac_val": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "fractalcli": [265, 1740, 1772, 1794], "fraction": [957, 1110, 1213, 1221, 1225, 1289, 1559, 1561, 1610, 1704, 1714, 1750, 1790, 1838, 1842], "frag": [1226, 1336, 1704, 1782, 1785, 1802], "frag1": 1770, "frag2": 1770, "frag_ind": 106, "frag_mod": [0, 1, 2, 1341, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "frag_ref_atom": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "fraga": 1770, "fragb": 1770, "fraglib": 1782, "fragment": [76, 79, 106, 295, 350, 1013, 1015, 1018, 1034, 1035, 1048, 1125, 1216, 1218, 1221, 1230, 1313, 1317, 1341, 1442, 1678, 1704, 1711, 1714, 1722, 1726, 1738, 1742, 1743, 1749, 1766, 1767, 1768, 1770, 1771, 1776, 1780, 1781, 1785, 1790, 1794, 1828, 1832, 1835, 1837, 1842, 1844], "fragment_charg": [106, 1768], "fragment_multipl": [106, 1768], "fragment_separ": [106, 1768], "fragmenta": 1835, "fragmentb": 1835, "fragmentedmol": 1833, "fragmenttyp": 1827, "fragmol": 1768, "fragnam": 1782, "frame": [106, 1743], "framework": [1733, 1747, 1838], "francesco": [1750, 1829, 1836], "fransson": [1734, 1781], "franz": 1734, "frediani": 1803, "free": [11, 352, 677, 1206, 1685, 1691, 1704, 1714, 1750, 1756, 1757, 1771, 1776, 1781, 1788, 1799, 1810, 1828, 1836, 1837, 1842, 1843, 1844], "free_block": 1810, "freedom": [617, 1024, 1206, 1217, 1704, 1738, 1743, 1776, 1833], "freeli": [2, 1738, 1759, 1774, 1801], "freez": [76, 809, 1125, 1126, 1148, 1149, 1210, 1221, 1226, 1230, 1315, 1316, 1317, 1454, 1704, 1714, 1756, 1763, 1771, 1789, 1792, 1802, 1828, 1837, 1842, 1844], "freeze_all_dihedr": [0, 1, 2, 1371, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "freeze_cor": [0, 1, 2, 8, 76, 284, 1126, 1127, 1148, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1828, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "freeze_core_polici": [0, 1, 2, 1125, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "freeze_interfrag": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "freeze_intrafrag": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "freeze_list": 1802, "freq": [301, 302, 388, 1714, 1740, 1772, 1833, 1842, 1843, 1844], "freq1": [1714, 1842], "freq2": [1714, 1842], "freq_algorit": [624, 1206, 1704], "freq_func": [300, 301, 302, 1772], "frequenc": [150, 300, 307, 368, 369, 377, 386, 388, 389, 399, 539, 550, 573, 616, 669, 679, 701, 707, 921, 922, 1024, 1203, 1206, 1213, 1217, 1226, 1231, 1323, 1568, 1704, 1706, 1710, 1714, 1718, 1723, 1735, 1738, 1742, 1743, 1769, 1777, 1778, 1781, 1792, 1796, 1798, 1801, 1802, 1831, 1832, 1833, 1837, 1838, 1840, 1842, 1843], "frequency_scale_factor": 1801, "frequent": [1776, 1785, 1832], "fresh": [1747, 1808], "fridai": 1786, "friend": 1838, "friendli": [1781, 1816], "friesner": 1838, "frisch": [356, 1734], "frish": 1810, "from": [0, 1, 2, 5, 8, 20, 21, 64, 74, 75, 84, 86, 87, 92, 94, 100, 106, 115, 130, 132, 138, 148, 150, 158, 176, 217, 262, 263, 265, 267, 272, 277, 283, 284, 286, 291, 294, 295, 296, 297, 299, 303, 304, 310, 314, 317, 321, 329, 333, 337, 341, 342, 345, 346, 347, 349, 350, 355, 356, 361, 365, 367, 375, 376, 377, 378, 384, 386, 388, 390, 393, 394, 396, 397, 399, 413, 434, 457, 474, 476, 493, 494, 530, 539, 554, 573, 574, 581, 587, 592, 599, 601, 617, 623, 638, 650, 651, 654, 664, 665, 671, 676, 684, 685, 689, 691, 705, 707, 731, 783, 802, 830, 835, 862, 881, 891, 923, 954, 994, 1071, 1157, 1186, 1198, 1199, 1200, 1202, 1203, 1206, 1208, 1210, 1213, 1215, 1219, 1221, 1222, 1224, 1225, 1226, 1228, 1229, 1230, 1231, 1232, 1241, 1268, 1331, 1332, 1353, 1380, 1382, 1401, 1405, 1418, 1455, 1535, 1558, 1568, 1579, 1583, 1616, 1617, 1666, 1692, 1704, 1708, 1711, 1714, 1715, 1717, 1722, 1723, 1724, 1725, 1730, 1736, 1739, 1740, 1742, 1743, 1746, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1773, 1774, 1775, 1776, 1777, 1780, 1781, 1782, 1783, 1784, 1785, 1787, 1788, 1790, 1791, 1792, 1794, 1797, 1798, 1799, 1801, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1817, 1823, 1824, 1825, 1828, 1829, 1832, 1833, 1835, 1836, 1837, 1838, 1839, 1841, 1842, 1843, 1844], "from_arrai": [100, 106, 148, 267, 331, 1759, 1797], "from_dict": [106, 1726], "from_fil": [150, 1767], "from_list": [64, 100, 148, 1797], "from_schema": 106, "from_seri": [100, 148], "from_str": 106, "front": [1757, 1781, 1824, 1828, 1832, 1844], "frontier": [1714, 1750, 1842], "frontier_orbit": [1112, 1221, 1704, 1750], "frontmatt": 1788, "frozen": [0, 8, 84, 150, 268, 284, 295, 298, 348, 625, 1125, 1126, 1127, 1128, 1206, 1221, 1226, 1318, 1319, 1320, 1321, 1322, 1704, 1711, 1714, 1715, 1739, 1740, 1742, 1743, 1752, 1755, 1756, 1757, 1766, 1776, 1777, 1781, 1789, 1790, 1792, 1798, 1802, 1810, 1829, 1837, 1842], "frozen_bend": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "frozen_cartesian": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "frozen_dcc": 1810, "frozen_dihedr": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "frozen_dist": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "frozen_docc": [0, 1, 2, 1125, 1704, 1714, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "frozen_occ": 150, "frozen_oofp": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "frozen_uocc": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "frozen_vir": 150, "frozen_virt": [626, 1206, 1704], "frzcpi": 150, "frzvpi": 150, "fsapt": [1043, 1046, 1218, 1704, 1714, 1738, 1770, 1837, 1842], "fsapt0": 1837, "fsapt1": [1714, 1770, 1842], "fsapt2": [1714, 1842], "fsaptd": [1714, 1842], "fsymbol": 106, "ft97": [295, 318, 319, 1695, 1698, 1699, 1703, 1757, 1758, 1766, 1800], "ftild": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "ftrue_atomic_numb": 106, "fuel": [1714, 1842], "fukui": 1750, "fulfil": [1738, 1743, 1802], "full": [0, 2, 100, 106, 135, 138, 150, 288, 289, 295, 300, 301, 302, 318, 319, 322, 325, 339, 340, 354, 377, 477, 498, 573, 574, 619, 639, 655, 677, 698, 708, 729, 767, 786, 821, 881, 1200, 1206, 1208, 1209, 1210, 1226, 1229, 1231, 1232, 1323, 1372, 1405, 1485, 1499, 1556, 1568, 1666, 1673, 1695, 1696, 1697, 1700, 1704, 1711, 1714, 1725, 1729, 1735, 1738, 1742, 1743, 1744, 1745, 1746, 1748, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1764, 1766, 1767, 1770, 1771, 1772, 1776, 1777, 1781, 1785, 1788, 1789, 1790, 1794, 1800, 1802, 1809, 1819, 1832, 1833, 1838, 1841, 1842, 1843], "full_geometri": 106, "full_hess_everi": [0, 1, 2, 611, 1206, 1300, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "full_matrix": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "full_nam": 120, "full_path": 87, "full_pg_n": 106, "full_spac": 13, "fuller": [1709, 1738, 1776, 1796], "fulli": [2, 100, 106, 430, 1199, 1226, 1231, 1352, 1490, 1704, 1738, 1743, 1748, 1753, 1756, 1757, 1760, 1776, 1781, 1788, 1803, 1810, 1824, 1836, 1838], "fullquart": [570, 574, 1206, 1704], "func": [106, 267, 284, 300, 301, 302, 318, 319, 346, 1714, 1740, 1752, 1759, 1772, 1774, 1779, 1794, 1800, 1809, 1842], "func_cal": 1757, "funciton": [1230, 1471, 1704, 1837], "function": [0, 5, 8, 13, 20, 27, 29, 64, 73, 81, 82, 84, 87, 88, 90, 92, 96, 100, 101, 103, 105, 106, 110, 112, 114, 119, 138, 147, 148, 150, 173, 235, 236, 240, 246, 248, 252, 267, 268, 275, 278, 281, 283, 284, 285, 286, 287, 293, 295, 296, 298, 300, 301, 302, 303, 304, 306, 307, 312, 314, 315, 316, 318, 319, 322, 324, 325, 327, 329, 331, 333, 335, 336, 337, 338, 346, 348, 350, 351, 352, 356, 359, 368, 369, 370, 372, 373, 377, 378, 380, 381, 382, 391, 392, 393, 399, 400, 448, 488, 586, 597, 623, 628, 629, 630, 631, 635, 652, 658, 660, 678, 691, 761, 774, 891, 967, 978, 979, 999, 1108, 1131, 1157, 1170, 1199, 1200, 1206, 1208, 1209, 1210, 1214, 1215, 1221, 1226, 1231, 1368, 1487, 1503, 1504, 1521, 1524, 1526, 1532, 1535, 1621, 1671, 1690, 1698, 1703, 1704, 1710, 1713, 1714, 1730, 1734, 1738, 1740, 1742, 1746, 1748, 1750, 1752, 1753, 1754, 1755, 1756, 1759, 1760, 1763, 1764, 1766, 1767, 1768, 1769, 1771, 1774, 1775, 1776, 1777, 1780, 1781, 1783, 1784, 1786, 1790, 1791, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1808, 1809, 1810, 1817, 1819, 1823, 1824, 1826, 1828, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1840, 1842, 1843, 1844], "function_index": 81, "function_kwarg": 378, "function_to_cent": 8, "function_to_shel": 8, "functionl": 1757, "functionnam": 1740, "functions_local_to_glob": 9, "fundament": [1781, 1797, 1801], "furan": 0, "furor": 1804, "further": [2, 106, 284, 381, 382, 575, 671, 1206, 1692, 1704, 1730, 1738, 1740, 1743, 1748, 1752, 1756, 1757, 1760, 1772, 1780, 1781, 1788, 1798, 1800, 1809, 1810, 1817, 1826, 1833, 1838, 1841], "furthermor": [655, 1206, 1231, 1655, 1704, 1753, 1798, 1802, 1841], "futur": [2, 150, 283, 333, 603, 1206, 1231, 1589, 1704, 1736, 1737, 1757, 1759, 1767, 1774, 1781, 1785, 1788, 1809], "futurewarn": 279, "fw": [1734, 1836], "fwhm": [322, 325], "fx": 106, "fy": 106, "fz": 106, "fzc": [13, 98, 1714, 1842], "fzcv": [1714, 1842], "fzv": [13, 98], "g": [8, 74, 84, 106, 150, 226, 265, 266, 267, 268, 270, 276, 288, 289, 295, 296, 306, 339, 340, 354, 356, 374, 386, 393, 395, 433, 444, 466, 482, 507, 514, 575, 586, 668, 669, 680, 695, 823, 947, 1106, 1107, 1147, 1199, 1200, 1201, 1202, 1206, 1210, 1213, 1221, 1224, 1225, 1228, 1230, 1232, 1235, 1241, 1242, 1282, 1380, 1469, 1666, 1694, 1704, 1706, 1708, 1730, 1732, 1733, 1734, 1737, 1738, 1740, 1743, 1748, 1749, 1752, 1753, 1754, 1755, 1759, 1760, 1764, 1766, 1767, 1768, 1769, 1770, 1772, 1774, 1776, 1777, 1779, 1780, 1782, 1785, 1786, 1787, 1789, 1792, 1794, 1795, 1797, 1799, 1800, 1802, 1804, 1808, 1809, 1812, 1814, 1817, 1824, 1828, 1829, 1832, 1833, 1837, 1838, 1840, 1841, 1843, 1844], "g09": [2, 285, 296, 336, 1769], "g09ur": [2, 285, 296, 336, 1769], "g2": [295, 1714, 1766, 1771, 1842], "g4e0596": 1786, "g6100822": 1786, "g94": 1730, "g_": [377, 1753], "g_converg": [0, 1, 2, 632, 1206, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "g_user_scftyp": 1801, "g_user_wfn": 1801, "ga": [1125, 1221, 1692, 1704, 1706, 1707, 1714, 1731, 1752, 1771, 1837, 1842], "gain": [1230, 1455, 1704, 1756, 1757, 1770, 1781, 1837, 1838], "galv": [1734, 1781], "gam": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "gamess": 1782, "gamlam": [621, 641, 668, 1206, 1704], "gamma": [17, 322, 324, 325, 377, 384, 386, 627, 1206, 1704, 1772, 1841], "gamma_": [377, 1753, 1757], "gamma_1": 1753, "gamma_2": 1753, "gamma_p": 1753, "gamma_q": 1753, "gap": 1757, "garza": [1231, 1616, 1617, 1704], "gatech": [1748, 1781], "gather": [1738, 1757], "gau": [1226, 1324, 1704, 1802], "gau2grid": [1738, 1777, 1780], "gau2grid_dir": 1773, "gau2gridconfig": 1773, "gau2gridfor": 1780, "gau_loos": [1226, 1324, 1704, 1802], "gau_tight": [1226, 1324, 1704, 1802], "gau_verytight": [1226, 1324, 1704, 1802], "gaug": [0, 1, 2, 636, 1206, 1704, 1714, 1730, 1733, 1735, 1739, 1740, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "gauss": [295, 318, 319, 637, 655, 1206, 1704, 1734, 1744, 1745, 1766, 1777, 1780, 1781, 1792, 1800, 1836], "gaussian": [8, 81, 295, 296, 377, 628, 1206, 1704, 1708, 1730, 1734, 1750, 1766, 1769, 1771, 1773, 1775, 1781, 1783, 1810, 1817, 1827, 1838], "gaussian94": [1730, 1743], "gaussianshel": [8, 1817, 1827], "gaussiantyp": 1827, "gauxc": [18, 1231, 1625, 1626, 1629, 1633, 1634, 1636, 1637, 1704, 1738, 1838], "gauxc_dir": 1838, "gauxc_enable_gpu": 1838, "gb": [8, 374, 395, 650, 1206, 1704, 1730, 1742, 1743, 1748, 1750, 1757, 1764, 1767, 1770, 1810, 1821, 1828, 1832, 1838], "gcbee32b": 1786, "gcc": [1736, 1746, 1748, 1767, 1781, 1808], "gcc5": 1738, "gcc6": 1738, "gcc7": 1738, "gcc72": 1738, "gcc_5": 1738, "gcc_linux": 1738, "gccpfx": 1738, "gcov": 1822, "gcp": [106, 267, 295, 318, 319, 400, 1695, 1698, 1700, 1701, 1703, 1738, 1758, 1759, 1766, 1777, 1780, 1781, 1800, 1842], "gcp_engin": [267, 1759], "gcp_v202": 1759, "gdb": [1736, 1767, 1814], "gdma": [400, 1097, 1704, 1705, 1709, 1736, 1738, 1777, 1780, 1785, 1788, 1842], "gdma1": 1719, "gdma_dir": 1775, "gdma_interfac": 1775, "gdma_limit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "gdma_mangl": 1775, "gdma_multipole_unit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "gdma_origin": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "gdma_radiu": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "gdma_switch": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "gdmaconfig": 1775, "ge": [1707, 1731], "geersten": 1734, "gemm": [100, 1810], "gemv": 1810, "gen_davidson": [874, 1210, 1704], "genba": [8, 577, 628, 1206, 1704, 1743], "genbas_1": [628, 1206, 1704], "gener": [0, 1, 2, 16, 90, 100, 106, 148, 150, 163, 216, 247, 267, 279, 284, 291, 292, 294, 295, 296, 297, 303, 314, 330, 331, 335, 341, 343, 345, 347, 368, 369, 372, 377, 407, 470, 570, 573, 574, 575, 584, 586, 590, 603, 618, 619, 623, 628, 644, 669, 765, 786, 832, 886, 975, 1035, 1036, 1037, 1095, 1096, 1108, 1111, 1187, 1206, 1226, 1296, 1326, 1334, 1335, 1682, 1704, 1714, 1726, 1730, 1733, 1734, 1735, 1738, 1739, 1740, 1742, 1743, 1748, 1749, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1761, 1762, 1763, 1764, 1766, 1767, 1769, 1770, 1771, 1774, 1775, 1777, 1780, 1781, 1782, 1783, 1785, 1786, 1787, 1791, 1792, 1794, 1797, 1798, 1799, 1802, 1804, 1808, 1809, 1810, 1817, 1818, 1824, 1828, 1829, 1831, 1832, 1833, 1835, 1837, 1838, 1840, 1841, 1842], "general_invert": 100, "genfromtxt": 2, "geni": 1764, "genuin": 13, "geo": [1785, 1835], "geom": [106, 304, 386, 388, 1714, 1722, 1768, 1785, 1842], "geom1pi": 1833, "geom1psi": 1833, "geom2": 1833, "geom2pi": 1833, "geom2psi": 1833, "geom_maxit": [0, 1, 2, 318, 319, 633, 1206, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "geometr": [106, 318, 319, 673, 702, 1206, 1231, 1505, 1704, 1759, 1774, 1790, 1800], "geometri": [2, 83, 106, 265, 270, 287, 318, 319, 338, 350, 386, 388, 399, 457, 570, 586, 592, 611, 632, 633, 634, 635, 652, 656, 705, 921, 922, 1024, 1199, 1206, 1213, 1217, 1226, 1231, 1301, 1323, 1324, 1325, 1349, 1350, 1351, 1352, 1364, 1365, 1368, 1565, 1692, 1704, 1708, 1710, 1711, 1714, 1715, 1723, 1724, 1735, 1738, 1740, 1742, 1743, 1752, 1753, 1754, 1767, 1769, 1770, 1776, 1777, 1778, 1779, 1781, 1782, 1785, 1790, 1792, 1794, 1798, 1799, 1831, 1834, 1835, 1837, 1838, 1840, 1841, 1842], "geometric_keyword": 1802, "geometryunit": [106, 1827], "georgia": [1692, 1752], "gepol": 1803, "gerg": 1735, "get": [11, 64, 68, 73, 86, 87, 88, 98, 100, 106, 114, 137, 148, 150, 201, 220, 247, 300, 301, 302, 306, 307, 318, 319, 575, 793, 1206, 1210, 1704, 1714, 1722, 1736, 1737, 1740, 1743, 1748, 1757, 1764, 1767, 1770, 1772, 1777, 1781, 1785, 1788, 1795, 1798, 1800, 1801, 1808, 1809, 1810, 1817, 1818, 1820, 1821, 1822, 1828, 1833, 1838, 1840, 1841, 1842, 1844], "get_active_molecul": [378, 1837], "get_algorithm": 78, "get_amplitud": 11, "get_ao_cor": 27, "get_ao_s": 27, "get_arrai": 150, "get_array_vari": 1775, "get_basisset": 150, "get_block": [88, 100, 147, 148], "get_blocks12": 1817, "get_blocks34": 1817, "get_bool": 114, "get_cosx_grid": 18, "get_current_modul": 114, "get_default_namespac": 86, "get_default_path": 87, "get_dens": 150, "get_dimens": 13, "get_dipole_field_strength": 150, "get_doubl": 114, "get_dpd_id": 90, "get_energi": 84, "get_file_path": 87, "get_frag": 106, "get_fragment_charg": 106, "get_fragment_multipl": 106, "get_fragment_typ": 106, "get_frozen_core_energi": 90, "get_full_point_group": 106, "get_full_point_group_with_n": 106, "get_global_opt": [8, 1801, 1809, 1837], "get_gradi": 1743, "get_int": 114, "get_int_vector": 114, "get_keep_dpd_so_int": 90, "get_keep_ht_int": 90, "get_keep_iwl_so_int": 90, "get_local_opt": 1801, "get_memori": [27, 90, 374, 395], "get_method": 27, "get_metr": 78, "get_mix_data": 96, "get_mo_cor": 27, "get_np_xyzw": 147, "get_omega": 92, "get_omega_alpha": 92, "get_omega_beta": 92, "get_opdm": [13, 150, 314, 1791], "get_opt": [8, 195, 197, 1801, 1809], "get_orbit": 13, "get_pivot": 78, "get_point": 1810, "get_print": [90, 150], "get_psi_result": [1740, 1772, 1794], "get_psio": 90, "get_result": [265, 1740, 1772, 1794], "get_reverse_pivot": 78, "get_schwarz_cutoff": 27, "get_scratch_filenam": 150, "get_snlink_max_am": 18, "get_space_s": 27, "get_str": 114, "get_tei_already_presort": 90, "get_tensor": 27, "get_tensor_pqq": 75, "get_tensor_s": 27, "get_tensor_shap": 27, "get_tpdm": 13, "get_vari": [106, 150, 1738, 1743, 1832, 1834], "get_wcombin": 92, "get_x1": 94, "get_x2": 94, "get_x3": 94, "get_x4": 94, "get_z": 94, "getbasetemp": 1788, "getcharg": 73, "getconf": [1738, 1748], "getpid": [86, 354], "gev": 1706, "gfm": [1225, 1288, 1295, 1704], "gfortran": [1738, 1748, 1808], "gfortran_linux": 1738, "gfortran_osx": 1738, "gg": 1839, "gga": [138, 295, 318, 319, 400, 1695, 1696, 1697, 1698, 1700, 1701, 1702, 1703, 1714, 1739, 1757, 1766, 1781, 1800, 1838, 1842], "gga1": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "gga_c_pb": 1757, "gga_superfunc": [1714, 1842], "gga_x_pb": 1757, "gh": [1788, 1833], "gha": [1738, 1786, 1788], "ghost": [79, 106, 1061, 1218, 1692, 1704, 1711, 1714, 1721, 1724, 1743, 1752, 1776, 1802, 1828, 1832, 1837, 1842, 1844], "ghost_as_dummi": 106, "ghost_format": 106, "ghrn": 1788, "giampaolo": 1738, "giao": [669, 1206, 1704, 1708], "gib": 1819, "gibb": [1691, 1714, 1776, 1828, 1842, 1843, 1844], "gibi": 1821, "gibibyt": 1821, "giga": 1821, "gigant": [882, 1210, 1704], "gij": 1791, "gill": 1757, "git": [1736, 1737, 1748, 1767, 1777, 1781, 1788, 1805, 1806, 1814], "git_repositori": 1738, "git_tag": [1738, 1788], "github": [372, 561, 993, 1204, 1215, 1704, 1736, 1738, 1746, 1748, 1751, 1757, 1759, 1767, 1781, 1782, 1785, 1787, 1802, 1803, 1805, 1806, 1814, 1816, 1817, 1833, 1837, 1838], "gitlab": [1692, 1752, 1784], "give": [0, 70, 100, 148, 331, 377, 617, 671, 693, 701, 783, 784, 808, 823, 835, 1102, 1125, 1159, 1160, 1161, 1162, 1164, 1165, 1206, 1210, 1221, 1704, 1737, 1738, 1743, 1748, 1752, 1755, 1770, 1771, 1785, 1786, 1795, 1797, 1809, 1828, 1837, 1844], "given": [5, 8, 17, 64, 73, 81, 84, 86, 87, 100, 103, 106, 111, 112, 115, 134, 138, 148, 284, 295, 314, 326, 331, 550, 592, 609, 622, 650, 651, 660, 671, 672, 704, 827, 833, 859, 860, 884, 1203, 1206, 1210, 1704, 1714, 1730, 1738, 1740, 1742, 1755, 1759, 1763, 1766, 1771, 1775, 1776, 1781, 1791, 1797, 1801, 1809, 1810, 1817, 1821, 1824, 1828, 1829, 1833, 1836, 1837, 1838, 1842, 1844], "gk": 1757, "glanc": 1788, "glean": [1739, 1742, 1743, 1756, 1757, 1781, 1798, 1817], "glick": [1734, 1763, 1781], "global": [8, 86, 114, 138, 171, 176, 195, 196, 197, 200, 208, 210, 212, 227, 230, 235, 243, 255, 262, 263, 326, 327, 351, 370, 371, 376, 397, 400, 1704, 1705, 1714, 1752, 1757, 1764, 1767, 1777, 1799, 1809, 1812, 1828, 1832, 1837, 1842, 1844], "global_opt": 1801, "globalsonli": 370, "globular": 1763, "glossary_psivari": 1823, "glycin": [1714, 1833, 1842], "gm": [1692, 1752], "gmail": 1738, "gn": 1790, "gnu": [1738, 1764, 1781, 1808], "go": [804, 1047, 1210, 1218, 1230, 1231, 1441, 1612, 1704, 1737, 1738, 1740, 1743, 1748, 1755, 1785, 1788, 1801, 1804, 1810, 1824, 1828, 1837, 1844], "goal": [1804, 1808], "goddard": 1734, "goe": [283, 333, 366, 379, 1225, 1283, 1294, 1704, 1730, 1738, 1756, 1821, 1828, 1844], "goerigk": 1734, "gold": 1740, "gomp": 1738, "gonthier": [1734, 1781, 1786, 1837, 1838], "good": [0, 2, 86, 106, 374, 386, 395, 833, 1210, 1229, 1688, 1704, 1737, 1738, 1743, 1748, 1750, 1754, 1755, 1756, 1757, 1763, 1764, 1781, 1786, 1809, 1817, 1824, 1828, 1837, 1838, 1844], "gordan": 1837, "gordon": [1734, 1757, 1759, 1771, 1798], "gori": 1738, "got": [2, 1737, 1757, 1770, 1781, 1833, 1838], "goto": [1737, 1788], "gotobla": 1738, "gotten": 1738, "gov": 1734, "govern": [268, 433, 466, 507, 514, 1199, 1200, 1201, 1202, 1225, 1242, 1704, 1738, 1742, 1743, 1785, 1801, 1808, 1809, 1832, 1840], "gpl": 1781, "gpu": [1105, 1221, 1231, 1624, 1637, 1704, 1720, 1734, 1738, 1777, 1780, 1838], "gpu_dfcc": [400, 1738, 1842], "gpudfcc1": 1720, "gpudfcc2": 1720, "grab": [1748, 1788], "grac": [138, 1230, 1472, 1473, 1474, 1704, 1714, 1837, 1842], "grac_alpha": 138, "grac_beta": 138, "grac_shift": 138, "grad": [303, 845, 1025, 1210, 1217, 1704, 1708, 1711, 1713, 1714, 1715, 1722, 1743, 1769, 1775, 1842], "grad1": [1714, 1842], "grad2": [1714, 1842], "grad3": [1714, 1842], "grad4": [1714, 1842], "grad5": [1714, 1838, 1842], "gradient": [2, 61, 73, 100, 103, 106, 133, 147, 150, 241, 262, 265, 267, 268, 285, 296, 300, 301, 302, 303, 307, 312, 318, 319, 335, 336, 367, 378, 568, 571, 581, 586, 599, 601, 609, 610, 615, 618, 632, 665, 669, 679, 692, 698, 707, 743, 750, 845, 854, 857, 876, 930, 946, 949, 950, 958, 1011, 1025, 1174, 1198, 1201, 1202, 1205, 1206, 1208, 1210, 1213, 1216, 1217, 1222, 1225, 1231, 1266, 1271, 1281, 1285, 1286, 1290, 1497, 1522, 1523, 1524, 1525, 1526, 1648, 1674, 1685, 1690, 1704, 1706, 1708, 1711, 1714, 1715, 1718, 1721, 1722, 1725, 1735, 1738, 1739, 1740, 1742, 1743, 1746, 1754, 1755, 1756, 1757, 1759, 1769, 1771, 1772, 1774, 1775, 1776, 1777, 1779, 1781, 1785, 1789, 1790, 1794, 1796, 1798, 1802, 1803, 1804, 1809, 1817, 1823, 1828, 1831, 1832, 1837, 1838, 1840, 1842, 1844], "gradient_": 150, "gradient_body_dict": 1794, "gradient_on_charg": 73, "gradient_rm": 133, "gradient_writ": [0, 1, 2, 306, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "gradonli": [615, 1206, 1704], "gradual": 1759, "grafova": [1692, 1752], "grai": 1750, "grain": [1754, 1817], "gram": 1706, "grand": 1734, "graph": 1768, "graphic": [1734, 1838], "gravit": [1706, 1832], "graviti": 1706, "grd": 1743, "great": [605, 1206, 1704, 1767, 1788, 1808, 1822, 1824], "greater": [2, 285, 287, 336, 338, 577, 808, 852, 1206, 1210, 1704, 1753, 1761, 1763, 1767, 1785, 1796, 1798, 1802, 1817, 1828, 1838], "greatli": [1753, 1798, 1810, 1824, 1833, 1837, 1838, 1841], "green": [1738, 1748, 1750], "grep": [1743, 1785, 1786, 1788, 1802, 1828, 1844], "grid": [2, 18, 70, 94, 105, 110, 111, 138, 147, 291, 341, 637, 770, 967, 968, 969, 970, 1031, 1033, 1101, 1114, 1116, 1131, 1133, 1134, 1135, 1136, 1137, 1142, 1206, 1209, 1218, 1220, 1221, 1231, 1487, 1490, 1492, 1493, 1494, 1495, 1496, 1515, 1517, 1519, 1527, 1535, 1545, 1590, 1595, 1597, 1621, 1625, 1631, 1632, 1633, 1635, 1636, 1659, 1690, 1704, 1710, 1714, 1750, 1754, 1773, 1775, 1776, 1790, 1838, 1842], "grid_data": 110, "grid_esp": [111, 1799], "grid_field": [111, 1799], "grimm": [106, 267, 1225, 1256, 1704, 1714, 1715, 1734, 1738, 1756, 1757, 1767, 1777, 1780, 1781, 1837, 1842], "ground": [0, 314, 352, 679, 992, 1181, 1206, 1215, 1222, 1231, 1610, 1704, 1714, 1739, 1742, 1743, 1746, 1776, 1791, 1792, 1828, 1838, 1841, 1842, 1844], "group": [2, 17, 20, 91, 106, 120, 150, 265, 295, 390, 569, 574, 593, 616, 619, 660, 697, 698, 993, 1015, 1206, 1215, 1216, 1232, 1666, 1692, 1704, 1714, 1730, 1733, 1735, 1738, 1740, 1749, 1752, 1754, 1757, 1766, 1777, 1779, 1782, 1790, 1794, 1801, 1802, 1803, 1817, 1833, 1837, 1838, 1842, 1843], "groupbi": 389, "grow": 1833, "gtfock": [84, 721, 1166, 1207, 1221, 1231, 1609, 1704], "gtrsim": 1838, "guarante": [0, 84, 292, 343, 344, 609, 647, 1206, 1704, 1738, 1753, 1757, 1781, 1821, 1837], "guess": [0, 1, 2, 84, 329, 335, 342, 356, 393, 407, 448, 457, 474, 476, 496, 498, 499, 500, 603, 638, 648, 660, 672, 706, 724, 731, 739, 742, 749, 757, 823, 830, 833, 834, 851, 881, 884, 1197, 1199, 1200, 1206, 1207, 1208, 1226, 1229, 1338, 1342, 1418, 1558, 1565, 1603, 1604, 1605, 1609, 1611, 1640, 1651, 1694, 1704, 1708, 1714, 1729, 1730, 1732, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1790, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1828, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1839, 1840, 1841, 1842, 1843, 1844], "guess_ca": 84, "guess_cb": 84, "guess_mix": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "guess_persist": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "guess_r_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "guess_vector": [0, 1, 2, 833, 861, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "guessbasi": 1809, "guessbasisdf": 1809, "guest": 1781, "gui": [1738, 1748, 1791], "guid": [279, 318, 319, 1736, 1737, 1738, 1748, 1767, 1800, 1817], "guidanc": [1738, 1770, 1781, 1788], "guidelin": [1757, 1785, 1801, 1821], "gwh": [1231, 1563, 1704, 1757, 1838], "gxx": 1738, "gxx_linux": 1738, "gyromag": 1706, "gz": [1759, 1788], "gzip": 1750, "h": [2, 11, 13, 16, 88, 100, 106, 148, 150, 295, 307, 426, 443, 444, 479, 482, 519, 521, 543, 545, 628, 811, 835, 837, 842, 873, 1126, 1198, 1199, 1200, 1202, 1203, 1206, 1210, 1221, 1226, 1326, 1668, 1669, 1690, 1704, 1706, 1707, 1708, 1714, 1730, 1731, 1733, 1734, 1738, 1740, 1743, 1746, 1747, 1748, 1749, 1750, 1753, 1754, 1755, 1756, 1757, 1759, 1762, 1763, 1764, 1766, 1767, 1768, 1770, 1771, 1772, 1773, 1775, 1776, 1781, 1782, 1783, 1784, 1785, 1786, 1789, 1792, 1793, 1794, 1795, 1798, 1802, 1803, 1805, 1810, 1823, 1828, 1829, 1832, 1833, 1836, 1837, 1838, 1839, 1841, 1842, 1843, 1844], "h0": [830, 833, 834, 1210, 1704], "h0_block": [830, 833, 1210, 1704], "h0_block_coupl": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "h0_block_coupling_s": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "h0_blocksiz": [0, 1, 2, 874, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "h0_guess_siz": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "h0block": [874, 1210, 1704], "h0block_inv": [874, 1210, 1704], "h1": [329, 356, 1730, 1833], "h1x": 329, "h2": [295, 329, 356, 1692, 1714, 1752, 1766, 1802, 1832, 1833, 1842], "h2_energi": 1832, "h2o": [2, 284, 288, 289, 295, 300, 301, 302, 318, 319, 339, 340, 381, 382, 1692, 1712, 1714, 1716, 1718, 1720, 1723, 1727, 1730, 1738, 1740, 1750, 1752, 1756, 1757, 1759, 1763, 1766, 1767, 1771, 1772, 1782, 1792, 1794, 1800, 1802, 1826, 1828, 1832, 1838, 1842, 1844], "h2o2": [1714, 1841, 1842], "h2o_shap": [1692, 1752], "h2o_siz": [1692, 1752], "h2x": 329, "h3": [1729, 1802], "h3o": [317, 365, 1799], "h4": 106, "h_": [1757, 1836, 1838], "h_0": [873, 1210, 1704], "h_1": [873, 1210, 1704], "h_approx_diag": 133, "h_bond_connect": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "h_corr": 1843, "h_ene": 1833, "h_energi": 1832, "h_guess_everi": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "h_label": 1833, "h_p": 1753, "h_update_den_tol": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "h_yne": 1833, "ha": [0, 2, 8, 84, 106, 110, 150, 208, 209, 210, 212, 235, 236, 265, 266, 267, 270, 276, 279, 280, 282, 284, 329, 332, 342, 356, 377, 381, 382, 399, 471, 568, 569, 574, 593, 603, 611, 612, 614, 632, 633, 634, 642, 643, 647, 652, 655, 656, 675, 694, 697, 703, 884, 1095, 1200, 1206, 1210, 1219, 1231, 1626, 1629, 1634, 1655, 1704, 1714, 1733, 1735, 1736, 1737, 1738, 1739, 1740, 1742, 1743, 1746, 1748, 1749, 1750, 1751, 1753, 1755, 1756, 1757, 1759, 1762, 1764, 1765, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1792, 1794, 1798, 1801, 1802, 1803, 1804, 1806, 1807, 1808, 1809, 1810, 1816, 1817, 1824, 1826, 1828, 1829, 1832, 1833, 1837, 1838, 1839, 1841, 1842, 1844], "hacki": 247, "had": [399, 1738, 1788, 1801, 1838], "hadz": 1733, "haettig": [0, 1734], "hald": 1734, "half": [90, 103, 322, 325, 377, 884, 1210, 1704, 1708, 1738, 1750, 1810, 1828, 1841, 1844], "half_tran": 90, "halftran": 90, "halkier": 1740, "halt": 1743, "hamiltionian": [284, 1740], "hamiltonian": [0, 13, 84, 163, 298, 342, 348, 356, 474, 477, 638, 639, 660, 718, 805, 811, 833, 836, 874, 1163, 1200, 1201, 1206, 1207, 1210, 1221, 1229, 1231, 1407, 1412, 1413, 1414, 1587, 1589, 1704, 1730, 1742, 1755, 1757, 1762, 1777, 1781, 1785, 1790, 1798, 1829, 1837, 1838, 1841], "hamiltonian_solv": 329, "hamiltoniansolv": 1841, "hampel": [443, 479, 519, 543, 1199, 1200, 1202, 1203, 1704], "hand": [2, 297, 347, 356, 699, 1206, 1704, 1708, 1743, 1750, 1757, 1769, 1770, 1776, 1788, 1817, 1821, 1824, 1838, 1841], "handi": [2, 1734, 1754, 1755, 1772, 1834], "handl": [2, 8, 88, 106, 118, 265, 283, 333, 342, 356, 430, 568, 627, 837, 858, 935, 961, 1199, 1206, 1213, 1232, 1666, 1704, 1708, 1714, 1735, 1736, 1740, 1742, 1743, 1748, 1755, 1767, 1768, 1780, 1782, 1785, 1788, 1789, 1794, 1803, 1804, 1805, 1809, 1810, 1812, 1817, 1823, 1824, 1833, 1837, 1841, 1842, 1843], "handler": [1714, 1738, 1757, 1842], "handshak": 370, "handwritten": 1817, "hansen": 1734, "haphazard": 1738, "happen": [2, 609, 861, 1206, 1210, 1704, 1738, 1755, 1770, 1786, 1801, 1833, 1837], "happi": 1738, "haqz": 1733, "har": [106, 1759, 1783, 1832], "hard": [607, 1206, 1231, 1598, 1660, 1704, 1747, 1767, 1821], "hardwar": [1231, 1620, 1704, 1738, 1763, 1838], "hargu": 1734, "harmless": 1738, "harmon": [8, 81, 103, 214, 300, 301, 302, 384, 399, 615, 617, 669, 691, 707, 763, 764, 766, 1206, 1209, 1704, 1730, 1754, 1761, 1777, 1781, 1801, 1810, 1817, 1828, 1831, 1838, 1840, 1844], "harmonic_analysi": [150, 384, 399], "harte": 1837, "hartre": [284, 295, 300, 301, 302, 306, 307, 318, 319, 442, 518, 542, 632, 676, 1199, 1202, 1203, 1206, 1230, 1231, 1473, 1474, 1663, 1690, 1695, 1697, 1698, 1700, 1703, 1704, 1706, 1740, 1743, 1744, 1745, 1749, 1753, 1754, 1755, 1757, 1758, 1766, 1769, 1770, 1771, 1772, 1776, 1777, 1778, 1790, 1800, 1803, 1810, 1823, 1832, 1836, 1837, 1843], "hartree2aj": 1706, "hartree2ev": 1706, "hartree2j": 1706, "hartree2kcalmol": [1706, 1828, 1832], "hartree2kjmol": 1706, "hartree2mhz": 1706, "hartree2wavenumb": 1706, "hartree_atomic_mass_unit_relationship": 1706, "hartree_electron_volt_relationship": 1706, "hartree_energi": 1706, "hartree_energy_in_ev": 1706, "hartree_hertz_relationship": 1706, "hartree_inverse_meter_relationship": 1706, "hartree_joule_relationship": 1706, "hartree_kelvin_relationship": 1706, "hartree_kilogram_relationship": 1706, "harvest": [1714, 1842], "has_array_vari": 150, "has_chang": [235, 236, 326, 327, 370, 1777, 1809, 1812], "has_ecp": 8, "has_global_option_chang": 1801, "has_local_option_chang": 1801, "has_option_chang": 1801, "has_potential_vari": 150, "has_puream": [8, 1801], "has_scalar_vari": 150, "has_vari": [150, 207, 211], "has_zmatrix": 106, "haser": [1734, 1838], "hash": [106, 1730, 1786, 1788], "hasn": [2, 882, 1210, 1704, 1743, 1786, 1788], "hat": [917, 1213, 1704, 1738, 1742, 1757, 1763, 1771, 1798, 1829, 1836, 1838], "hattig": 1734, "hatz": 1733, "have": [2, 106, 150, 171, 220, 230, 262, 263, 279, 284, 342, 356, 370, 399, 430, 574, 605, 609, 641, 671, 681, 692, 823, 827, 948, 1070, 1076, 1088, 1096, 1124, 1126, 1199, 1206, 1210, 1213, 1219, 1221, 1225, 1231, 1248, 1615, 1620, 1704, 1730, 1733, 1735, 1736, 1737, 1738, 1740, 1743, 1746, 1747, 1748, 1753, 1755, 1756, 1757, 1759, 1761, 1763, 1764, 1767, 1770, 1771, 1775, 1776, 1780, 1781, 1782, 1785, 1786, 1788, 1789, 1797, 1798, 1802, 1804, 1808, 1809, 1810, 1813, 1817, 1821, 1824, 1825, 1828, 1829, 1832, 1833, 1835, 1837, 1838, 1839, 1840, 1844], "hazard": [471, 1200, 1704], "hb": [1692, 1752], "hb6": [1692, 1752], "hbar": [368, 369, 377, 474, 483, 501, 1200, 1704, 1742], "hbc6": 1832, "hbc60": [1692, 1752], "hbc6a": [1692, 1752], "hbc6arlx": [1692, 1752], "hc": 1706, "hcch": [1692, 1752], "hcl": [1714, 1842], "hcn": [1714, 1715, 1842], "hcore": [90, 298, 348], "hcth": [295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "hcth120": [295, 318, 319, 1695, 1697, 1698, 1699, 1703, 1758, 1766, 1800], "hcth147": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "hcth407": [295, 318, 319, 1695, 1697, 1698, 1699, 1703, 1758, 1766, 1800], "hcth407p": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "hcth93": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "hcthh": [295, 318, 319, 1695, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "hcthp14": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "hcthp76": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "hd": [804, 1210, 1704], "hd_avg": [0, 1, 2, 861, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "hd_exact": [835, 1210, 1704], "hd_kave": [835, 1210, 1704], "hd_otf": [0, 1, 2, 861, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "hd_vector": 13, "hdf5": [1738, 1746], "hdfgroup": 1738, "he": [697, 1126, 1206, 1221, 1692, 1704, 1707, 1714, 1728, 1731, 1733, 1738, 1752, 1757, 1782, 1794, 1806, 1833, 1837, 1838, 1842], "he2": [1714, 1833, 1842], "head": [1734, 1747, 1748, 1757, 1759, 1771, 1786, 1788, 1798, 1806], "header": [2, 76, 147, 296, 298, 348, 1230, 1463, 1704, 1738, 1768, 1769, 1785, 1786, 1788, 1804, 1808, 1818, 1834, 1837], "headlin": 1788, "heal": 1786, "heap": 1742, "hear": [1692, 1738, 1752], "heart": 1743, "heavi": [1051, 1218, 1694, 1704, 1707, 1730, 1731, 1732, 1733, 1742, 1756, 1757, 1770, 1823, 1824, 1828, 1838, 1844], "heavier": [1230, 1445, 1704, 1837], "heavili": [295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1757, 1758, 1766, 1800], "heff4": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "heff_print": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "hefti": 1748, "hehe": [1692, 1752], "heid": [1734, 1802], "height": [282, 323, 332, 1692, 1750, 1752, 1835], "heisenberg": 1837, "hekr": [1692, 1752], "held": [433, 466, 507, 514, 580, 641, 842, 1199, 1200, 1201, 1202, 1206, 1210, 1225, 1242, 1704, 1742, 1837], "helfem": 1838, "helgak": [284, 810, 1210, 1692, 1704, 1734, 1740, 1741, 1743, 1752, 1802, 1832], "helion": 1706, "helion_electron_mass_ratio": 1706, "helion_g_factor": 1706, "helion_mag_mom": 1706, "helion_mag_mom_to_bohr_magneton_ratio": 1706, "helion_mag_mom_to_nuclear_magneton_ratio": 1706, "helion_mass": 1706, "helion_mass_energy_equival": 1706, "helion_mass_energy_equivalent_in_mev": 1706, "helion_mass_in_u": 1706, "helion_molar_mass": 1706, "helion_proton_mass_ratio": 1706, "helium": [628, 1206, 1692, 1704, 1714, 1728, 1752, 1757, 1794, 1806, 1833, 1838, 1842], "hellmann": 1798, "hello": 1799, "helmholtz": 1838, "helmholz": 1838, "help": [0, 2, 284, 433, 466, 471, 507, 514, 657, 671, 729, 842, 906, 1124, 1199, 1200, 1201, 1202, 1206, 1208, 1210, 1212, 1221, 1225, 1229, 1231, 1242, 1405, 1499, 1704, 1738, 1740, 1742, 1743, 1747, 1748, 1750, 1755, 1757, 1767, 1770, 1777, 1781, 1786, 1789, 1801, 1802, 1818, 1828, 1838, 1844], "helper": [73, 283, 333, 366, 379, 393, 1714, 1740, 1797, 1823, 1828, 1832, 1842], "helpmanu": 1738, "henc": [660, 679, 1206, 1704, 1748, 1755, 1757, 1794, 1798, 1821, 1828, 1829, 1837, 1844], "hene": [1692, 1752], "herbst": [0, 1734, 1777, 1780, 1781], "herbst2020": [0, 1734], "here": [2, 84, 267, 284, 285, 329, 336, 370, 381, 382, 608, 669, 993, 1124, 1206, 1215, 1221, 1226, 1231, 1324, 1633, 1704, 1708, 1714, 1730, 1737, 1738, 1740, 1741, 1742, 1743, 1746, 1749, 1752, 1753, 1756, 1757, 1759, 1764, 1767, 1770, 1774, 1781, 1782, 1785, 1786, 1788, 1792, 1797, 1801, 1802, 1803, 1808, 1809, 1810, 1816, 1823, 1826, 1828, 1833, 1837, 1838, 1842, 1844], "hereaft": [1738, 1785, 1798, 1833], "hermit": [100, 637, 1206, 1704, 1841], "hermitan": 342, "hermitian": [329, 335, 356, 1753, 1841], "hermitivit": 100, "hern": 1734, "hertz": 1706, "hertz_atomic_mass_unit_relationship": 1706, "hertz_electron_volt_relationship": 1706, "hertz_hartree_relationship": 1706, "hertz_inverse_meter_relationship": 1706, "hertz_joule_relationship": 1706, "hertz_kelvin_relationship": 1706, "hertz_kilogram_relationship": 1706, "hess": [386, 387, 399, 1026, 1122, 1217, 1221, 1704, 1713, 1714, 1777, 1780, 1785, 1836, 1842], "hess1": [1714, 1842], "hess2": [1714, 1842], "hess3": [1714, 1842], "hess4": [1714, 1842], "hess5": [1714, 1842], "hess_typ": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "hess_upd": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "hess_update_limit": [0, 1, 2, 1331, 1332, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "hess_update_limit_max": [0, 1, 2, 1332, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "hess_update_limit_scal": [0, 1, 2, 1331, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "hess_update_use_last": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "hesselmann": [1230, 1469, 1470, 1704, 1734, 1837], "hessian": [84, 103, 128, 147, 150, 242, 265, 267, 268, 300, 301, 302, 318, 319, 335, 378, 384, 386, 387, 389, 399, 571, 596, 603, 611, 635, 640, 652, 656, 666, 681, 706, 745, 756, 843, 926, 944, 946, 1026, 1170, 1206, 1208, 1210, 1213, 1217, 1221, 1225, 1279, 1281, 1300, 1323, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1338, 1342, 1685, 1690, 1704, 1708, 1714, 1718, 1725, 1738, 1739, 1740, 1742, 1752, 1753, 1754, 1756, 1757, 1771, 1776, 1777, 1781, 1785, 1789, 1790, 1791, 1794, 1796, 1798, 1800, 1803, 1828, 1831, 1832, 1838, 1840, 1841, 1842, 1844], "hessian_": 150, "hessian_body_dict": 1794, "hessian_with": [318, 319, 1800], "hessian_writ": [0, 1, 2, 307, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "heurist": [0, 1757, 1759], "hexachlorocyclohexan": 1833, "hexadecapol": [1685, 1776], "hf": [2, 14, 76, 92, 106, 128, 130, 138, 145, 150, 241, 242, 262, 267, 284, 295, 300, 301, 302, 314, 317, 318, 319, 365, 381, 382, 394, 597, 658, 660, 664, 684, 926, 1045, 1206, 1213, 1218, 1467, 1670, 1679, 1689, 1690, 1692, 1695, 1697, 1698, 1700, 1702, 1703, 1704, 1707, 1710, 1711, 1714, 1718, 1724, 1730, 1731, 1735, 1738, 1739, 1740, 1743, 1744, 1745, 1752, 1757, 1758, 1759, 1763, 1766, 1767, 1768, 1770, 1772, 1774, 1776, 1777, 1781, 1790, 1791, 1798, 1799, 1800, 1802, 1826, 1827, 1828, 1836, 1837, 1841, 1842, 1844], "hf3c": [106, 295, 318, 319, 1695, 1698, 1700, 1703, 1718, 1758, 1766, 1774, 1800], "hf_guess": 1768, "hg": [1707, 1731], "hhff": 1768, "hi": 1804, "hidden": [1736, 1743, 1767, 1838], "hide": 1738, "hierarch": 1813, "hierarchi": 1767, "high": [2, 20, 265, 285, 287, 336, 338, 697, 1206, 1692, 1704, 1710, 1734, 1736, 1740, 1742, 1748, 1752, 1753, 1754, 1755, 1757, 1767, 1781, 1788, 1794, 1810, 1829, 1837, 1838], "high_mem": [951, 1213, 1704], "higher": [20, 265, 471, 596, 644, 795, 1153, 1200, 1206, 1210, 1221, 1226, 1228, 1230, 1305, 1380, 1455, 1480, 1704, 1738, 1739, 1740, 1742, 1749, 1754, 1756, 1776, 1781, 1790, 1794, 1799, 1802, 1809, 1810, 1817, 1829, 1832, 1838], "highest": [2, 106, 150, 285, 300, 301, 302, 336, 386, 489, 671, 696, 1126, 1200, 1206, 1221, 1704, 1740, 1750, 1755, 1761, 1772, 1783, 1809, 1833], "highest_1": [284, 1740, 1741, 1743], "highli": [726, 1208, 1704, 1714, 1734, 1753, 1754, 1755, 1757, 1763, 1781, 1810, 1829, 1837, 1838, 1842], "highlight": [0, 1736, 1767, 1814, 1817, 1828, 1838], "hik": 1730, "him": 1775, "hint": [1738, 1746, 1749, 1762, 1765, 1768, 1773, 1775, 1782, 1783, 1784, 1803, 1806, 1807, 1839], "hirata": [1734, 1755], "hirshfeld": 1799, "histori": [767, 1209, 1226, 1353, 1372, 1373, 1704, 1738, 1754, 1786, 1802, 1804], "hit": [1737, 1738, 1838], "hj": [295, 1695, 1697, 1698, 1700, 1701, 1757, 1758, 1766], "hlsearch": 1738, "hnc": [1714, 1842], "ho2": [1713, 1714, 1842], "hobza": [1692, 1752, 1832], "hod": [574, 1206, 1704], "hof": [1714, 1842], "hoffmann": 1734, "hoh": 1802, "hohenberg": [1734, 1757], "hohenstein": [1692, 1734, 1752, 1770, 1781, 1786, 1828, 1837, 1844], "hold": [106, 274, 275, 284, 321, 329, 388, 888, 1210, 1704, 1708, 1714, 1740, 1741, 1759, 1817, 1837, 1838, 1842, 1844], "hold_met": 27, "hole": [794, 795, 859, 860, 875, 890, 1210, 1704, 1755, 1757, 1805, 1829], "holger": 1760, "holst": 1734, "home": [323, 1748, 1767, 1788, 1828, 1832], "homebrew": [1736, 1750, 1767], "homo": [476, 671, 896, 1200, 1206, 1211, 1231, 1564, 1704, 1713, 1714, 1750, 1757, 1768, 1837, 1838, 1842], "homo_occ": 1768, "homogen": 325, "honestli": 1822, "hooh": [1714, 1802, 1842], "hook": [1777, 1808, 1814], "hopefulli": [1788, 1844], "host": [1738, 1767], "houck": [1734, 1805, 1806], "hover": 1788, "how": [2, 106, 138, 265, 321, 377, 389, 659, 700, 728, 786, 813, 835, 837, 846, 993, 1125, 1154, 1206, 1208, 1210, 1215, 1221, 1225, 1229, 1230, 1231, 1296, 1417, 1472, 1556, 1704, 1714, 1736, 1740, 1742, 1755, 1756, 1767, 1770, 1771, 1777, 1780, 1781, 1787, 1788, 1794, 1798, 1801, 1802, 1804, 1812, 1813, 1814, 1815, 1817, 1819, 1824, 1828, 1829, 1831, 1833, 1837, 1842, 1844], "howev": [0, 342, 575, 577, 609, 680, 706, 727, 827, 921, 922, 1206, 1208, 1210, 1213, 1704, 1730, 1738, 1739, 1742, 1748, 1753, 1755, 1756, 1757, 1770, 1771, 1789, 1797, 1798, 1799, 1802, 1817, 1824, 1829, 1832, 1833, 1837, 1838, 1841, 1843, 1844], "hp": [575, 1206, 1704], "hpbeint": [295, 318, 319, 1695, 1698, 1700, 1703, 1758, 1766, 1800], "hpp": 1765, "hse": 1757, "hse03": [295, 1695, 1697, 1698, 1700, 1701, 1758, 1766], "hse06": [295, 1695, 1697, 1698, 1700, 1701, 1758, 1766], "hsg": [1714, 1832, 1842], "hsg0": [1692, 1752], "hsga": [1692, 1752], "htbh": 1832, "htm": [2, 285, 296, 336, 1692, 1752, 1769], "html": [2, 287, 338, 373, 388, 391, 993, 1215, 1704, 1737, 1738, 1746, 1748, 1764, 1788, 1828], "http": [0, 2, 106, 285, 287, 296, 297, 308, 336, 338, 347, 372, 377, 388, 561, 993, 1204, 1215, 1692, 1704, 1714, 1717, 1734, 1735, 1737, 1738, 1740, 1743, 1746, 1748, 1750, 1751, 1752, 1759, 1761, 1764, 1768, 1769, 1774, 1776, 1781, 1782, 1784, 1785, 1786, 1788, 1791, 1792, 1805, 1806, 1821, 1822, 1828, 1833, 1837, 1839, 1842], "hu": 1792, "hub": 1788, "huckel": [1231, 1563, 1704, 1838], "huge": [811, 1210, 1704, 1755], "hugo": 1788, "hujo": [1734, 1759], "human": [266, 268, 269, 270, 276, 277, 278, 280], "hundredth": 1838, "hungari": [586, 1206, 1704], "hungarian": 106, "hurdl": 1838, "hurt": 1786, "hwen": [615, 1206, 1704], "hx": [295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "hx_function": 335, "hyb": [295, 318, 319, 1695, 1697, 1698, 1700, 1701, 1702, 1703, 1758, 1766, 1800], "hybrid": [295, 318, 319, 400, 957, 1213, 1225, 1230, 1231, 1289, 1468, 1513, 1690, 1695, 1697, 1698, 1701, 1702, 1703, 1704, 1714, 1718, 1734, 1739, 1757, 1766, 1770, 1776, 1781, 1797, 1798, 1800, 1834, 1837, 1838, 1842], "hybrid_superfunc": [1714, 1718, 1842], "hydrogen": [106, 628, 1206, 1692, 1704, 1714, 1730, 1752, 1770, 1781, 1785, 1802, 1828, 1833, 1842, 1844], "hydronium": [1714, 1842], "hydroxyl": [1710, 1714, 1770, 1842], "hylleraa": [1734, 1763], "hypercontract": 94, "hyperlink": [1764, 1801], "hyperpol": [669, 1206, 1704], "hyperpolariz": [669, 1206, 1704, 1706], "hyphen": 2, "hz": [550, 1203, 1704, 1706, 1742], "h\u00fcckel": [781, 1209, 1704, 1754], "i": [0, 1, 2, 5, 8, 11, 13, 15, 16, 17, 18, 61, 64, 81, 84, 86, 87, 91, 100, 103, 106, 110, 111, 115, 138, 139, 143, 144, 148, 150, 188, 195, 197, 200, 207, 208, 209, 210, 211, 213, 219, 235, 236, 241, 242, 247, 255, 265, 279, 282, 284, 285, 286, 287, 288, 289, 295, 296, 297, 300, 301, 302, 303, 308, 314, 318, 319, 322, 325, 326, 329, 331, 332, 335, 336, 337, 338, 339, 340, 342, 344, 347, 355, 356, 368, 369, 370, 373, 374, 377, 380, 383, 384, 390, 391, 393, 395, 399, 401, 404, 406, 407, 430, 432, 433, 434, 445, 466, 474, 476, 496, 507, 514, 539, 550, 568, 569, 570, 571, 572, 573, 574, 575, 577, 580, 582, 584, 586, 592, 593, 596, 597, 598, 599, 601, 603, 606, 608, 609, 614, 616, 621, 623, 627, 628, 632, 634, 635, 638, 639, 640, 641, 642, 644, 645, 647, 648, 650, 652, 655, 656, 658, 660, 661, 662, 664, 665, 666, 669, 670, 671, 672, 677, 678, 679, 680, 681, 683, 684, 685, 687, 688, 691, 694, 696, 697, 698, 699, 701, 702, 703, 704, 706, 707, 708, 726, 727, 729, 746, 752, 755, 764, 765, 772, 773, 778, 781, 786, 792, 794, 795, 799, 808, 811, 813, 819, 823, 829, 833, 836, 837, 838, 842, 852, 859, 860, 861, 874, 875, 876, 882, 884, 890, 893, 894, 901, 921, 922, 930, 934, 949, 958, 978, 980, 981, 982, 983, 985, 992, 1001, 1013, 1015, 1018, 1025, 1026, 1027, 1070, 1076, 1079, 1084, 1085, 1086, 1088, 1095, 1096, 1101, 1109, 1124, 1125, 1126, 1129, 1147, 1158, 1171, 1172, 1181, 1197, 1199, 1200, 1201, 1202, 1203, 1206, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1219, 1220, 1221, 1222, 1224, 1225, 1226, 1228, 1229, 1230, 1231, 1232, 1235, 1236, 1238, 1239, 1240, 1241, 1242, 1266, 1290, 1293, 1299, 1303, 1312, 1313, 1323, 1324, 1326, 1327, 1331, 1332, 1341, 1352, 1362, 1383, 1405, 1409, 1412, 1417, 1426, 1434, 1435, 1436, 1441, 1453, 1455, 1472, 1480, 1490, 1498, 1500, 1506, 1508, 1532, 1564, 1578, 1619, 1626, 1629, 1633, 1634, 1649, 1655, 1658, 1665, 1666, 1667, 1668, 1669, 1690, 1692, 1704, 1707, 1708, 1710, 1711, 1713, 1714, 1726, 1730, 1731, 1734, 1735, 1736, 1740, 1741, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1783, 1784, 1785, 1787, 1788, 1789, 1790, 1791, 1792, 1794, 1795, 1796, 1797, 1799, 1800, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1812, 1813, 1814, 1817, 1821, 1823, 1824, 1825, 1829, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "i3": [614, 1206, 1704], "i7": 1771, "i_": 1757, "ia": [961, 1213, 1229, 1417, 1704, 1708, 1756, 1763, 1838, 1841], "iajb": 1763, "iat": 1833, "ib": 1756, "ibm": [575, 1206, 1704], "ibo": [1036, 1055, 1056, 1057, 1058, 1059, 1061, 1063, 1218, 1704, 1770], "ibo2": 76, "ic": [1225, 1296, 1704, 1708, 1798], "icc": [1738, 1748], "ichino": [655, 1206, 1704], "icor": [0, 1, 2, 787, 884, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "icosohedr": 1757, "icpc": [1738, 1748], "icpx": 1738, "id": [86, 115, 150, 265, 1740, 1750, 1767, 1786, 1788, 1794, 1822, 1833], "idea": [1738, 1748, 1755, 1757, 1767, 1781, 1797, 1824], "ideal": [386, 1706, 1786, 1838], "idempot": [84, 106, 213, 1753, 1838], "ident": [100, 106, 591, 609, 649, 663, 811, 1093, 1206, 1210, 1219, 1704, 1711, 1714, 1733, 1752, 1755, 1756, 1757, 1759, 1770, 1771, 1785, 1797, 1809, 1838, 1842, 1844], "identif": [1756, 1808], "identifi": [2, 98, 115, 367, 1743, 1750, 1833, 1838], "idfmo": 30, "ie": [87, 1714, 1743, 1750, 1776, 1782, 1794, 1842], "iec": 1832, "iefpcm": 1803, "ifdef": 1785, "ifort": [1738, 1748], "ignacio": 1734, "ignor": [61, 342, 446, 484, 539, 702, 772, 773, 778, 781, 795, 1199, 1200, 1203, 1206, 1209, 1210, 1226, 1327, 1362, 1704, 1742, 1750, 1754, 1757, 1785, 1788, 1814, 1819, 1828, 1833], "iho": [1037, 1047, 1218, 1704, 1770], "ii": [794, 795, 859, 890, 1210, 1229, 1417, 1704, 1711, 1714, 1755, 1757, 1763, 1771, 1778, 1786, 1805, 1810, 1838, 1842], "iii": [532, 555, 782, 785, 789, 790, 796, 797, 859, 875, 877, 878, 1202, 1203, 1210, 1704, 1734, 1755, 1778, 1781, 1782, 1786, 1810], "iint_": [1757, 1838], "iirc": 1788, "ij": [377, 433, 466, 507, 514, 641, 1199, 1200, 1201, 1202, 1206, 1225, 1242, 1704, 1708, 1742, 1755, 1756, 1759, 1763, 1771, 1829, 1838], "ij_canon": [665, 1206, 1704], "ijk": 1755, "ijkl": [574, 1206, 1704], "ijqc": [1714, 1810, 1842], "ik": [1763, 1771], "ill": [1230, 1480, 1704, 1837], "illustr": [671, 1206, 1704, 1714, 1743, 1770, 1789, 1838, 1841, 1842], "im": 377, "imag": [87, 106, 386, 1738, 1750, 1761, 1764, 1770, 1772, 1785, 1787], "imageh": 1750, "imagemagick": 1750, "images": 1750, "imagew": 1750, "imagin": 1770, "imaginari": [385, 386, 388, 987, 1215, 1704, 1746, 1772], "imit": [1738, 1743, 1785], "immateri": 1748, "immedi": [1738, 1759, 1774, 1776, 1786, 1801], "immin": 1786, "imo": 30, "impact": [284, 1740, 1761], "imped": 1706, "implement": [0, 2, 268, 284, 329, 351, 356, 368, 369, 370, 381, 382, 430, 568, 574, 576, 603, 641, 676, 690, 692, 697, 1199, 1206, 1226, 1231, 1352, 1626, 1692, 1704, 1714, 1718, 1730, 1734, 1740, 1742, 1743, 1750, 1752, 1754, 1756, 1757, 1763, 1768, 1770, 1771, 1774, 1775, 1776, 1777, 1780, 1781, 1789, 1790, 1798, 1805, 1806, 1810, 1817, 1821, 1824, 1826, 1836, 1837, 1838, 1839, 1840, 1841, 1842], "impli": [1738, 1743, 1770, 1781, 1782, 1794, 1829, 1837, 1838], "implicit": [1738, 1743, 1757, 1781, 1803], "implicitli": [592, 1206, 1704, 1757, 1770], "implict": 1754, "import": [0, 2, 213, 272, 358, 380, 452, 487, 525, 549, 573, 609, 681, 802, 868, 869, 1199, 1200, 1202, 1203, 1206, 1210, 1230, 1445, 1704, 1714, 1730, 1738, 1742, 1747, 1750, 1752, 1753, 1754, 1755, 1757, 1759, 1767, 1768, 1785, 1787, 1788, 1790, 1797, 1801, 1808, 1812, 1817, 1824, 1828, 1832, 1834, 1836, 1837, 1838, 1841, 1842, 1843, 1844], "importantli": 1828, "importerror": 1828, "impos": [106, 1743, 1753, 1777, 1814, 1837], "imposs": [1799, 1821], "improperli": 170, "improv": [430, 470, 738, 1199, 1200, 1208, 1704, 1734, 1742, 1755, 1768, 1781, 1785, 1802, 1806, 1810, 1817, 1821, 1824, 1837, 1838], "inabl": 1757, "inaccur": 1757, "inact": [106, 150, 314, 1172, 1222, 1704, 1743, 1789, 1791, 1794, 1802], "inc": 352, "incept": 1757, "incfock": [0, 1, 2, 1568, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "incfock_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "incfock_full_fock_everi": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "incid": [550, 1203, 1704, 1742], "inclin": [697, 1206, 1704], "includ": [2, 106, 150, 159, 284, 285, 287, 295, 297, 314, 318, 319, 336, 338, 347, 367, 378, 388, 470, 476, 616, 636, 665, 667, 677, 699, 745, 795, 833, 978, 979, 980, 982, 983, 1012, 1014, 1016, 1017, 1019, 1020, 1112, 1126, 1200, 1206, 1208, 1210, 1214, 1216, 1221, 1224, 1229, 1231, 1235, 1403, 1404, 1406, 1413, 1420, 1658, 1673, 1704, 1730, 1733, 1735, 1738, 1740, 1742, 1743, 1746, 1748, 1750, 1752, 1753, 1755, 1756, 1757, 1762, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1773, 1775, 1776, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1794, 1800, 1802, 1803, 1808, 1809, 1810, 1817, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1841], "include_deprecated_kei": [150, 263], "include_perturb": 103, "include_pure_transform": 103, "inclus": [601, 662, 699, 1206, 1231, 1658, 1704, 1742, 1749, 1802, 1803, 1805, 1841], "incompat": [1231, 1626, 1634, 1704], "incomplet": [1786, 1837], "inconsist": [150, 1770], "inconveni": 1767, "incor": [961, 1213, 1231, 1620, 1626, 1704, 1838], "incorpor": [284, 1730, 1733, 1740, 1757, 1759, 1767, 1776, 1798, 1819], "incorrect": [314, 1757, 1791, 1838], "incorrectli": 1797, "increas": [0, 699, 1206, 1226, 1341, 1704, 1750, 1753, 1754, 1756, 1757, 1763, 1796, 1802, 1817, 1828, 1838, 1844], "incredibli": 1781, "increment": [18, 66, 100, 1231, 1555, 1566, 1567, 1568, 1704, 1714, 1768, 1788, 1802, 1838, 1842], "incur": [1743, 1757, 1770, 1817], "ind": [76, 1029, 1218, 1230, 1442, 1678, 1679, 1689, 1704, 1714, 1776, 1837, 1842], "ind20": [1679, 1689, 1776, 1837], "ind22": [1689, 1776, 1837], "ind30": [1689, 1714, 1776, 1837, 1842], "indab": 1770, "indba": 1770, "indc": [1714, 1842], "inde": [2, 1755, 1841], "indent": [1757, 1833, 1844], "indep": 1738, "independ": [106, 168, 170, 329, 370, 539, 721, 1203, 1207, 1704, 1714, 1738, 1742, 1753, 1757, 1759, 1768, 1770, 1774, 1785, 1788, 1795, 1802, 1808, 1824, 1838, 1840, 1842], "index": [3, 5, 11, 13, 15, 17, 75, 81, 84, 91, 95, 98, 106, 134, 140, 183, 184, 368, 369, 384, 430, 433, 466, 507, 514, 603, 635, 641, 652, 902, 954, 1096, 1199, 1200, 1201, 1202, 1206, 1212, 1213, 1219, 1225, 1230, 1242, 1455, 1481, 1704, 1708, 1726, 1738, 1742, 1750, 1752, 1753, 1756, 1763, 1764, 1768, 1771, 1775, 1776, 1777, 1786, 1788, 1794, 1795, 1802, 1810, 1832, 1837, 1838, 1844], "indic": [0, 8, 21, 106, 284, 295, 300, 301, 302, 318, 319, 335, 381, 382, 384, 433, 466, 507, 514, 627, 793, 795, 829, 1108, 1111, 1199, 1200, 1201, 1202, 1206, 1210, 1221, 1225, 1231, 1242, 1559, 1562, 1579, 1581, 1685, 1704, 1730, 1733, 1740, 1742, 1743, 1746, 1750, 1752, 1753, 1766, 1767, 1770, 1771, 1772, 1775, 1776, 1777, 1785, 1792, 1794, 1799, 1800, 1802, 1806, 1817, 1826, 1828, 1834, 1837, 1844], "indigo": [575, 1206, 1704], "indinavir": [1692, 1752], "indirect": [614, 669, 690, 1206, 1704], "indirectli": [1226, 1341, 1704], "individu": [2, 329, 601, 683, 1206, 1704, 1714, 1740, 1750, 1752, 1759, 1767, 1770, 1788, 1794, 1810, 1817, 1824, 1832, 1837, 1838, 1842, 1844], "induc": [1228, 1385, 1387, 1389, 1391, 1704, 1749], "induced_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "induct": [76, 103, 1045, 1218, 1230, 1441, 1449, 1450, 1465, 1466, 1704, 1714, 1734, 1770, 1776, 1781, 1837, 1842], "induction_oper": 103, "industri": 1757, "ineffect": [1743, 1832], "ineffici": [837, 1210, 1704, 1738, 1739, 1755, 1781], "inequ": 1838, "inerti": 1743, "inertia_tensor": 106, "inevit": [1802, 1824], "inf": [1679, 1689, 1714, 1776, 1842], "infer": [1755, 1838], "inferior": [284, 1740], "infil": 1788, "infiles_with_cont": 1788, "infin": 1837, "infinit": [377, 1843], "influenc": [106, 284, 1232, 1666, 1692, 1704, 1740, 1752, 1754, 1759, 1767, 1774, 1843], "info": [8, 106, 318, 319, 327, 342, 356, 370, 374, 395, 844, 1210, 1704, 1708, 1714, 1738, 1748, 1759, 1767, 1768, 1772, 1774, 1785, 1786, 1788, 1800, 1808, 1810, 1842], "inform": [1, 2, 8, 74, 81, 100, 104, 105, 106, 115, 120, 138, 148, 150, 262, 263, 296, 303, 310, 314, 331, 350, 351, 361, 370, 371, 394, 399, 498, 569, 593, 644, 667, 716, 720, 838, 1021, 1118, 1153, 1200, 1206, 1207, 1210, 1216, 1221, 1230, 1231, 1463, 1608, 1692, 1704, 1730, 1738, 1742, 1743, 1750, 1752, 1755, 1757, 1759, 1764, 1767, 1769, 1772, 1775, 1781, 1786, 1791, 1797, 1801, 1802, 1804, 1808, 1809, 1810, 1817, 1821, 1828, 1833, 1837, 1838, 1841, 1843, 1844], "infrar": [386, 707, 1206, 1704], "infrastructur": [1714, 1726, 1737, 1823, 1841, 1842], "infrequ": 1764, "infti": [1042, 1218, 1704, 1740, 1757, 1837], "ing": [1735, 1738], "inherit": [150, 329, 1768], "inherit_loglevel": 1768, "inhomegen": 322, "inhomogen": 1757, "ini": 2, "init": [64, 84, 88, 148, 1808, 1810], "init_arrai": 1810, "init_io_fil": 12, "init_with_xyz": 1833, "initi": [27, 64, 68, 84, 90, 92, 106, 138, 147, 267, 308, 328, 342, 356, 457, 471, 589, 635, 638, 648, 652, 660, 706, 834, 851, 870, 1199, 1200, 1206, 1210, 1226, 1231, 1323, 1343, 1361, 1494, 1496, 1563, 1615, 1616, 1617, 1704, 1714, 1737, 1738, 1742, 1748, 1752, 1753, 1759, 1763, 1776, 1781, 1787, 1790, 1794, 1798, 1802, 1808, 1817, 1819, 1821, 1828, 1832, 1833, 1837, 1841, 1842, 1844], "initialize_gtfock_jk": 84, "initialize_jk": 84, "initialized_diis_manager_": 84, "initio": [1, 1734, 1753, 1756, 1777, 1781, 1786, 1790, 1838], "inlin": [2, 1764], "innard": [1824, 1827], "inner": [625, 1206, 1704, 1794], "innermost": 1838, "inop": [444, 482, 1199, 1200, 1704], "inplac": [1738, 1767], "inpsight": 1827, "input": [0, 26, 70, 92, 106, 150, 216, 265, 280, 285, 286, 287, 295, 318, 319, 336, 337, 338, 350, 351, 359, 375, 376, 378, 380, 383, 384, 390, 396, 397, 400, 474, 570, 577, 592, 609, 614, 621, 642, 643, 650, 651, 660, 669, 671, 696, 705, 823, 897, 1000, 1043, 1046, 1052, 1109, 1125, 1126, 1130, 1200, 1206, 1210, 1211, 1215, 1218, 1221, 1227, 1230, 1377, 1472, 1704, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1735, 1738, 1740, 1742, 1743, 1746, 1749, 1750, 1752, 1754, 1759, 1761, 1763, 1764, 1766, 1767, 1768, 1770, 1771, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1785, 1788, 1789, 1790, 1792, 1794, 1798, 1799, 1800, 1801, 1802, 1803, 1808, 1810, 1824, 1829, 1831, 1833, 1834, 1836, 1837, 1840], "input_str": 330, "input_units_to_au": [106, 1768], "inputdat": 1788, "inputdatloc": 1788, "inputpars": 1768, "inputv": [374, 395], "inquiri": 1781, "insensit": [150, 151, 174, 175, 176, 207, 211, 212, 238, 244, 254, 255, 262, 367, 374, 376, 377, 395, 397, 1743, 1752, 1795, 1796, 1810, 1828], "insert": [5, 106, 111, 1753, 1767, 1786, 1801, 1828, 1833], "insid": [0, 106, 760, 768, 1209, 1704, 1754, 1756, 1770, 1781, 1828], "insight": [1763, 1770, 1828, 1844], "insist": 2, "inspect": [1743, 1788, 1802], "instabl": [681, 1206, 1231, 1638, 1639, 1640, 1641, 1642, 1649, 1704, 1734, 1757, 1798, 1838], "instal": [2, 561, 1204, 1704, 1714, 1715, 1730, 1747, 1750, 1757, 1777, 1780, 1781, 1785, 1788, 1808, 1814, 1828, 1838, 1842, 1844], "installationtyp": 1748, "instanc": [8, 18, 64, 68, 87, 100, 106, 147, 148, 150, 267, 350, 378, 1714, 1743, 1759, 1764, 1767, 1779, 1810, 1828, 1832, 1833, 1838, 1842], "instanti": [106, 1774, 1794], "instead": [2, 100, 106, 150, 192, 193, 203, 204, 274, 300, 301, 302, 318, 319, 375, 396, 577, 611, 632, 633, 634, 652, 656, 672, 691, 946, 994, 1206, 1213, 1215, 1225, 1226, 1231, 1254, 1255, 1281, 1296, 1300, 1337, 1549, 1588, 1610, 1695, 1697, 1700, 1701, 1702, 1704, 1711, 1737, 1738, 1742, 1743, 1746, 1748, 1752, 1755, 1757, 1758, 1759, 1761, 1762, 1763, 1764, 1765, 1768, 1769, 1772, 1773, 1775, 1779, 1781, 1782, 1783, 1784, 1786, 1794, 1798, 1800, 1801, 1802, 1803, 1810, 1817, 1828, 1837, 1838, 1839, 1843, 1844], "instruct": [111, 1002, 1005, 1006, 1007, 1008, 1009, 1215, 1704, 1730, 1737, 1738, 1743, 1746, 1749, 1752, 1759, 1762, 1765, 1767, 1773, 1774, 1775, 1782, 1783, 1784, 1785, 1788, 1792, 1801, 1803, 1806, 1807, 1813, 1817, 1820, 1828, 1829, 1833, 1837, 1839, 1840, 1844], "insuffici": [2, 1714, 1753, 1757, 1837, 1842], "insul": 1757, "int": [2, 5, 7, 8, 9, 11, 12, 13, 14, 15, 16, 17, 18, 20, 21, 22, 23, 24, 25, 26, 27, 29, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 64, 75, 80, 81, 84, 85, 86, 87, 88, 89, 90, 91, 92, 96, 98, 100, 103, 105, 106, 110, 111, 112, 114, 115, 119, 120, 128, 130, 131, 133, 138, 139, 141, 143, 144, 145, 147, 148, 150, 154, 155, 156, 157, 158, 183, 184, 187, 198, 199, 225, 246, 248, 250, 251, 266, 270, 276, 277, 282, 285, 287, 288, 289, 299, 300, 301, 302, 305, 309, 310, 313, 321, 329, 332, 335, 336, 338, 339, 340, 342, 346, 349, 353, 354, 356, 360, 361, 364, 374, 376, 377, 380, 383, 384, 386, 389, 390, 395, 397, 399, 1224, 1237, 1704, 1708, 1734, 1740, 1759, 1763, 1767, 1768, 1772, 1774, 1785, 1794, 1801, 1810, 1821, 1832, 1837], "int_": 1757, "int_0": 1837, "int_ptr": 1817, "intco": 1708, "intcos_generate_exit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "intdump": [187, 294, 297, 345, 347], "integ": [0, 1, 2, 64, 88, 114, 246, 248, 268, 374, 389, 395, 404, 405, 406, 407, 412, 413, 419, 420, 431, 433, 435, 447, 452, 466, 469, 476, 485, 487, 489, 490, 502, 504, 505, 507, 514, 524, 525, 527, 528, 537, 548, 549, 558, 564, 569, 572, 578, 580, 582, 583, 585, 587, 588, 591, 593, 594, 595, 603, 606, 607, 611, 612, 614, 618, 620, 622, 632, 633, 634, 644, 645, 646, 649, 651, 654, 659, 660, 661, 663, 667, 681, 684, 685, 686, 687, 689, 690, 700, 704, 709, 710, 711, 712, 716, 720, 723, 724, 728, 734, 735, 741, 751, 755, 756, 757, 760, 763, 764, 766, 768, 770, 775, 776, 782, 785, 789, 790, 791, 793, 796, 797, 798, 800, 804, 805, 806, 808, 813, 814, 815, 816, 820, 826, 828, 832, 833, 834, 837, 840, 842, 846, 847, 848, 853, 862, 868, 869, 870, 871, 877, 878, 879, 881, 890, 894, 895, 896, 901, 906, 911, 912, 914, 918, 927, 931, 932, 950, 966, 969, 970, 974, 992, 993, 997, 1003, 1021, 1028, 1031, 1056, 1060, 1062, 1066, 1077, 1080, 1097, 1104, 1114, 1118, 1122, 1126, 1134, 1136, 1138, 1139, 1141, 1143, 1144, 1148, 1149, 1153, 1176, 1180, 1181, 1185, 1189, 1190, 1191, 1193, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1224, 1225, 1226, 1228, 1229, 1230, 1231, 1232, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1249, 1250, 1251, 1263, 1267, 1286, 1302, 1305, 1323, 1325, 1333, 1347, 1363, 1379, 1380, 1391, 1395, 1397, 1400, 1401, 1408, 1409, 1412, 1416, 1425, 1426, 1439, 1456, 1457, 1458, 1463, 1477, 1490, 1493, 1494, 1495, 1496, 1508, 1515, 1517, 1533, 1536, 1542, 1544, 1547, 1548, 1550, 1561, 1568, 1574, 1575, 1576, 1577, 1580, 1590, 1592, 1597, 1607, 1608, 1625, 1632, 1635, 1636, 1639, 1640, 1641, 1645, 1646, 1652, 1653, 1655, 1659, 1661, 1666, 1704, 1714, 1740, 1742, 1743, 1746, 1749, 1750, 1754, 1755, 1757, 1762, 1771, 1775, 1776, 1789, 1794, 1795, 1798, 1801, 1802, 1810, 1817, 1828, 1833, 1835, 1837, 1838, 1841, 1842, 1843, 1844], "integerword": [650, 1206, 1704], "integr": [1, 2, 4, 13, 65, 69, 71, 72, 76, 84, 89, 90, 93, 94, 98, 103, 107, 109, 110, 112, 115, 116, 121, 127, 141, 142, 143, 144, 150, 158, 166, 187, 286, 294, 295, 297, 298, 310, 329, 337, 345, 347, 348, 361, 430, 433, 466, 507, 514, 559, 568, 575, 590, 623, 637, 641, 643, 657, 660, 668, 682, 693, 708, 710, 727, 775, 776, 838, 858, 901, 927, 954, 961, 1096, 1129, 1167, 1199, 1200, 1201, 1202, 1204, 1206, 1208, 1209, 1210, 1212, 1213, 1219, 1221, 1223, 1225, 1230, 1231, 1242, 1436, 1455, 1459, 1461, 1464, 1465, 1466, 1476, 1477, 1481, 1489, 1508, 1510, 1542, 1543, 1544, 1590, 1597, 1626, 1627, 1629, 1634, 1659, 1704, 1708, 1714, 1727, 1734, 1736, 1739, 1742, 1743, 1747, 1753, 1756, 1757, 1763, 1765, 1766, 1767, 1771, 1776, 1777, 1780, 1783, 1787, 1789, 1790, 1798, 1808, 1809, 1814, 1818, 1819, 1832, 1836, 1837, 1839, 1841, 1842], "integral_cutoff": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "integral_packag": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "integralfactori": [103, 115, 1817, 1827], "integrals_erf": 103, "integrals_erfc": 103, "integraltransform": 1827, "integratorxx": [186, 1738], "intel": [1737, 1738, 1748, 1767, 1771, 1781, 1788, 1839], "intel64": 1738, "intend": [300, 301, 302, 318, 319, 329, 586, 1206, 1704, 1714, 1738, 1743, 1752, 1763, 1772, 1774, 1800, 1801, 1834, 1835, 1842], "intens": [386, 574, 673, 674, 679, 707, 1206, 1704, 1753, 1785, 1840, 1841], "intent": [1743, 1801], "intention": 329, "inter": [76, 147, 763, 1209, 1704, 1754], "interact": [73, 76, 177, 295, 381, 382, 574, 662, 764, 981, 985, 1048, 1206, 1209, 1210, 1214, 1218, 1230, 1673, 1689, 1692, 1704, 1714, 1730, 1733, 1734, 1742, 1743, 1746, 1750, 1752, 1754, 1757, 1759, 1761, 1763, 1766, 1770, 1776, 1777, 1778, 1779, 1782, 1786, 1790, 1794, 1798, 1801, 1802, 1805, 1806, 1809, 1826, 1829, 1831, 1832, 1833, 1835, 1836, 1837, 1838, 1842], "interatom": [106, 1226, 1303, 1341, 1704, 1759, 1776, 1802, 1828, 1844], "intercal": [300, 301, 302, 318, 319, 1714, 1752, 1772, 1777, 1781, 1796, 1800, 1831, 1840, 1842], "intercept": 2, "interchang": [106, 1738, 1755, 1759], "interconvers": [1714, 1842], "interest": [644, 1206, 1704, 1738, 1755, 1757, 1759, 1767, 1770, 1774, 1785, 1799, 1801, 1817, 1828, 1829, 1832, 1835, 1841, 1844], "interf": 1782, "interfac": [2, 106, 181, 284, 312, 577, 581, 586, 587, 592, 599, 601, 609, 611, 632, 633, 634, 650, 651, 652, 654, 656, 660, 676, 684, 685, 689, 691, 705, 1157, 1206, 1221, 1224, 1231, 1497, 1498, 1577, 1599, 1683, 1704, 1714, 1738, 1740, 1742, 1755, 1757, 1766, 1767, 1768, 1777, 1785, 1786, 1788, 1790, 1794, 1795, 1800, 1804, 1810, 1817, 1819, 1836, 1838, 1842], "interface_cfour": 1743, "interfacelib": 1738, "interfer": [1748, 1767, 1786], "interfrag": [1226, 1313, 1314, 1316, 1337, 1338, 1339, 1340, 1704, 1770, 1802], "interfrag_collinear_tol": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "interfrag_coord": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "interfrag_dist_inv": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "interfrag_hess": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "interfrag_mod": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "interfrag_step_limit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "interfrag_tight": [1226, 1324, 1704, 1802], "interfragment_connect": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "interior": [1230, 1483, 1704, 1837], "intermedi": [0, 75, 106, 400, 433, 463, 466, 503, 507, 514, 1199, 1200, 1201, 1202, 1225, 1230, 1231, 1242, 1463, 1489, 1627, 1704, 1714, 1730, 1733, 1742, 1755, 1767, 1771, 1777, 1781, 1794, 1837, 1838, 1842], "intermediari": [996, 1215, 1704, 1746], "intermediates_energi": 1794, "intermediates_gradi": 1794, "intermediates_hessian": 1794, "intermitt": 1786, "intermolecular": [1770, 1778, 1781, 1802, 1806, 1833, 1837], "intern": [14, 62, 84, 106, 128, 130, 138, 145, 147, 150, 267, 284, 314, 416, 592, 596, 632, 637, 656, 668, 683, 743, 1070, 1076, 1088, 1150, 1170, 1183, 1198, 1208, 1219, 1221, 1222, 1225, 1229, 1231, 1293, 1306, 1334, 1343, 1349, 1351, 1352, 1364, 1365, 1367, 1434, 1620, 1704, 1708, 1714, 1730, 1735, 1738, 1740, 1742, 1743, 1746, 1759, 1762, 1765, 1767, 1771, 1772, 1773, 1775, 1779, 1782, 1783, 1784, 1785, 1791, 1802, 1803, 1809, 1810, 1817, 1828, 1833, 1838, 1839, 1842, 1844], "internal_rot": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "internet": 1833, "interoper": [1769, 1781], "interp": 1738, "interpol": [1231, 1616, 1617, 1704, 1759], "interpret": [374, 395, 1738, 1743, 1767, 1776, 1786, 1788, 1790, 1794, 1799, 1824, 1828, 1831, 1832, 1833, 1835, 1838, 1844], "interprocedur": 1746, "interrupt": 1738, "interstrand": [1692, 1752], "interti": 106, "interv": 106, "interven": [1714, 1842], "intra": 1763, "intract": 1763, "intrafrag": [1226, 1342, 1704, 1802], "intrafrag_hess": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "intrafrag_step_limit": [0, 1, 2, 634, 1206, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "intrafrag_step_limit_max": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "intrafrag_step_limit_min": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "intramolecular": [106, 295, 1230, 1442, 1704, 1714, 1766, 1768, 1777, 1781, 1790, 1828, 1837, 1842, 1844], "intramonom": 1781, "intric": 1743, "intrins": [1770, 1802], "introduc": [1730, 1743, 1753, 1757, 1759, 1781, 1790, 1797, 1817, 1821, 1828, 1836, 1837, 1838, 1844], "introduct": [0, 1734, 1743, 1754, 1755, 1757, 1770, 1777, 1788, 1790, 1802, 1831], "ints_toler": [0, 1, 2, 187, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "intuit": 1833, "intvector": [36, 37, 38, 54, 78, 1827], "invari": [702, 1206, 1704, 1734, 1798, 1817, 1841], "invers": [100, 139, 811, 1055, 1210, 1218, 1704, 1706, 1754, 1755, 1776, 1810, 1838], "inverse_fine_structure_const": 1706, "inverse_meter_atomic_mass_unit_relationship": 1706, "inverse_meter_electron_volt_relationship": 1706, "inverse_meter_hartree_relationship": 1706, "inverse_meter_hertz_relationship": 1706, "inverse_meter_joule_relationship": 1706, "inverse_meter_kelvin_relationship": 1706, "inverse_meter_kilogram_relationship": 1706, "inverse_of_conductance_quantum": 1706, "invert": [100, 106, 874, 1210, 1704, 1838], "investig": [0, 1757, 1781, 1833], "invok": [570, 669, 677, 823, 1206, 1210, 1704, 1736, 1742, 1743, 1755, 1767, 1770, 1771, 1777, 1781, 1782, 1791, 1792, 1796, 1828, 1832, 1837, 1838, 1844], "involv": [342, 356, 568, 575, 608, 610, 657, 671, 792, 860, 1206, 1210, 1230, 1445, 1704, 1714, 1735, 1738, 1743, 1746, 1753, 1757, 1767, 1770, 1782, 1786, 1805, 1810, 1828, 1834, 1837, 1838, 1842, 1844], "io": [90, 100, 148, 900, 993, 1212, 1215, 1231, 1507, 1704, 1738, 1746, 1748, 1788, 1827, 1837, 1838], "iomanag": 1827, "iomp5": 1738, "ion": [1714, 1754, 1842], "ionari": 1757, "ioniz": [608, 613, 896, 925, 1206, 1211, 1213, 1225, 1262, 1264, 1704, 1757, 1781, 1805, 1837], "iota": 88, "ip": [1714, 1777, 1780, 1790, 1837, 1842], "ip_fit": [1757, 1768, 1777], "ip_pol": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ipea": [988, 1215, 1704, 1746], "ipi": [308, 1738, 1768], "ipi_brok": 1768, "ipibrok": [308, 1768, 1777], "ir": [1707, 1731], "ir_intens": 386, "irc": [1226, 1346, 1347, 1348, 1354, 1704, 1714, 1802, 1842], "irc_direct": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "irc_point": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "irc_step_s": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "iroot": 13, "irreconcil": 1786, "irreduc": [0, 91, 106, 386, 422, 495, 531, 569, 593, 609, 616, 660, 1125, 1198, 1200, 1202, 1206, 1221, 1704, 1742, 1771, 1772, 1797, 1837, 1838], "irreduciblerepresent": [17, 1827], "irrelev": 1808, "irrep": [1, 2, 11, 13, 15, 16, 17, 20, 64, 88, 91, 100, 115, 148, 150, 259, 277, 300, 301, 302, 331, 386, 399, 410, 419, 489, 490, 495, 527, 837, 855, 881, 887, 897, 993, 1065, 1102, 1123, 1127, 1128, 1159, 1160, 1161, 1162, 1164, 1165, 1168, 1177, 1189, 1192, 1197, 1198, 1200, 1202, 1210, 1211, 1215, 1219, 1221, 1222, 1229, 1231, 1433, 1641, 1642, 1655, 1704, 1714, 1742, 1743, 1746, 1750, 1755, 1772, 1776, 1780, 1789, 1795, 1801, 1810, 1828, 1829, 1838, 1841, 1842, 1844], "irrep_data": [100, 148, 331, 1797], "irrep_index": 15, "irrep_label": [106, 386], "irreped_mat": 1797, "irrepord": 1801, "irrespect": 1748, "is_c_hybrid": 138, "is_c_lrc": 138, "is_c_scs_hybrid": 138, "is_cartesian": 81, "is_don": 3, "is_gga": [80, 138], "is_invert": 78, "is_libxc_func": 138, "is_lrc": 80, "is_meta": [80, 138], "is_poisson": 78, "is_pur": 81, "is_vari": 106, "is_x_hybrid": 138, "is_x_lrc": 138, "isapt": [1049, 1218, 1704, 1714, 1842], "isapt1": [2, 1714, 1770, 1842], "isapt2": [1714, 1842], "isbn": 1734, "isclos": 2, "isfil": 1788, "ish": [1767, 1838], "isn": [2, 279, 1230, 1455, 1480, 1704, 1759, 1785, 1788, 1837], "iso": [103, 1750], "isocontour": [1110, 1221, 1704, 1750], "isol": 1801, "isosurfac": 1750, "isotop": [106, 1232, 1666, 1704, 1832, 1843], "isotope1": [1714, 1842], "isotope2": [1714, 1833, 1842, 1843], "isotopolog": [574, 1206, 1704, 1714, 1842], "isotopologu": 1833, "isotrop": [1228, 1390, 1704, 1749], "isotropic_pol": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "isovalu": 1750, "issu": [0, 247, 657, 1206, 1231, 1508, 1629, 1704, 1737, 1738, 1743, 1746, 1757, 1759, 1767, 1770, 1781, 1787, 1788, 1802, 1803, 1814, 1816, 1817, 1828, 1837, 1838, 1844], "istop": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "isym": [2, 286, 298, 337, 348], "item": [5, 106, 284, 327, 434, 1199, 1704, 1738, 1740, 1742, 1786, 1788, 1794, 1801, 1809, 1821], "iter": [0, 1, 5, 18, 64, 84, 89, 100, 266, 270, 276, 277, 295, 328, 329, 330, 335, 342, 344, 356, 357, 405, 431, 440, 447, 457, 485, 496, 498, 524, 530, 548, 583, 585, 594, 605, 606, 609, 645, 646, 665, 685, 687, 689, 700, 723, 729, 741, 744, 759, 760, 768, 805, 808, 811, 813, 816, 833, 835, 837, 839, 840, 848, 853, 870, 874, 883, 893, 894, 914, 932, 946, 950, 966, 971, 972, 974, 976, 1003, 1060, 1062, 1066, 1080, 1141, 1180, 1185, 1197, 1199, 1200, 1202, 1203, 1206, 1207, 1208, 1209, 1210, 1211, 1213, 1214, 1215, 1218, 1219, 1221, 1222, 1225, 1228, 1229, 1230, 1231, 1243, 1263, 1267, 1281, 1286, 1391, 1405, 1416, 1426, 1430, 1439, 1457, 1490, 1499, 1550, 1561, 1568, 1577, 1580, 1607, 1639, 1648, 1652, 1668, 1669, 1680, 1682, 1690, 1704, 1734, 1735, 1742, 1746, 1749, 1755, 1757, 1763, 1766, 1768, 1770, 1771, 1776, 1780, 1785, 1788, 1789, 1790, 1792, 1793, 1798, 1802, 1817, 1824, 1828, 1832, 1837, 1838, 1841, 1844], "iter_inv": [874, 1210, 1704], "iteration_": 84, "iteration_energi": 84, "ith": 81, "its": [0, 2, 8, 11, 100, 106, 284, 322, 325, 329, 399, 419, 489, 527, 656, 666, 698, 827, 1070, 1076, 1088, 1096, 1198, 1200, 1202, 1206, 1210, 1219, 1225, 1296, 1704, 1714, 1730, 1738, 1740, 1743, 1746, 1748, 1749, 1752, 1753, 1755, 1756, 1757, 1759, 1762, 1765, 1767, 1771, 1773, 1774, 1775, 1776, 1781, 1782, 1783, 1784, 1785, 1786, 1794, 1795, 1798, 1801, 1803, 1806, 1807, 1810, 1817, 1823, 1828, 1832, 1837, 1838, 1839, 1841, 1842], "itself": [2, 267, 370, 1714, 1737, 1738, 1748, 1750, 1754, 1759, 1768, 1781, 1785, 1788, 1801, 1808, 1810, 1829, 1833, 1837, 1838, 1842], "iupac": [390, 1232, 1665, 1667, 1704, 1833, 1843], "iv": [792, 794, 795, 796, 798, 860, 875, 877, 879, 1210, 1704, 1778, 1810], "iwth": 73, "ixyz2databas": [1752, 1835], "iz": 1734, "izsak": [1734, 1838], "j": [11, 76, 84, 92, 100, 303, 356, 377, 443, 444, 479, 482, 519, 521, 543, 545, 669, 885, 981, 985, 1199, 1200, 1202, 1203, 1206, 1210, 1214, 1225, 1230, 1256, 1469, 1692, 1704, 1706, 1708, 1714, 1715, 1730, 1734, 1738, 1742, 1748, 1752, 1755, 1756, 1757, 1759, 1762, 1763, 1767, 1771, 1776, 1777, 1780, 1781, 1783, 1786, 1792, 1810, 1837, 1838, 1842], "j_": 1757, "j_alg": 1838, "j_fc": [669, 1206, 1704], "j_sd": [669, 1206, 1704], "j_so": [669, 1206, 1704], "ja": 1756, "ja00480a005": 1734, "jacobi": [0, 725, 746, 1207, 1208, 1704, 1753], "jadz": 1733, "jaeger": 1734, "jaindx": [680, 1206, 1704], "jame": [1734, 1781, 1786, 1841], "jansen": [1734, 1781, 1837], "janssen": 1781, "januari": [1787, 1837], "jaqz": 1733, "jatz": 1733, "jb": [1708, 1756, 1763], "jcc": [1734, 1781], "jcp": [1225, 1229, 1271, 1427, 1692, 1704, 1714, 1740, 1752, 1842], "jctc": [295, 318, 319, 1692, 1695, 1698, 1700, 1702, 1703, 1734, 1752, 1758, 1766, 1781, 1800], "jeff": 1841, "jensen": [1707, 1730, 1731, 1734, 1755], "jerom": [1786, 1838], "jet": 1810, "jeziorski": [1734, 1781, 1828, 1829, 1837, 1844], "jfit": [1707, 1731], "jha": [1734, 1777, 1780], "ji": 1838, "jinja": 1788, "jitter": 387, "jj": [1757, 1763, 1838], "jk": [18, 66, 84, 102, 714, 1207, 1231, 1613, 1618, 1694, 1704, 1706, 1714, 1726, 1732, 1771, 1827, 1841, 1842], "jk_type": 92, "jkfit": [8, 92, 295, 376, 397, 810, 1210, 1230, 1231, 1445, 1502, 1694, 1704, 1707, 1714, 1730, 1731, 1732, 1733, 1756, 1757, 1766, 1770, 1771, 1828, 1837, 1838, 1842, 1844], "job": [2, 168, 284, 378, 516, 570, 656, 1088, 1202, 1206, 1219, 1225, 1270, 1704, 1738, 1740, 1743, 1752, 1757, 1759, 1771, 1772, 1774, 1777, 1785, 1795, 1802, 1833, 1837, 1840], "jobarc": [638, 680, 1206, 1704], "jobnam": 1767, "jobtyp": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "joda": [614, 1206, 1704], "joda_print": [644, 1206, 1704], "john": [1734, 1743], "johndo": [1737, 1786], "johnson": [1759, 1837], "join": 1743, "jone": 1757, "jong": 1734, "jorg": 1734, "jorgensen": [1740, 1755], "josephson": 1706, "josephson_const": 1706, "joul": 1706, "joule_atomic_mass_unit_relationship": 1706, "joule_electron_volt_relationship": 1706, "joule_hartree_relationship": 1706, "joule_hertz_relationship": 1706, "joule_inverse_meter_relationship": 1706, "joule_kelvin_relationship": 1706, "joule_kilogram_relationship": 1706, "journei": 1835, "jp045141": [1692, 1752], "jp066479k": [295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "jpca": [1692, 1734, 1752], "jpclett": [295, 318, 319, 1695, 1698, 1702, 1703, 1758, 1766, 1800], "jpeg": 1788, "jpg": 1788, "jroot": 13, "jsch": 1832, "json": [265, 367, 400, 1740, 1767, 1768, 1772, 1788, 1794, 1802, 1842], "json_data": [100, 148], "jsonschema": 1738, "jsyu": [2, 285, 296, 336, 1769], "jturnei": 1738, "judg": 1743, "jul": [1733, 1804], "juli": [1792, 1837], "jump": 279, "jun": [106, 284, 295, 1694, 1707, 1714, 1731, 1732, 1733, 1740, 1743, 1766, 1770, 1828, 1833, 1837, 1842, 1844], "june": 1746, "jupyt": [1738, 1828], "jurecka": [1692, 1752], "just": [0, 2, 106, 279, 393, 610, 656, 660, 993, 1206, 1215, 1704, 1708, 1714, 1730, 1737, 1738, 1740, 1743, 1746, 1748, 1756, 1757, 1768, 1771, 1779, 1782, 1785, 1786, 1801, 1808, 1810, 1815, 1817, 1828, 1842, 1843, 1844], "justin": [1757, 1762, 1768, 1783, 1791, 1792, 1838], "justm": 1748, "jz201170d": [295, 1695, 1697, 1698, 1700, 1701, 1702, 1758, 1766], "k": [2, 11, 76, 84, 92, 295, 318, 319, 342, 368, 369, 377, 386, 390, 394, 861, 1210, 1224, 1683, 1691, 1695, 1698, 1700, 1703, 1704, 1706, 1707, 1714, 1731, 1734, 1738, 1742, 1750, 1755, 1757, 1758, 1763, 1766, 1767, 1772, 1776, 1777, 1780, 1781, 1786, 1792, 1798, 1800, 1809, 1838, 1842, 1843], "k_": 1798, "k_a": 1837, "k_alg": 1838, "k_b": 1837, "ka": [641, 1206, 1704], "kabsch": 106, "kaliman": [1216, 1678, 1777, 1780], "kallai": [216, 217, 295, 586, 1206, 1704, 1734, 1740, 1755, 1766, 1792, 1793], "kappa": [1753, 1798], "kappa_": 1798, "kappa_invang": 1754, "kappa_invbohr": 1754, "kappa_p": 1753, "karlsruh": [1707, 1730, 1731], "karton": 1740, "kb": [650, 1206, 1704, 1706, 1832], "kcal": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1828, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "kcalmol2wavenumb": 1706, "keep": [0, 1, 2, 86, 106, 265, 295, 407, 408, 656, 1197, 1206, 1231, 1613, 1704, 1735, 1737, 1738, 1740, 1743, 1747, 1748, 1757, 1766, 1785, 1794, 1810, 1817, 1828, 1837, 1838, 1844], "keepal": 1748, "kei": [0, 2, 8, 21, 68, 86, 100, 106, 148, 150, 151, 174, 175, 176, 192, 195, 197, 200, 203, 207, 208, 209, 210, 211, 212, 219, 235, 236, 238, 244, 246, 247, 248, 249, 254, 255, 262, 263, 265, 267, 268, 277, 283, 323, 333, 346, 359, 366, 367, 371, 376, 377, 379, 383, 386, 397, 1738, 1740, 1754, 1757, 1759, 1761, 1772, 1788, 1794, 1823, 1824, 1828, 1838], "kelvin": [1232, 1667, 1704, 1706, 1754, 1843], "kelvin_atomic_mass_unit_relationship": 1706, "kelvin_electron_volt_relationship": 1706, "kelvin_hartree_relationship": 1706, "kelvin_hertz_relationship": 1706, "kelvin_inverse_meter_relationship": 1706, "kelvin_joule_relationship": 1706, "kelvin_kilogram_relationship": 1706, "kenneth": [1692, 1752], "kept": [823, 1210, 1226, 1356, 1704, 1753], "kernel": [1230, 1231, 1468, 1626, 1628, 1629, 1630, 1634, 1704, 1756, 1757, 1760, 1837, 1838], "kesharwani": 1734, "ket": [13, 1708, 1756], "keten": [1714, 1842], "key1": 27, "key2": 27, "keyerror": [150, 262], "keynot": 1788, "keyword": [0, 8, 86, 106, 195, 197, 200, 208, 209, 210, 219, 235, 236, 246, 248, 249, 265, 283, 284, 300, 301, 302, 303, 318, 319, 326, 327, 328, 333, 357, 371, 378, 381, 382, 392, 430, 539, 569, 574, 581, 582, 586, 587, 592, 593, 599, 603, 606, 608, 609, 610, 611, 614, 616, 619, 622, 625, 628, 629, 630, 631, 632, 633, 634, 637, 639, 640, 641, 643, 645, 648, 650, 651, 652, 654, 655, 656, 660, 662, 664, 665, 670, 671, 672, 676, 679, 684, 685, 689, 690, 691, 694, 695, 699, 705, 708, 709, 711, 712, 736, 823, 930, 949, 958, 1065, 1076, 1084, 1096, 1102, 1125, 1157, 1199, 1203, 1206, 1208, 1210, 1213, 1219, 1221, 1225, 1226, 1231, 1266, 1290, 1360, 1497, 1498, 1577, 1599, 1619, 1711, 1714, 1730, 1733, 1738, 1739, 1740, 1743, 1752, 1753, 1756, 1757, 1759, 1763, 1764, 1768, 1775, 1777, 1779, 1780, 1781, 1782, 1787, 1790, 1791, 1792, 1794, 1795, 1796, 1800, 1801, 1805, 1808, 1809, 1814, 1821, 1826, 1828, 1829, 1831, 1834, 1838, 1840, 1842, 1844], "kg": [1706, 1832], "ki": 1735, "kib": 1832, "kicharski": 1734, "kilogram": 1706, "kilogram_atomic_mass_unit_relationship": 1706, "kilogram_electron_volt_relationship": 1706, "kilogram_hartree_relationship": 1706, "kilogram_hertz_relationship": 1706, "kilogram_inverse_meter_relationship": 1706, "kilogram_joule_relationship": 1706, "kilogram_kelvin_relationship": 1706, "kilojoul": 1706, "kind": [0, 2, 377, 662, 1206, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1828, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "kinet": [76, 89, 93, 103, 150, 295, 318, 319, 1669, 1690, 1695, 1697, 1698, 1700, 1702, 1703, 1757, 1758, 1766, 1776, 1781, 1800, 1817, 1836, 1838], "kinetic_grad": 103, "kineticint": [1817, 1827], "king": [1734, 1781, 1782, 1786, 1802, 1843], "kitandkapoodl": 1788, "kj": [1706, 1752, 1763, 1837], "kl": [641, 1206, 1704, 1708, 1763], "klamt": [1734, 1754], "klepei": 1734, "klitz": 1706, "klopper": 1740, "km": 386, "kmlyp": [295, 318, 319, 1695, 1698, 1700, 1703, 1758, 1766, 1800], "knew": 1738, "knob": [1738, 1783], "know": [2, 603, 664, 1124, 1206, 1221, 1704, 1738, 1750, 1757, 1786, 1801, 1817, 1824, 1828, 1833, 1838, 1843, 1844], "knowledg": [608, 1206, 1229, 1688, 1704, 1755], "known": [106, 265, 577, 1206, 1704, 1730, 1738, 1739, 1740, 1742, 1753, 1756, 1757, 1759, 1763, 1767, 1771, 1781, 1788, 1789, 1790, 1794, 1798, 1801, 1803, 1838], "koch": [1734, 1740], "kohn": [84, 150, 314, 1734, 1757, 1791, 1810, 1837, 1838], "kongst": 1734, "konrad": 1734, "koopman": [925, 1213, 1225, 1259, 1260, 1704, 1757, 1781], "korona": [1230, 1469, 1704, 1734, 1837], "korsel": 1781, "kpa": 1706, "kpd": 1788, "kr": [1707, 1714, 1731, 1733, 1842], "krau": [1734, 1740, 1750, 1781], "krieg": 1734, "krivdina": 1734, "krkr": [1692, 1752], "kroll": [1122, 1221, 1704, 1730, 1762, 1836], "kruse": [1734, 1760, 1781], "krylov": [1734, 1798, 1805], "krypton": [1692, 1752], "ksdt": [295, 318, 319, 1695, 1698, 1703, 1758, 1766, 1800], "kt2": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "kth": [861, 863, 1210, 1704, 1755], "kumar": [1734, 1781, 1786], "kurlancek": [1734, 1798], "kurlancheek": [1734, 1798], "kussmann": 1734, "kutzelnigg": [1734, 1781, 1836], "kw": 1711, "kwarg": [2, 5, 8, 13, 20, 27, 29, 64, 88, 90, 92, 96, 100, 101, 103, 106, 114, 119, 147, 148, 246, 248, 252, 275, 284, 291, 295, 300, 301, 302, 306, 307, 312, 317, 318, 319, 320, 341, 351, 352, 359, 365, 370, 381, 382, 393, 394, 398, 1714, 1740, 1743, 1750, 1768, 1772, 1779, 1794, 1799, 1809, 1834, 1842], "kwargs_low": [1809, 1834], "k\u00e1llai": 1755, "l": [2, 5, 94, 97, 295, 318, 319, 377, 1131, 1132, 1133, 1134, 1136, 1137, 1221, 1695, 1697, 1698, 1702, 1703, 1704, 1714, 1730, 1734, 1738, 1754, 1755, 1758, 1763, 1766, 1767, 1776, 1777, 1780, 1781, 1782, 1786, 1788, 1789, 1799, 1800, 1803, 1810, 1836, 1842], "l10": 1788, "l105": 1833, "l130": 1788, "l136": 1833, "l15": 1788, "l23": 372, "l41": 372, "l762": 1730, "l9": 1788, "l_m": 1775, "l_user_scftype_scf": 1801, "l_user_wfn": 1801, "l_user_wfn_scf": 1801, "la": [1707, 1731], "lab": [1738, 1759, 1783, 1804, 1835], "labb": 1734, "label": [2, 8, 21, 74, 98, 100, 103, 106, 257, 258, 283, 284, 285, 286, 287, 296, 298, 317, 333, 336, 337, 338, 348, 365, 383, 384, 386, 616, 1206, 1704, 1706, 1708, 1730, 1733, 1737, 1738, 1743, 1748, 1750, 1753, 1756, 1764, 1767, 1769, 1776, 1782, 1785, 1788, 1794, 1799, 1802, 1804, 1833, 1837], "labori": 1833, "lack": [1753, 1757, 1802, 1832], "lag": 279, "lagard\u00e8r": 1734, "lagrang": 1202, "lagrangian": [62, 150, 1708, 1798], "laid": 150, "laikov": 1757, "lambda": [164, 346, 377, 520, 529, 639, 647, 655, 913, 1202, 1206, 1213, 1225, 1230, 1244, 1476, 1671, 1704, 1739, 1742, 1757, 1776, 1781, 1798, 1838], "lambda_": [377, 1753], "lambda_1": [530, 1202, 1704], "lambda_2": [530, 1202, 1704, 1753], "lambda_3": 1753, "lan": [1714, 1842], "lanczo": [874, 1210, 1704], "lane": 1788, "langl": [411, 430, 433, 466, 507, 513, 514, 557, 568, 575, 641, 727, 787, 884, 917, 1198, 1199, 1200, 1201, 1202, 1204, 1206, 1208, 1210, 1213, 1225, 1242, 1704, 1714, 1742, 1756, 1757, 1763, 1771, 1798, 1829, 1836, 1838, 1842], "languag": [810, 1210, 1704, 1738, 1764, 1785, 1821, 1824, 1828, 1832, 1844], "lanl2dz": [1707, 1731], "lapack": [1714, 1736, 1737, 1746, 1767, 1782, 1785, 1812, 1814, 1842], "lapack_include_dir": 1738, "lapack_librari": 1738, "lapack_typ": 1738, "laplac": [95, 140, 1230, 1443, 1704, 1781, 1837], "laplacedenomin": 1827, "laqua": [1734, 1757, 1838], "larg": [0, 106, 327, 342, 356, 433, 466, 507, 514, 568, 574, 682, 703, 726, 1153, 1199, 1200, 1201, 1202, 1206, 1208, 1221, 1225, 1230, 1242, 1463, 1692, 1704, 1714, 1730, 1738, 1742, 1748, 1750, 1752, 1757, 1759, 1763, 1767, 1768, 1770, 1774, 1776, 1781, 1798, 1802, 1824, 1835, 1836, 1837, 1838, 1842, 1844], "larger": [577, 1206, 1226, 1231, 1331, 1332, 1490, 1704, 1730, 1738, 1740, 1753, 1755, 1757, 1770, 1785, 1790, 1802, 1821, 1838], "largest": [2, 285, 287, 321, 336, 338, 432, 601, 634, 659, 683, 698, 700, 1199, 1206, 1704, 1742, 1752, 1754, 1781, 1788, 1832, 1833], "last": [2, 5, 18, 66, 150, 276, 277, 284, 286, 295, 300, 301, 302, 312, 318, 319, 337, 342, 356, 381, 382, 430, 490, 628, 867, 1199, 1200, 1206, 1210, 1231, 1606, 1704, 1714, 1738, 1740, 1748, 1752, 1757, 1766, 1768, 1770, 1772, 1782, 1785, 1788, 1794, 1795, 1799, 1800, 1804, 1810, 1826, 1828, 1832, 1833, 1838, 1840, 1842, 1844], "lastli": 1838, "lasttest": [2, 1738], "late": [1746, 1757, 1828], "later": [0, 2, 87, 284, 370, 488, 637, 648, 671, 1148, 1149, 1200, 1206, 1221, 1231, 1613, 1704, 1708, 1730, 1738, 1740, 1757, 1781, 1785, 1786, 1798, 1804, 1808, 1835, 1838, 1844], "latest": [1736, 1737, 1738, 1748, 1764, 1781, 1786, 1788, 1817, 1837], "latex": [1764, 1801], "latter": [0, 2, 297, 347, 474, 573, 577, 626, 647, 697, 703, 1200, 1206, 1231, 1655, 1704, 1714, 1738, 1742, 1743, 1752, 1753, 1755, 1756, 1757, 1759, 1770, 1774, 1788, 1803, 1804, 1817, 1834, 1837, 1838, 1841, 1842], "lattic": 1706, "lattice_parameter_of_silicon": 1706, "launch": [1756, 1767], "law": [1706, 1734, 1743], "layer": [1768, 1794, 1810, 1817, 1823, 1824], "layout": [100, 135, 148, 1736, 1767, 1777, 1814, 1818, 1824, 1838], "lbl": 1772, "lc": [295, 1695, 1698, 1701, 1710, 1758, 1766], "lcao": 1781, "lcc2": [1669, 1776], "lccd": [284, 295, 318, 319, 381, 382, 1675, 1680, 1684, 1714, 1739, 1740, 1766, 1771, 1776, 1781, 1798, 1800, 1826, 1842], "lccsd": [284, 295, 1669, 1680, 1714, 1739, 1740, 1766, 1771, 1776, 1781, 1842], "ld_library_path": [1738, 1808], "lda": [1230, 1478, 1704, 1708, 1714, 1810, 1838, 1842], "lda0": [295, 318, 319, 1695, 1698, 1700, 1701, 1703, 1758, 1766, 1800], "ldot": [1775, 1838], "le": [1231, 1562, 1704, 1738], "lead": [681, 1206, 1704, 1742, 1753, 1757, 1759, 1763, 1767, 1770, 1781, 1797, 1798, 1802, 1810, 1817, 1837, 1838], "leak": 1821, "learn": [1786, 1808], "least": [0, 2, 106, 154, 155, 156, 157, 158, 159, 342, 356, 399, 434, 703, 839, 840, 841, 1199, 1206, 1210, 1704, 1714, 1738, 1739, 1742, 1747, 1750, 1756, 1761, 1785, 1788, 1792, 1838, 1839, 1842], "leat": 1738, "leav": [2, 106, 279, 1231, 1498, 1704, 1730, 1738, 1767, 1785, 1786, 1788, 1817], "lebedev": [770, 776, 1209, 1231, 1536, 1537, 1544, 1704, 1754, 1757], "lechner": 1734, "lectur": 1770, "led": 1757, "left": [100, 284, 356, 411, 430, 466, 513, 514, 557, 1198, 1199, 1200, 1202, 1204, 1669, 1704, 1708, 1740, 1741, 1742, 1753, 1757, 1760, 1776, 1801, 1804, 1829, 1837, 1838, 1841], "leftarrow": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "leftmost": 0, "legaci": 1770, "legacy_gradi": 1743, "legendr": [1230, 1477, 1704], "legit": [267, 1759], "legitim": [380, 1768, 1782], "lehtola": [1734, 1781, 1838], "leining": [835, 1210, 1704, 1714, 1755, 1781, 1789, 1842], "len": [329, 1668, 1669, 1690, 1776], "length": [100, 149, 150, 282, 332, 388, 402, 414, 539, 618, 620, 683, 819, 1197, 1198, 1203, 1206, 1210, 1231, 1586, 1657, 1704, 1706, 1714, 1742, 1750, 1761, 1776, 1828, 1832, 1833, 1841, 1842, 1844], "lengthi": 1824, "lengthier": 1840, "lennard": 1757, "lenth": 1781, "less": [2, 106, 285, 287, 295, 318, 319, 329, 336, 338, 582, 647, 684, 703, 710, 837, 874, 1085, 1206, 1210, 1219, 1226, 1303, 1341, 1704, 1738, 1742, 1743, 1744, 1745, 1752, 1755, 1756, 1757, 1766, 1767, 1771, 1776, 1785, 1789, 1794, 1798, 1800, 1801, 1802, 1810, 1824, 1835, 1837, 1838], "lesser": [1714, 1738, 1781, 1842], "lestrang": 1734, "lestrange2015": [1734, 1841], "let": [1, 92, 1746, 1749, 1754, 1756, 1757, 1762, 1765, 1767, 1770, 1773, 1775, 1782, 1783, 1784, 1785, 1786, 1788, 1797, 1798, 1803, 1824, 1828, 1839, 1844], "lett": [1714, 1734, 1740, 1842], "letter": [1709, 1730, 1776, 1810], "lettercas": [330, 355, 358], "lev": [1224, 1235, 1704, 1785], "level": [0, 2, 103, 106, 138, 147, 150, 260, 261, 267, 268, 269, 284, 308, 310, 335, 346, 352, 361, 370, 378, 383, 433, 466, 507, 514, 525, 537, 549, 558, 574, 581, 586, 612, 659, 738, 791, 794, 800, 820, 859, 860, 868, 890, 920, 928, 1119, 1153, 1184, 1199, 1200, 1201, 1202, 1203, 1204, 1206, 1208, 1210, 1213, 1221, 1222, 1224, 1225, 1226, 1230, 1231, 1235, 1241, 1242, 1305, 1479, 1570, 1571, 1653, 1692, 1704, 1714, 1730, 1736, 1738, 1739, 1740, 1742, 1743, 1748, 1752, 1755, 1757, 1759, 1761, 1764, 1767, 1768, 1770, 1774, 1776, 1781, 1785, 1787, 1788, 1794, 1796, 1798, 1799, 1802, 1805, 1806, 1809, 1812, 1814, 1817, 1828, 1832, 1837, 1838, 1841, 1842, 1844], "level_hint": [267, 1759], "level_shift": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "level_shift_cutoff": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "levenshtein": [299, 349], "leverag": [1828, 1841], "lgpl": [1738, 1781], "lgtm": 1822, "lhf": 1837, "li": [1692, 1707, 1731, 1733, 1734, 1752, 1802], "lia": [903, 1212, 1704], "liabl": 1767, "liako": [1734, 1763], "lib": [2, 1738, 1765, 1783, 1785, 1786, 1828], "lib64": 1738, "lib_name_without_lib": 1785, "libacml": 1738, "libacml_mp": 1738, "libaddon": 1738, "libbla": 1738, "libc": [1738, 1808], "libciomr": [811, 1210, 1704, 1755, 1810], "libderiv": [1738, 1839], "libdii": [1708, 1838], "libdisp": [267, 1759], "libdpd": [433, 434, 466, 507, 514, 537, 558, 1199, 1200, 1201, 1202, 1203, 1204, 1225, 1242, 1704, 1742], "libecpint": [1738, 1777, 1780, 1838], "libefp": [295, 400, 1216, 1678, 1736, 1738, 1766, 1777, 1780, 1781, 1785, 1786, 1842], "libefp2": 1782, "libefp_dir": 1782, "libefpconfig": 1782, "liber": 106, "libfock": [1738, 1757, 1817, 1823, 1838], "libfunct": 1757, "libgcc": 1748, "libint": [1736, 1738, 1777, 1780, 1785, 1788, 1839], "libint1": [1738, 1783], "libint2": [214, 310, 361, 1129, 1221, 1704, 1738, 1783, 1788, 1817], "libint2_dir": 1783, "libint_dev": 1737, "libiomp5": 1738, "libjk": 1725, "liblapack": 1738, "libm": 1738, "libmint": [158, 1154, 1221, 1704, 1714, 1726, 1738, 1743, 1768, 1783, 1785, 1810, 1817, 1823, 1838, 1839, 1842], "libmintsbasisset": 1730, "libmintsmolecul": 1768, "libmkl_cor": 1738, "libmkl_lapack95_lp64": 1738, "libmkl_rt": [1738, 1748], "libopt": [1777, 1809, 1812], "libpython": 1748, "libpython3": 1738, "libqt": [100, 1810], "librari": [2, 86, 226, 267, 372, 728, 1208, 1215, 1216, 1677, 1678, 1704, 1714, 1730, 1735, 1736, 1737, 1743, 1746, 1748, 1749, 1754, 1757, 1759, 1762, 1765, 1767, 1773, 1775, 1777, 1780, 1781, 1783, 1784, 1785, 1786, 1798, 1803, 1808, 1810, 1817, 1823, 1824, 1838, 1839, 1841, 1842], "libsapt_solv": 1837, "libscf_solv": [130, 1154, 1221, 1704, 1757, 1838, 1841], "libstdc": 1808, "libtensorlight": 1738, "libtran": 1708, "libxc": [96, 138, 1231, 1520, 1704, 1714, 1738, 1757, 1777, 1780, 1781, 1842], "libxc_dir": 1784, "libxc_funct": 1757, "libxcconfig": 1784, "libxcfunct": [138, 1827], "licenc": [1, 1749, 1754, 1773, 1780, 1782, 1783, 1784, 1803], "licens": [1735, 1738, 1743, 1748, 1777, 1788, 1792, 1806], "life": [2, 285, 296, 336, 1769], "lift": [1823, 1824], "light": [106, 282, 323, 332, 1706, 1772], "light_color": 323, "lightweight": [267, 1748, 1759, 1786, 1824], "like": [0, 2, 8, 100, 111, 150, 229, 262, 263, 318, 319, 329, 356, 359, 367, 372, 386, 665, 1018, 1206, 1216, 1225, 1254, 1255, 1704, 1708, 1714, 1730, 1735, 1737, 1738, 1740, 1742, 1743, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1762, 1763, 1764, 1767, 1768, 1770, 1771, 1776, 1779, 1785, 1786, 1788, 1792, 1795, 1796, 1798, 1800, 1801, 1802, 1803, 1808, 1809, 1810, 1817, 1821, 1823, 1824, 1828, 1832, 1833, 1837, 1838, 1840, 1842, 1843, 1844], "likewis": [1730, 1767, 1781, 1833], "lim_": 1757, "limit": [2, 296, 381, 382, 539, 680, 1097, 1203, 1206, 1220, 1226, 1330, 1331, 1332, 1704, 1738, 1742, 1743, 1757, 1769, 1774, 1775, 1782, 1790, 1794, 1799, 1802, 1810, 1817, 1824, 1826, 1828, 1829, 1837, 1838, 1844], "linalg": [334, 1841], "lindep_tol": 115, "lindh": [1226, 1342, 1704], "lindh_simpl": [1226, 1342, 1704], "line": [2, 282, 332, 377, 380, 614, 661, 1206, 1224, 1240, 1704, 1714, 1730, 1735, 1736, 1738, 1739, 1743, 1750, 1764, 1768, 1777, 1782, 1785, 1788, 1801, 1802, 1808, 1822, 1828, 1832, 1833, 1834, 1835, 1838, 1841, 1842, 1844], "linear": [0, 1, 2, 16, 106, 115, 295, 318, 319, 335, 377, 573, 616, 639, 645, 646, 647, 662, 777, 929, 946, 977, 1206, 1209, 1213, 1214, 1225, 1226, 1229, 1231, 1281, 1339, 1403, 1602, 1616, 1617, 1692, 1704, 1708, 1710, 1714, 1730, 1733, 1734, 1735, 1738, 1739, 1740, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1790, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1811, 1812, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1839, 1840, 1841, 1842, 1843, 1844], "linear_tol": 115, "linearli": [115, 1710, 1714, 1763, 1810, 1838, 1842], "lineq": [946, 1213, 1225, 1281, 1704], "lineq_solv": [0, 1, 2, 946, 1225, 1281, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "lineq_typ": [645, 1206, 1704], "linesearch": [1226, 1368, 1704, 1802], "lineshap": [322, 325, 377, 1827], "linger": 1788, "link": [268, 292, 310, 343, 361, 373, 391, 721, 1034, 1036, 1037, 1041, 1047, 1048, 1049, 1050, 1166, 1207, 1218, 1221, 1231, 1572, 1626, 1636, 1692, 1704, 1714, 1738, 1746, 1748, 1752, 1757, 1762, 1764, 1765, 1767, 1773, 1775, 1777, 1782, 1783, 1784, 1785, 1788, 1790, 1804, 1808, 1824, 1838, 1839, 1842], "link_ints_toler": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "linker": 1770, "linux": [1, 1736, 1737, 1746, 1748, 1749, 1754, 1759, 1762, 1765, 1767, 1773, 1774, 1775, 1781, 1782, 1783, 1784, 1788, 1803, 1806, 1807, 1808, 1839], "lipparini": [1734, 1754], "list": [0, 2, 5, 8, 9, 13, 16, 21, 26, 27, 64, 73, 75, 84, 89, 90, 92, 96, 98, 100, 103, 105, 106, 108, 110, 111, 112, 114, 128, 131, 138, 139, 143, 147, 148, 150, 196, 240, 246, 248, 267, 268, 284, 285, 286, 297, 298, 299, 310, 317, 318, 319, 322, 324, 325, 327, 328, 329, 331, 334, 335, 336, 337, 342, 344, 346, 347, 348, 349, 356, 361, 363, 365, 367, 377, 381, 382, 383, 384, 386, 388, 389, 392, 616, 641, 829, 855, 930, 949, 958, 1108, 1111, 1126, 1155, 1206, 1210, 1213, 1221, 1225, 1231, 1266, 1290, 1655, 1704, 1735, 1738, 1740, 1742, 1743, 1746, 1748, 1750, 1752, 1753, 1754, 1755, 1757, 1759, 1761, 1762, 1765, 1767, 1768, 1772, 1773, 1774, 1775, 1776, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1790, 1792, 1794, 1797, 1798, 1799, 1800, 1802, 1803, 1804, 1808, 1817, 1826, 1828, 1829, 1832, 1833, 1838, 1839, 1840, 1841, 1843], "list_of_arrai": 1797, "list_of_ion": 1754, "liter": [2, 285, 287, 336, 338, 374, 395, 1764, 1789, 1794], "literal_cfour": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "literatur": [2, 68, 267, 356, 662, 1206, 1704, 1718, 1752, 1754, 1757, 1759, 1770, 1802, 1837], "lithium": [1714, 1842], "littl": [1738, 1767, 1828, 1837, 1844], "liu": [811, 1210, 1704, 1755], "live": [1764, 1777, 1786, 1801, 1818, 1828], "ll": [1738, 1743, 1788, 1817, 1828, 1836, 1844], "llai": [1224, 1683, 1742, 1755, 1767, 1777, 1780, 1792], "lldb": [1736, 1767, 1814], "ller": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "llvm": [1738, 1788], "lm": [1692, 1752], "lmo": [978, 980, 981, 982, 983, 985, 1214, 1704, 1763], "lmp2": [1669, 1776], "ln": [322, 368, 369, 377, 1738], "lo": 1810, "load": [2, 100, 148, 150, 225, 900, 1212, 1231, 1507, 1628, 1704, 1738, 1748, 1767, 1770, 1782, 1788, 1808, 1828, 1832, 1833, 1837], "load_mpqc": 100, "loader": [358, 1738], "loc": [1000, 1215, 1704, 1746], "local": [0, 1, 2, 8, 10, 76, 114, 117, 195, 197, 200, 210, 295, 326, 351, 370, 371, 376, 397, 442, 443, 444, 445, 446, 479, 481, 482, 483, 484, 518, 519, 520, 521, 522, 523, 542, 543, 544, 545, 546, 547, 620, 664, 763, 965, 971, 972, 973, 974, 976, 994, 1000, 1054, 1056, 1060, 1206, 1209, 1214, 1215, 1218, 1231, 1573, 1574, 1629, 1704, 1714, 1730, 1733, 1735, 1736, 1737, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1790, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1828, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "local_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "local_cphf_cutoff": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "local_cutoff": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "local_do_singl": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "local_filter_singl": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "local_ibo_condit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "local_ibo_pow": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "local_ibo_star": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "local_ibo_stars_complet": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "local_ibo_use_star": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "local_maxit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "local_method": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "local_opt": 1801, "local_pairdef": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "local_precondition": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "local_use_ghost": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "local_weakp": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "localhost": 1788, "localiz": 1770, "locat": [88, 106, 148, 231, 267, 323, 324, 1714, 1715, 1730, 1735, 1738, 1743, 1746, 1748, 1749, 1750, 1761, 1762, 1764, 1765, 1767, 1770, 1773, 1775, 1776, 1782, 1783, 1784, 1787, 1788, 1803, 1806, 1807, 1808, 1809, 1814, 1823, 1835, 1838, 1839, 1840, 1842, 1844], "lock": [138, 648, 1206, 1229, 1415, 1704], "lock_occ": 1785, "lock_singlet": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "log": [2, 342, 356, 1736, 1748, 1767, 1768, 1786, 1788, 1794, 1802], "log_gaussian": [968, 1214, 1231, 1532, 1704], "log_slat": [968, 1214, 1231, 1532, 1704], "logarithm": [1231, 1531, 1704], "logfil": [767, 1209, 1704, 1754], "logger": 1768, "logic": [2, 62, 285, 336, 660, 1206, 1704, 1757, 1788, 1824], "loglevel": [1738, 1767, 1768], "logo": [1736, 1767], "lol": [1112, 1221, 1704, 1750], "lola": [1112, 1221, 1704, 1750], "lolb": [1112, 1221, 1704, 1750], "london": 1734, "lone": [284, 1740, 1788], "long": [2, 138, 389, 400, 1710, 1738, 1752, 1755, 1756, 1757, 1759, 1764, 1785, 1786, 1787, 1801, 1802, 1810, 1828, 1832, 1833, 1837, 1838], "longer": [592, 682, 1206, 1231, 1498, 1704, 1738, 1759, 1763, 1764, 1783, 1810, 1817, 1838], "longest": 2, "longtest": 2, "longtim": 1743, "look": [8, 299, 349, 603, 881, 1206, 1210, 1704, 1738, 1740, 1743, 1749, 1750, 1753, 1754, 1756, 1757, 1762, 1764, 1767, 1786, 1788, 1801, 1803, 1808, 1817, 1828, 1837, 1838, 1844], "look_at": 323, "lookup": [86, 1757], "loop": [1711, 1714, 1777, 1799, 1810, 1817, 1828, 1833, 1842, 1844], "loop_start": 1817, "loos": [975, 1214, 1704, 1833], "loosen": [1230, 1455, 1704, 1757, 1837], "looser": 2, "lorentzian": [322, 377, 1827], "lori": [106, 1740, 1743, 1746, 1752, 1759, 1765, 1773, 1774, 1782, 1783, 1784, 1802, 1804, 1807, 1839, 1843], "loriab": 1759, "loschmidt": 1706, "loschmidt_constant_27315_k_100_kpa": 1706, "loschmidt_constant_27315_k_101325_kpa": 1706, "lose": 106, "loss": [1753, 1798, 1838], "lost": 106, "lot": [2, 308, 1738, 1764, 1768, 1786, 1798, 1799, 1810, 1817, 1828, 1844], "low": [20, 265, 434, 467, 1095, 1199, 1200, 1219, 1704, 1714, 1738, 1740, 1742, 1757, 1763, 1767, 1771, 1788, 1794, 1812, 1814, 1829, 1838, 1842], "low_mem": [951, 1213, 1704], "lowdin": [1685, 1776], "lowdin_charg": [111, 1799], "lower": [20, 100, 284, 359, 574, 614, 640, 681, 887, 1206, 1210, 1224, 1226, 1241, 1345, 1692, 1704, 1714, 1726, 1738, 1740, 1742, 1752, 1754, 1755, 1757, 1763, 1771, 1785, 1802, 1809, 1810, 1833, 1834, 1838, 1841, 1842], "lower_bound": 1802, "lowercas": [359, 392, 1709, 1730, 1738, 1754, 1776, 1782, 1785, 1809, 1834, 1835], "lowernam": [1809, 1834], "lowertriangl": [100, 135], "lowest": [0, 300, 301, 302, 342, 603, 609, 660, 671, 672, 681, 833, 1125, 1206, 1210, 1221, 1226, 1231, 1363, 1658, 1704, 1714, 1750, 1755, 1771, 1772, 1795, 1829, 1833, 1837, 1838, 1841, 1842], "lpb": [769, 781, 1209, 1704, 1754], "lpol": [1694, 1707, 1731, 1732, 1733], "lr": [0, 495, 606, 610, 613, 1200, 1206, 1224, 1236, 1704, 1714, 1742, 1842], "lr1": [1714, 1842], "lr2": [1714, 1842], "lr3": [1714, 1842], "lrc": [295, 1695, 1698, 1700, 1701, 1710, 1714, 1739, 1757, 1758, 1766, 1781, 1842], "lru": [434, 467, 1199, 1200, 1704, 1742], "ls_thc_basis_toler": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ls_thc_comput": 1827, "ls_thc_df": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ls_thc_pruning_schem": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ls_thc_radial_point": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ls_thc_s_epsilon": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ls_thc_spherical_point": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ls_thc_weights_toler": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "lsda": [300, 301, 302, 1739, 1757, 1772, 1781], "lsda_cutoff": 80, "lsdaton": 1724, "lse": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "lse_collaps": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "lse_toler": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "lto": [1736, 1780], "lu": [100, 1714, 1734, 1754, 1810, 1842], "luckili": 1828, "lumo": [476, 671, 895, 1200, 1206, 1211, 1231, 1564, 1704, 1714, 1750, 1768, 1838, 1842], "lumo_occ": 1768, "luu": [1734, 1770], "lvc": [655, 1206, 1704], "lvl": 1785, "lvmo": 1750, "lx": 1810, "ly": [2, 1224, 1683, 1748, 1755, 1757, 1792, 1810, 1838], "lz": 1810, "m": [0, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1750, 1751, 1752, 1753, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "m05": [295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1757, 1758, 1766, 1800], "m06": [295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "m08": [295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "m11": [295, 318, 319, 1695, 1697, 1698, 1700, 1701, 1702, 1703, 1758, 1766, 1800], "m_": [692, 865, 884, 1206, 1210, 1224, 1229, 1238, 1239, 1401, 1704, 1750, 1755, 1829, 1833], "m_iabc": 1708, "m_lumo": [1112, 1221, 1704, 1750], "m_tdm": [1231, 1657, 1704, 1841], "ma": 1833, "mac": [1736, 1737, 1748, 1767, 1781, 1808], "machin": [575, 651, 1206, 1704, 1781, 1821, 1838], "machineri": [2, 106, 271, 1738, 1743, 1756, 1757, 1817, 1824], "maco": [1, 1746, 1748, 1749, 1754, 1759, 1762, 1765, 1773, 1774, 1775, 1781, 1782, 1783, 1784, 1803, 1806, 1807, 1839], "macosx": 1748, "macp": 1833, "macport": [1736, 1767], "macro": [741, 1208, 1704, 1757], "macroconfigur": [794, 1210, 1704], "macroiter": [84, 749, 1208, 1704, 1753, 1838], "macroscop": 377, "mad": [906, 1212, 1704, 1757], "madai": 1734, "made": [268, 359, 1730, 1737, 1743, 1748, 1753, 1756, 1757, 1763, 1778, 1785, 1801, 1802, 1808, 1824, 1832, 1834, 1835], "madmp2_sleep": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mag": [683, 1206, 1704, 1706], "mag_const": 1706, "mag_flux_quantum": 1706, "magma": [1231, 1629, 1704], "magnet": [636, 1206, 1231, 1657, 1704, 1776, 1841], "magnetiz": [454, 1199, 1704, 1706], "magneton": 1706, "magnitud": [275, 873, 1210, 1226, 1231, 1330, 1586, 1704, 1753, 1757, 1817, 1838], "mai": [0, 2, 8, 106, 122, 150, 262, 263, 318, 319, 329, 370, 383, 433, 457, 466, 471, 507, 514, 615, 660, 671, 786, 823, 827, 833, 882, 1125, 1130, 1199, 1200, 1201, 1202, 1206, 1210, 1221, 1225, 1230, 1231, 1242, 1435, 1436, 1445, 1508, 1694, 1704, 1707, 1730, 1731, 1732, 1733, 1736, 1737, 1739, 1742, 1743, 1746, 1748, 1752, 1753, 1755, 1756, 1757, 1761, 1763, 1767, 1770, 1771, 1774, 1775, 1776, 1780, 1781, 1782, 1785, 1786, 1788, 1789, 1794, 1795, 1798, 1799, 1800, 1801, 1802, 1804, 1808, 1810, 1817, 1828, 1829, 1832, 1835, 1837, 1838, 1839, 1843, 1844], "mail": 1804, "main": [2, 1733, 1737, 1738, 1740, 1748, 1756, 1763, 1775, 1786, 1788, 1804, 1808, 1827, 1828, 1838], "main_pag": 1738, "mainli": [1714, 1788, 1803, 1842], "maintain": [434, 1199, 1704, 1742, 1785, 1786, 1802, 1804, 1817, 1824], "mainten": [2, 1786, 1788], "mainz": 1743, "major": [279, 1742, 1763, 1768, 1781, 1810, 1832], "make": [0, 2, 88, 100, 148, 329, 837, 881, 884, 1102, 1126, 1170, 1210, 1221, 1228, 1231, 1390, 1575, 1704, 1714, 1730, 1735, 1738, 1740, 1742, 1743, 1747, 1748, 1749, 1752, 1753, 1754, 1755, 1756, 1759, 1762, 1764, 1767, 1770, 1771, 1772, 1774, 1779, 1781, 1782, 1785, 1786, 1788, 1789, 1791, 1801, 1802, 1803, 1808, 1817, 1821, 1823, 1824, 1828, 1832, 1835, 1838, 1842, 1844], "make_filenam": 8, "make_shar": [1814, 1817, 1819], "makeandnuk": 90, "makefil": [1735, 1759, 1764, 1774, 1808], "malmqvist": [1734, 1789], "manag": [265, 328, 357, 620, 1206, 1704, 1737, 1738, 1740, 1748, 1767, 1777, 1785, 1794, 1814, 1819, 1824], "manage_git": 1788, "managedmethoderror": [1809, 1827], "mandatori": [0, 781, 1209, 1704, 1754], "mangl": 371, "mani": [0, 2, 100, 148, 285, 287, 336, 338, 377, 389, 586, 659, 660, 1125, 1154, 1206, 1221, 1704, 1714, 1722, 1730, 1738, 1739, 1740, 1742, 1743, 1756, 1757, 1759, 1763, 1768, 1769, 1774, 1779, 1781, 1783, 1790, 1794, 1798, 1799, 1808, 1810, 1817, 1824, 1828, 1832, 1833, 1837, 1838, 1840, 1842, 1844], "manifest": [1757, 1841], "manifold": 0, "manipul": [100, 148, 265, 1738, 1740, 1743, 1759, 1790, 1794, 1799, 1801, 1808, 1824, 1833, 1838], "manner": [446, 484, 523, 547, 1199, 1200, 1202, 1203, 1704, 1730, 1743, 1757, 1789, 1838], "manr": [635, 652, 656, 1206, 1704], "manual": [2, 150, 295, 300, 301, 302, 303, 318, 319, 381, 382, 574, 637, 671, 743, 1049, 1050, 1206, 1208, 1218, 1698, 1703, 1704, 1710, 1713, 1714, 1735, 1738, 1743, 1744, 1745, 1755, 1756, 1757, 1766, 1770, 1771, 1772, 1775, 1781, 1788, 1792, 1793, 1799, 1800, 1801, 1802, 1808, 1814, 1815, 1826, 1828, 1833, 1837, 1838, 1842, 1844], "manuscript": 1763, "manybodi": [1768, 1794], "manybodycomput": [1768, 1794], "map": [11, 84, 106, 150, 176, 212, 255, 262, 263, 1226, 1229, 1346, 1431, 1432, 1434, 1704, 1738, 1743, 1777, 1833], "maqz": 1733, "mar": [1694, 1707, 1731, 1732, 1733, 1738], "march": [2, 1738, 1743], "mark": [2, 87, 635, 1206, 1704, 1739, 1742, 1743, 1756, 1757, 1781, 1785, 1798, 1819], "mark_file_for_retent": 87, "marker": [2, 106, 1738, 1743, 1833], "marqu": [1777, 1780, 1781], "marshal": [106, 1692, 1752], "mart": 1734, "martin": [1734, 1740, 1792], "martinez": [1734, 1750], "mask": 335, "mass": [106, 307, 386, 389, 390, 399, 618, 677, 707, 1206, 1704, 1706, 1714, 1738, 1768, 1772, 1782, 1799, 1828, 1833, 1842, 1844], "mass_numb": 106, "massiv": 1824, "master": [372, 1737, 1738, 1748, 1764, 1781, 1782, 1785, 1786, 1788, 1828, 1833, 1840], "masterluke87": 1738, "mat": [2, 363, 1714, 1797, 1842], "mat2arr": 1833, "mat_num_column_print": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "match": [2, 106, 267, 278, 299, 349, 380, 1231, 1633, 1636, 1704, 1711, 1713, 1714, 1738, 1752, 1757, 1759, 1768, 1785, 1786, 1788, 1795, 1796, 1809, 1817, 1833, 1838, 1842, 1843], "materi": 1837, "math": [1734, 1738, 1748, 1777, 1798, 1808], "math_root": 1738, "mathbb": [1757, 1838], "mathbf": [0, 377, 1750, 1763, 1776, 1837, 1841], "mathcal": [284, 1740, 1741], "mathemat": [1763, 1764, 1824, 1837], "mathjax": 1764, "mathlib": 1738, "mathopenmp": 1738, "mathrm": [322, 368, 369, 377, 1750, 1756, 1757, 1838], "matirx": 92, "matlab": [1757, 1810], "matplotlib": [0, 1761], "matric": [2, 16, 18, 75, 76, 84, 100, 103, 148, 160, 182, 217, 259, 356, 575, 664, 686, 828, 855, 1035, 1198, 1206, 1218, 1225, 1231, 1268, 1270, 1560, 1661, 1704, 1714, 1743, 1753, 1770, 1771, 1775, 1789, 1797, 1798, 1810, 1823, 1833, 1838, 1841, 1842], "matrix": [0, 1, 2, 7, 11, 13, 16, 21, 27, 30, 31, 32, 33, 34, 35, 36, 37, 38, 40, 41, 42, 44, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 68, 70, 73, 74, 75, 76, 78, 84, 90, 92, 94, 95, 97, 101, 103, 104, 105, 106, 108, 110, 111, 112, 115, 118, 119, 128, 130, 131, 133, 135, 137, 139, 140, 143, 147, 148, 150, 151, 152, 171, 174, 176, 182, 183, 184, 207, 212, 241, 242, 244, 255, 259, 262, 263, 267, 295, 306, 307, 314, 318, 319, 321, 329, 331, 335, 342, 350, 363, 408, 416, 417, 477, 509, 575, 592, 596, 609, 618, 623, 627, 637, 665, 667, 678, 679, 684, 697, 707, 743, 810, 811, 828, 836, 845, 852, 872, 874, 886, 888, 903, 904, 909, 910, 926, 972, 977, 994, 998, 1135, 1138, 1171, 1172, 1179, 1180, 1197, 1198, 1200, 1201, 1206, 1208, 1210, 1212, 1213, 1214, 1215, 1221, 1222, 1225, 1226, 1229, 1231, 1296, 1362, 1369, 1370, 1411, 1551, 1567, 1568, 1600, 1602, 1663, 1704, 1708, 1711, 1714, 1724, 1740, 1743, 1753, 1755, 1756, 1757, 1763, 1766, 1770, 1771, 1772, 1775, 1776, 1780, 1785, 1788, 1791, 1794, 1798, 1799, 1800, 1802, 1812, 1814, 1817, 1821, 1823, 1824, 1827, 1828, 1829, 1832, 1833, 1836, 1837, 1838, 1841, 1842, 1844], "matrix1": [1714, 1842], "matrix2": [1714, 1842], "matrix_irrep": 16, "matrixfactori": [16, 103, 1827], "matt": [835, 1210, 1704], "matter": [1714, 1743, 1788, 1801, 1833, 1842], "matthew": [1755, 1789], "matz": 1733, "max": [8, 64, 310, 361, 683, 722, 1206, 1207, 1230, 1231, 1439, 1444, 1504, 1576, 1638, 1704, 1733, 1743, 1794, 1802, 1828, 1837, 1838, 1841, 1844], "max_": [1226, 1324, 1704, 1802], "max_am": [8, 158], "max_am_eri": [1738, 1783], "max_attempt": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "max_ccd_diisvec": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "max_diis_vector": [14, 128, 130, 145], "max_dim": [154, 155, 156, 157], "max_disp_g_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "max_dist": [299, 349], "max_energy_g_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "max_force_g_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "max_funct": [7, 105], "max_function_per_shel": 8, "max_holes_i": [794, 1210, 1704], "max_i": [794, 1210, 1704], "max_it": 84, "max_mem_buf": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "max_mograd_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "max_nbodi": 1794, "max_nprimit": 8, "max_num_vec": [0, 2, 808, 861, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "max_parts_iv": [794, 1210, 1704], "max_point": [7, 105, 138], "max_radial_mo": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "max_ss_siz": [342, 356], "max_vec": 321, "max_width": [313, 364], "maxdepth": 1786, "maxim": [0, 313, 364, 575, 763, 764, 766, 768, 1206, 1209, 1704, 1743, 1752, 1754, 1832], "maximilian": 1749, "maximum": [1, 8, 18, 64, 100, 105, 106, 138, 299, 321, 322, 324, 325, 335, 342, 349, 356, 377, 404, 405, 431, 447, 485, 524, 548, 573, 580, 582, 583, 585, 595, 607, 633, 646, 684, 689, 723, 734, 741, 755, 782, 785, 789, 790, 796, 797, 798, 805, 811, 814, 842, 847, 852, 853, 877, 878, 879, 890, 893, 894, 911, 914, 930, 932, 933, 950, 966, 974, 1003, 1007, 1031, 1060, 1062, 1066, 1080, 1114, 1139, 1141, 1176, 1185, 1197, 1199, 1200, 1202, 1203, 1206, 1207, 1208, 1210, 1211, 1213, 1214, 1215, 1218, 1219, 1221, 1222, 1224, 1225, 1226, 1228, 1229, 1230, 1231, 1235, 1243, 1250, 1263, 1266, 1267, 1269, 1286, 1325, 1326, 1340, 1343, 1347, 1349, 1350, 1351, 1366, 1391, 1408, 1416, 1444, 1456, 1457, 1497, 1515, 1516, 1547, 1575, 1577, 1592, 1607, 1625, 1639, 1645, 1652, 1704, 1714, 1738, 1742, 1746, 1749, 1755, 1757, 1759, 1768, 1771, 1774, 1785, 1788, 1789, 1794, 1798, 1802, 1828, 1833, 1837, 1838, 1839, 1841, 1842, 1844], "maximum_block_s": 1817, "maxit": [0, 2, 335, 342, 356, 689, 1206, 1490, 1554, 1574, 1704, 1730, 1733, 1735, 1739, 1740, 1743, 1746, 1747, 1748, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "maxr": 6, "maxscheur": 1738, "mayer": [1685, 1776, 1794, 1799], "mayer_indic": [111, 1799], "mayhal": 1734, "mb": [374, 395, 650, 651, 1206, 1704, 1714, 1743, 1748, 1750, 1757, 1767, 1828, 1832, 1842, 1844], "mb3lyp": [295, 318, 319, 1695, 1698, 1700, 1703, 1758, 1766, 1800], "mb_comput": 1794, "mbe": 1794, "mbi": [352, 1140, 1141, 1142, 1143, 1144, 1221, 1685, 1704, 1714, 1776, 1799, 1842], "mbis_charg": [111, 1799], "mbis_d_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mbis_maxit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mbis_pruning_schem": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mbis_radial_point": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mbis_spherical_point": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mbis_volume_ratio": [111, 1799], "mbox": [1753, 1838], "mbpt": [665, 708, 1206, 1230, 1451, 1704, 1743, 1756, 1763, 1776, 1798, 1837], "mc": 1794, "mc_level_idx": 1794, "mc_level_lbl": 1794, "mcalexand": [1781, 1786], "mccammon": 1734, "mcgibbon": [1734, 1806], "mcmurchi": 1817, "mcscf": [295, 314, 400, 810, 849, 851, 853, 856, 857, 1102, 1127, 1128, 1164, 1165, 1187, 1221, 1673, 1704, 1705, 1709, 1714, 1755, 1766, 1776, 1777, 1790, 1791, 1810, 1829, 1838, 1842], "mcscf1": [1714, 1842], "mcscf2": [1714, 1842], "mcscf3": [1714, 1842], "mcscf_algorithm": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mcscf_ci_cleanup": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mcscf_diis_error_typ": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mcscf_diis_freq": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mcscf_diis_max_vec": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mcscf_diis_start": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mcscf_dpd_cleanup": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mcscf_e_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mcscf_guess": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mcscf_max_rot": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mcscf_maxit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mcscf_object": 13, "mcscf_r_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mcscf_rotat": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mcscf_so_start_": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mcscf_so_start_grad": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mcscf_type": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mctc": [267, 1738, 1759, 1774], "md": [1738, 1788], "mdi": [312, 1738], "mdi_librari": 1738, "mdyne": [386, 1772], "me": [1706, 1737, 1738, 1837], "mean": [2, 265, 285, 287, 329, 336, 338, 433, 466, 507, 514, 592, 601, 603, 611, 616, 638, 655, 665, 669, 671, 675, 681, 688, 693, 708, 813, 935, 992, 1199, 1200, 1201, 1202, 1206, 1210, 1213, 1215, 1225, 1226, 1231, 1242, 1296, 1323, 1563, 1568, 1704, 1738, 1740, 1742, 1743, 1746, 1748, 1752, 1753, 1755, 1756, 1757, 1759, 1768, 1770, 1776, 1785, 1788, 1794, 1798, 1801, 1802, 1809, 1810, 1828, 1829, 1837, 1838, 1844], "meaning": [1714, 1770, 1837, 1842, 1844], "meaningless": 1752, "meanso": [693, 1206, 1704], "meant": [2, 285, 336, 1226, 1371, 1704, 1788, 1844], "meanwhil": 1753, "measur": [2, 1174, 1222, 1704, 1743, 1750, 1776, 1838], "mebi": 1821, "mech": 390, "mechan": [106, 1711, 1714, 1730, 1767, 1776, 1782, 1786, 1817, 1824, 1833, 1842], "media": 1738, "mediat": 370, "medium": [1740, 1756, 1757, 1803, 1837], "meet": [1808, 1825], "mega": 1821, "meh": 1837, "mem": [374, 395], "mem_df": [1166, 1221, 1231, 1507, 1609, 1620, 1704, 1838], "member": [62, 63, 79, 82, 83, 122, 126, 135, 265, 293, 327, 833, 1210, 1692, 1704, 1740, 1743, 1752, 1772, 1794, 1817, 1823, 1832, 1833], "members_descript": [1692, 1752], "memdfjk": 1827, "meme": [1692, 1743, 1752], "memori": [0, 84, 92, 103, 171, 176, 198, 212, 230, 243, 250, 255, 262, 263, 305, 342, 353, 374, 395, 433, 434, 463, 466, 503, 507, 514, 650, 651, 714, 727, 765, 811, 837, 882, 888, 902, 1051, 1095, 1199, 1200, 1201, 1202, 1206, 1207, 1208, 1209, 1210, 1212, 1218, 1219, 1225, 1230, 1231, 1242, 1480, 1481, 1482, 1508, 1576, 1618, 1620, 1624, 1704, 1714, 1734, 1742, 1743, 1753, 1754, 1755, 1756, 1757, 1763, 1767, 1770, 1771, 1777, 1781, 1786, 1788, 1798, 1802, 1810, 1817, 1819, 1824, 1828, 1837, 1838, 1841, 1842, 1844], "memory_estim": 92, "mennucci": 1734, "mention": [0, 1738, 1755, 1757, 1767, 1771, 1785, 1833, 1837, 1841], "menu": [1738, 1748, 1788], "merg": [2, 1736, 1747, 1767, 1786, 1788, 1814, 1824], "merge_stdsuit": 1788, "merz": [1692, 1752], "mess": 1838, "messag": [2, 266, 268, 269, 270, 271, 276, 277, 278, 279, 280, 285, 287, 313, 336, 338, 364, 383, 656, 679, 1206, 1704, 1738, 1746, 1748, 1750, 1767, 1785, 1788, 1809, 1828, 1844], "messagepack": [1738, 1767], "messi": 1767, "met": [106, 1079, 1086, 1219, 1704, 1743, 1771, 1838, 1841], "meta": [295, 318, 319, 400, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1703, 1714, 1757, 1766, 1800, 1838, 1841, 1842], "meta_cutoff": 80, "metadata": [1738, 1740, 1786, 1788, 1794, 1817], "metal": [685, 1206, 1704, 1714, 1757, 1837, 1838, 1842], "metameta": [1740, 1772, 1794], "metapackag": 1748, "meter": 1706, "methan": [1232, 1666, 1692, 1704, 1714, 1743, 1752, 1842, 1843], "method": [1, 2, 3, 5, 6, 7, 8, 9, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 26, 27, 29, 30, 61, 62, 64, 66, 68, 70, 73, 74, 75, 76, 77, 78, 80, 81, 84, 86, 87, 88, 89, 90, 91, 92, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 108, 110, 111, 112, 114, 115, 118, 119, 120, 128, 130, 131, 132, 133, 137, 138, 139, 140, 141, 143, 144, 145, 147, 148, 149, 150, 183, 184, 265, 266, 267, 268, 275, 284, 292, 295, 296, 300, 301, 302, 312, 314, 315, 316, 318, 319, 321, 322, 323, 324, 325, 326, 327, 329, 342, 343, 352, 373, 378, 381, 382, 391, 444, 446, 474, 482, 484, 521, 523, 545, 547, 579, 584, 586, 615, 635, 647, 652, 655, 662, 665, 666, 730, 739, 742, 762, 792, 811, 833, 858, 874, 897, 946, 949, 959, 960, 975, 1070, 1078, 1158, 1199, 1200, 1202, 1203, 1206, 1208, 1209, 1211, 1213, 1214, 1219, 1221, 1224, 1225, 1230, 1231, 1236, 1254, 1255, 1279, 1281, 1283, 1285, 1291, 1292, 1294, 1443, 1569, 1615, 1643, 1695, 1698, 1699, 1700, 1701, 1703, 1704, 1711, 1714, 1718, 1730, 1733, 1734, 1738, 1739, 1740, 1742, 1743, 1744, 1745, 1751, 1752, 1754, 1755, 1756, 1757, 1758, 1759, 1763, 1764, 1766, 1767, 1768, 1769, 1770, 1772, 1774, 1776, 1777, 1779, 1780, 1782, 1785, 1789, 1791, 1793, 1794, 1795, 1799, 1800, 1802, 1806, 1810, 1817, 1818, 1819, 1824, 1826, 1828, 1829, 1832, 1833, 1836, 1837, 1839, 1841, 1842, 1844], "method_str": 1794, "method_typ": 268, "methodnam": 1809, "methodologi": 1770, "methoxi": 1833, "methyl": [1714, 1757, 1770, 1802, 1833, 1842], "methylen": [1714, 1828, 1842, 1844], "methyloxiran": [1714, 1841, 1842], "methylthiophen": 1802, "metric": [75, 103, 1055, 1056, 1058, 1061, 1218, 1231, 1509, 1511, 1704, 1757, 1802, 1838, 1841], "metric_inv": 75, "mev": 1706, "mew": 1734, "mezei": [117, 664, 1061, 1206, 1218, 1704], "mg": [947, 1126, 1213, 1221, 1225, 1282, 1704, 1707, 1731, 1762, 1798], "mgga": [138, 1714, 1842], "mgga_ms0": [295, 318, 319, 1695, 1698, 1702, 1703, 1758, 1766, 1800], "mgga_ms1": [295, 318, 319, 1695, 1698, 1702, 1703, 1758, 1766, 1800], "mgga_ms2": [295, 318, 319, 1695, 1698, 1702, 1703, 1758, 1766, 1800], "mgga_ms2h": [295, 318, 319, 1695, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "mgga_mv": [295, 318, 319, 1695, 1698, 1702, 1703, 1758, 1766, 1800], "mgga_mv2h": [295, 318, 319, 1695, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "mgga_mvsh": [295, 318, 319, 1695, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "mhz": 1706, "mib": [374, 395, 1786, 1821, 1832], "micael": 1784, "micavx512": 1839, "michael": [0, 1, 106, 1754], "micro": [741, 1208, 1704, 1838], "microiter": [1231, 1644, 1645, 1646, 1647, 1704, 1753, 1838], "microscop": [368, 369], "mid": 1790, "midbond": [1692, 1714, 1752, 1837, 1842], "midwai": 1838, "might": [0, 150, 284, 605, 627, 786, 1125, 1206, 1210, 1221, 1704, 1737, 1740, 1753, 1754, 1755, 1767, 1770, 1771, 1789, 1817, 1821, 1828, 1829, 1833, 1837, 1844], "mih": [1224, 1683, 1792], "mikhalev": [1734, 1777, 1780], "mildli": 1786, "mileston": 1788, "miller": [635, 652, 1206, 1704], "millibohr": [634, 1206, 1704], "mimic": 334, "min": [1226, 1231, 1354, 1503, 1704, 1738, 1802], "min_": 1763, "min_ccd_diisvec": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "min_tim": [154, 155, 156, 157, 158, 159], "min_width": [313, 364], "minao": [1063, 1218, 1704, 1707, 1731], "minao_basi": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mind": [1737, 1738, 1786, 1788, 1802, 1810, 1828, 1844], "mindepth": 1786, "minessota": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "mini": 1738, "miniconda": [1736, 1737, 1738, 1746, 1749, 1759, 1762, 1765, 1767, 1773, 1774, 1775, 1782, 1783, 1784, 1788, 1803, 1806, 1807, 1839], "miniconda2": 1748, "miniconda3": 1748, "minim": [150, 295, 313, 318, 319, 364, 510, 635, 652, 1201, 1206, 1695, 1698, 1700, 1703, 1704, 1714, 1734, 1737, 1738, 1743, 1748, 1752, 1754, 1756, 1758, 1760, 1762, 1763, 1766, 1767, 1776, 1790, 1798, 1800, 1802, 1828, 1829, 1837, 1842, 1844], "minima": [635, 652, 1206, 1231, 1538, 1704, 1790], "minimum": [282, 284, 332, 496, 635, 652, 735, 815, 841, 903, 904, 912, 1200, 1206, 1208, 1210, 1212, 1213, 1225, 1226, 1228, 1230, 1231, 1251, 1354, 1363, 1382, 1455, 1458, 1462, 1478, 1517, 1548, 1550, 1602, 1646, 1704, 1740, 1742, 1743, 1749, 1756, 1757, 1761, 1768, 1783, 1785, 1788, 1802, 1832, 1835, 1837, 1838], "minimz": 1817, "mininum": [415, 740, 905, 1053, 1198, 1208, 1212, 1218, 1224, 1234, 1704], "minix": [1694, 1707, 1731, 1732, 1774], "minnesota": [295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "minor": [279, 1770], "mint": [400, 1704, 1705, 1714, 1738, 1785, 1786, 1788, 1842], "mints1": [1714, 1833, 1842], "mints10": [1714, 1842], "mints12": [1714, 1842], "mints13": 1726, "mints14": 1726, "mints15": [1714, 1842], "mints2": [283, 333, 1714, 1726, 1730, 1842], "mints3": [100, 1714, 1842], "mints4": [1714, 1833, 1842], "mints5": [1711, 1714, 1743, 1842], "mints6": [1714, 1833, 1842], "mints8": [1714, 1842], "mints9": [283, 333, 1714, 1726, 1842], "mintshelp": [14, 128, 130, 145, 150, 295, 1714, 1766, 1801, 1809, 1827, 1842], "mintz": 1781, "minu": [1126, 1221, 1704, 1843], "minut": [2, 1736, 1764, 1767], "miracl": 1743, "mirror": [87, 106, 1788, 1833], "misc": [1692, 1752, 1780, 1787], "miscellan": [1767, 1777, 1819, 1827], "misformat": [374, 395], "misha": 1738, "misiewicz": [1734, 1781], "mismatch": 1821, "misquitta": [1734, 1837], "miss": [1730, 1738, 1770, 1771, 1817, 1829, 1833, 1837], "missing_enabled_return": [106, 1768], "missing_enabled_return_efp": [106, 1768], "missing_enabled_return_qm": [106, 1768], "missingmethoderror": 1827, "mitrushenkov": [811, 833, 1210, 1704, 1755], "mix": [0, 1, 2, 103, 284, 615, 729, 792, 860, 957, 1206, 1208, 1213, 1225, 1229, 1231, 1289, 1405, 1499, 1564, 1692, 1694, 1704, 1706, 1707, 1714, 1722, 1731, 1732, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "mixed4": [0, 1, 2, 875, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mixedcas": 1835, "mixtur": [380, 1730, 1768, 1798, 1817, 1833, 1838, 1844], "mk": [295, 653, 1206, 1229, 1398, 1704, 1714, 1766, 1777, 1790, 1842], "mkdir": [1735, 1767], "mkl": [1738, 1748, 1756, 1767, 1771], "mkl_num_thread": 1767, "mkl_root": 1738, "mklvar": 1738, "mm": [1228, 1378, 1382, 1704, 1749, 1776, 1790], "mn": [1707, 1731], "mn12": [295, 318, 319, 1695, 1697, 1698, 1700, 1701, 1702, 1703, 1758, 1766, 1800], "mn15": [295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "mo": [2, 99, 103, 115, 130, 150, 286, 314, 337, 430, 440, 457, 461, 497, 562, 566, 568, 601, 727, 926, 946, 947, 1145, 1175, 1186, 1199, 1200, 1204, 1205, 1206, 1208, 1213, 1221, 1222, 1225, 1270, 1279, 1281, 1282, 1704, 1706, 1707, 1708, 1714, 1731, 1742, 1763, 1781, 1785, 1791, 1798, 1808, 1810, 1829, 1838, 1841, 1842], "mo_diis_num_vec": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mo_elec_dip_deriv1": 103, "mo_erf_eri": 103, "mo_eri": 103, "mo_ext": [111, 150, 1799], "mo_f12": 103, "mo_f12_double_commut": 103, "mo_f12_squar": 103, "mo_f12g12": 103, "mo_maxit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mo_oei_deriv1": 103, "mo_oei_deriv2": 103, "mo_overlap_half_deriv1": 103, "mo_read": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mo_spin_eri": 103, "mo_step_max": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mo_tei_deriv1": 103, "mo_tei_deriv2": 103, "mo_transform": 103, "mo_writ": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mo_x_unit": 1706, "moabcd": [621, 680, 1206, 1704], "mode": [2, 153, 267, 282, 283, 292, 300, 301, 302, 332, 333, 343, 384, 386, 388, 399, 570, 590, 603, 611, 616, 632, 633, 634, 652, 656, 707, 1027, 1206, 1217, 1226, 1231, 1313, 1316, 1500, 1620, 1704, 1738, 1743, 1750, 1752, 1759, 1767, 1777, 1779, 1800, 1803, 1828, 1831, 1832, 1840, 1844], "model": [2, 265, 268, 284, 295, 322, 325, 532, 540, 555, 766, 769, 1202, 1203, 1209, 1226, 1227, 1228, 1338, 1342, 1672, 1686, 1687, 1695, 1697, 1698, 1700, 1701, 1704, 1714, 1734, 1738, 1740, 1742, 1743, 1752, 1755, 1757, 1758, 1759, 1764, 1766, 1767, 1768, 1772, 1776, 1780, 1781, 1782, 1790, 1794, 1802, 1804, 1808, 1824, 1827, 1842], "modelchem": 1794, "modern": [1231, 1629, 1704, 1734, 1757, 1817, 1821], "modest": [667, 1206, 1704, 1763, 1837], "modhuckel": [1231, 1563, 1704, 1838], "modif": [0, 2, 265, 329, 664, 1206, 1704, 1740, 1747, 1760, 1767, 1771, 1794, 1823, 1824, 1831, 1838], "modifi": [329, 351, 377, 539, 609, 761, 774, 1203, 1206, 1209, 1225, 1231, 1279, 1555, 1704, 1710, 1738, 1742, 1743, 1747, 1754, 1757, 1759, 1767, 1776, 1783, 1784, 1798, 1804, 1819, 1828, 1836, 1837, 1838, 1844], "moduel": 1767, "modul": [0, 1, 2, 11, 114, 150, 188, 195, 197, 200, 208, 209, 210, 213, 219, 220, 226, 227, 228, 235, 236, 246, 248, 249, 260, 261, 267, 268, 272, 295, 296, 326, 327, 350, 355, 358, 370, 372, 375, 380, 381, 382, 396, 400, 561, 586, 699, 1078, 1105, 1106, 1107, 1117, 1146, 1147, 1151, 1152, 1158, 1204, 1206, 1219, 1221, 1230, 1463, 1475, 1704, 1711, 1714, 1727, 1730, 1733, 1736, 1740, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1790, 1791, 1792, 1794, 1795, 1797, 1799, 1800, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1815, 1816, 1817, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1829, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "modular": 1819, "module__keyword": 371, "module_nam": [376, 397, 1767], "modulenotfounderror": [1736, 1767], "moduletyp": 358, "mofa": 130, "mofb": 130, "mofeff": 130, "mograd_damp": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mohlyp": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "mohlyp2": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "moieti": 1770, "moint": [621, 641, 668, 680, 682, 1206, 1704], "mointegr": 1808, "mol": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1828, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "mol1": [1692, 1752, 1833], "mol2": [106, 1833], "mol22": [1692, 1752], "molar": [368, 369, 1706], "molar_gas_const": 1706, "molar_mass_const": 1706, "molar_mass_of_carbon_12": 1706, "molar_planck_const": 1706, "molar_planck_constant_times_c": 1706, "molar_volume_of_ideal_gas_27315_k_100_kpa": 1706, "molar_volume_of_ideal_gas_27315_k_101325_kpa": 1706, "molar_volume_of_silicon": 1706, "molden": [2, 104, 150, 287, 338, 388, 424, 934, 995, 1027, 1145, 1170, 1198, 1213, 1215, 1217, 1221, 1231, 1578, 1704, 1746, 1777, 1780, 1823, 1832], "molden1": [1714, 1842], "molden2": [1714, 1842], "molden_format": [2, 287, 338, 388], "molden_normal_mod": [1027, 1217, 1704, 1772], "molden_with_virtu": [0, 1, 2, 150, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "molden_writ": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "moldenwrit": 1827, "moldomain": 1722, "molecul": [0, 2, 8, 29, 68, 73, 76, 100, 150, 191, 240, 243, 265, 267, 275, 281, 283, 284, 288, 289, 291, 293, 295, 296, 297, 300, 301, 302, 303, 304, 308, 312, 314, 315, 316, 317, 318, 319, 323, 333, 339, 340, 341, 347, 350, 351, 352, 356, 365, 378, 380, 381, 382, 387, 390, 399, 573, 587, 592, 616, 654, 660, 695, 705, 771, 781, 934, 1025, 1026, 1027, 1048, 1130, 1150, 1206, 1209, 1210, 1213, 1217, 1218, 1221, 1226, 1231, 1232, 1313, 1578, 1620, 1666, 1673, 1692, 1704, 1711, 1714, 1722, 1723, 1726, 1727, 1730, 1734, 1735, 1738, 1739, 1740, 1742, 1743, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1761, 1762, 1763, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1774, 1775, 1777, 1780, 1781, 1785, 1789, 1791, 1792, 1794, 1796, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1809, 1826, 1827, 1828, 1829, 1831, 1836, 1837, 1838, 1841, 1842, 1843, 1844], "molecular": [2, 103, 106, 150, 568, 575, 587, 601, 608, 619, 641, 664, 669, 705, 1206, 1223, 1229, 1230, 1231, 1400, 1437, 1594, 1630, 1704, 1734, 1735, 1738, 1749, 1750, 1752, 1753, 1754, 1757, 1759, 1763, 1767, 1768, 1770, 1776, 1781, 1782, 1783, 1785, 1789, 1790, 1794, 1795, 1798, 1799, 1802, 1803, 1810, 1823, 1824, 1828, 1833, 1835, 1837, 1838, 1841, 1844], "molecular_charg": [106, 1768], "molecular_mass": 390, "molecular_multipl": [106, 1768], "moleculargrid": [29, 1827], "molecule_nam": 205, "molinit": 1768, "molinst": 106, "moller": [957, 1213, 1225, 1289, 1704], "molpars": 1833, "molpro": [1226, 1324, 1704, 1717, 1802], "molrec": 106, "mols_align": 106, "molschema": 106, "molssi": [312, 372, 1738, 1833], "molstr": 106, "molutil": 106, "mom": [84, 1231, 1579, 1580, 1581, 1704, 1706, 1714, 1838, 1842], "mom_excited_": 84, "mom_occ": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mom_performed_": 84, "mom_start": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mom_vir": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "moment": [0, 103, 317, 365, 368, 369, 377, 608, 610, 615, 669, 817, 1078, 1139, 1206, 1210, 1219, 1221, 1228, 1231, 1380, 1384, 1385, 1387, 1389, 1391, 1657, 1704, 1714, 1724, 1743, 1749, 1753, 1755, 1757, 1763, 1764, 1770, 1771, 1776, 1798, 1799, 1817, 1838, 1841, 1842], "momenta": 1733, "momentum": [2, 4, 8, 81, 89, 103, 285, 310, 336, 361, 1157, 1221, 1704, 1710, 1714, 1730, 1736, 1754, 1767, 1783, 1810, 1817, 1842], "momom": 1711, "mon": 1708, "monitor": [1743, 1788, 1802], "monkhorst": [1734, 1829], "mono": [1752, 1782], "monoa": 1752, "monoa_wfn": 237, "monoatom": 1782, "monob": 1752, "monob_wfn": 237, "monom": [75, 804, 1210, 1230, 1437, 1473, 1474, 1704, 1711, 1714, 1752, 1770, 1776, 1790, 1794, 1806, 1828, 1835, 1842, 1844], "monomera": 1837, "monomerb": 1837, "montag": 1750, "month": [1730, 1733, 1804], "more": [0, 1, 2, 106, 138, 150, 195, 197, 284, 285, 295, 303, 314, 318, 319, 336, 476, 550, 569, 589, 593, 644, 666, 671, 726, 765, 794, 875, 1097, 1125, 1153, 1200, 1203, 1206, 1208, 1209, 1210, 1220, 1221, 1222, 1224, 1226, 1230, 1231, 1236, 1305, 1443, 1549, 1681, 1682, 1695, 1698, 1699, 1703, 1704, 1708, 1714, 1730, 1738, 1740, 1742, 1743, 1748, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1763, 1766, 1767, 1770, 1771, 1774, 1775, 1781, 1782, 1783, 1785, 1786, 1788, 1791, 1792, 1794, 1795, 1800, 1802, 1803, 1804, 1806, 1810, 1817, 1819, 1821, 1822, 1828, 1829, 1832, 1833, 1835, 1837, 1838, 1842, 1844], "moread": [638, 1206, 1704], "morel": [1734, 1750], "moreov": [573, 616, 647, 1206, 1704, 1759, 1798, 1810, 1817], "morph": [1230, 1476, 1704], "mors": [635, 652, 1206, 1704], "mospac": [90, 1827], "most": [0, 1, 2, 150, 159, 295, 314, 393, 601, 660, 697, 811, 1206, 1210, 1230, 1231, 1444, 1690, 1704, 1730, 1733, 1738, 1739, 1740, 1742, 1743, 1753, 1755, 1756, 1757, 1764, 1766, 1767, 1770, 1771, 1772, 1776, 1781, 1789, 1790, 1791, 1792, 1793, 1798, 1800, 1801, 1802, 1809, 1810, 1817, 1823, 1824, 1828, 1829, 1832, 1833, 1834, 1837, 1838, 1841, 1843, 1844], "mostli": [1692, 1714, 1738, 1752, 1757, 1785, 1842], "moszynski": [1734, 1781, 1828, 1837, 1844], "motif": 1770, "motion": [162, 295, 318, 319, 381, 382, 603, 1200, 1206, 1704, 1755, 1766, 1800, 1826], "motiv": [1757, 1817, 1824], "move": [106, 288, 289, 339, 340, 1736, 1737, 1738, 1748, 1767, 1786, 1808, 1823, 1835, 1838], "move_atom": 8, "move_to_com": 106, "movement": 1797, "mowrit": 1827, "moxi": 1841, "mp": [0, 284, 295, 318, 319, 381, 382, 862, 864, 996, 1210, 1215, 1695, 1696, 1698, 1700, 1704, 1714, 1739, 1740, 1743, 1744, 1745, 1746, 1758, 1766, 1771, 1776, 1781, 1800, 1826, 1842], "mp10": 1755, "mp2": [0, 2, 76, 95, 138, 178, 265, 284, 286, 294, 295, 296, 300, 301, 302, 303, 318, 319, 337, 345, 381, 382, 446, 448, 449, 450, 453, 459, 460, 484, 568, 694, 731, 792, 851, 899, 902, 917, 935, 936, 937, 938, 939, 963, 964, 966, 971, 972, 976, 1081, 1082, 1083, 1084, 1085, 1089, 1094, 1146, 1147, 1199, 1200, 1204, 1206, 1208, 1210, 1212, 1213, 1214, 1219, 1221, 1225, 1229, 1230, 1254, 1255, 1402, 1418, 1459, 1461, 1462, 1475, 1481, 1669, 1670, 1671, 1674, 1675, 1676, 1680, 1683, 1684, 1688, 1689, 1694, 1704, 1711, 1714, 1725, 1727, 1728, 1730, 1732, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1752, 1755, 1757, 1766, 1768, 1769, 1771, 1772, 1775, 1776, 1777, 1780, 1781, 1790, 1794, 1798, 1800, 1801, 1802, 1809, 1826, 1828, 1832, 1834, 1838, 1842, 1844], "mp2_amp_typ": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mp2_amps_print": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mp2_ccsd": [1229, 1417, 1704], "mp2_ccsd_method": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mp2_dft": 1757, "mp2_guess": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mp2_os_scal": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mp2_scale_o": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mp2_scale_ss": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mp2_sos_scal": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mp2_sos_scale2": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mp2_ss_scale": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mp2_type": [0, 1, 2, 381, 382, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mp2d": [267, 295, 1695, 1696, 1698, 1700, 1738, 1758, 1759, 1766], "mp2fit": [1756, 1838], "mp2mp2": [295, 1695, 1696, 1698, 1700, 1758, 1766], "mp2p5": [1714, 1842], "mp2p75_corl": 1743, "mp3": [0, 284, 295, 307, 318, 319, 1090, 1147, 1219, 1221, 1670, 1675, 1680, 1684, 1704, 1711, 1714, 1739, 1740, 1743, 1744, 1745, 1766, 1771, 1772, 1776, 1779, 1781, 1798, 1800, 1809, 1834, 1842], "mp4": [190, 284, 295, 318, 319, 664, 665, 1073, 1091, 1147, 1206, 1219, 1221, 1670, 1680, 1704, 1711, 1739, 1740, 1743, 1744, 1745, 1766, 1776, 1777, 1781, 1790, 1800], "mp5": [318, 319, 1800], "mp7": [295, 1766], "mp_type": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mpcc": 1738, "mpfr": 1738, "mpi": [1231, 1634, 1704], "mpl": 106, "mpn": [0, 1, 2, 295, 862, 1147, 1213, 1221, 1225, 1673, 1675, 1684, 1704, 1714, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "mpn_order_sav": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mpn_schmidt": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mpn_wigner": [0, 1, 2, 862, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mpqc": 100, "mpw1b95": [295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "mpw1k": [295, 318, 319, 1695, 1698, 1700, 1703, 1758, 1766, 1800], "mpw1lyp": [295, 318, 319, 1695, 1697, 1698, 1700, 1703, 1758, 1766, 1800], "mpw1pbe": [295, 318, 319, 1695, 1698, 1700, 1703, 1758, 1766, 1800], "mpw1pw": [295, 318, 319, 1695, 1697, 1698, 1700, 1703, 1758, 1766, 1800], "mpw3lyp": [295, 318, 319, 1695, 1698, 1700, 1703, 1758, 1766, 1800], "mpw3pw": [295, 318, 319, 1695, 1698, 1700, 1703, 1758, 1766, 1800], "mpwb1k": [295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "mpwlyp1m": [295, 318, 319, 1695, 1698, 1700, 1703, 1758, 1766, 1800], "mpwlyp1w": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "mpwpw": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "mr": [653, 1206, 1704, 1792], "mrcc": [216, 217, 295, 400, 586, 612, 642, 653, 1158, 1206, 1221, 1229, 1240, 1398, 1688, 1704, 1705, 1709, 1738, 1739, 1740, 1742, 1755, 1766, 1767, 1776, 1777, 1780, 1790, 1793, 1842], "mrcc_level": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mrcc_method": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mrcc_num_doublet_root": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mrcc_num_singlet_root": [0, 1, 2, 1239, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mrcc_num_triplet_root": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mrcc_omp_num_thread": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mrcc_restart": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "mrccsd": [284, 1714, 1740, 1781, 1829, 1842], "mrccsdt": [284, 1229, 1403, 1704, 1740, 1781, 1792], "mrpt": [1688, 1776], "mrpt2": [1714, 1781, 1829, 1842], "ms0": [0, 1, 2, 833, 884, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ms2": [2, 286, 298, 337, 348], "msd": [943, 1213, 1225, 1279, 1704, 1798], "msg": [269, 271, 278, 280], "msgpack": 1738, "msie": 1757, "msvp": [1694, 1707, 1731, 1732, 1733, 1774], "mtd": [1685, 1714, 1776, 1809, 1842], "mtd_typd": 1809, "mtd_type": 1809, "mtdimer": 1802, "mtol": [106, 1768], "mtzvp": [1694, 1707, 1731, 1732, 1733, 1774], "mtzvpp": [1694, 1707, 1731, 1732, 1733, 1774], "mu": [377, 386, 1750, 1757, 1772, 1829, 1836, 1838, 1841], "mu_": 1841, "mu_1": 1829, "mu_2": 1829, "much": [2, 106, 138, 150, 279, 314, 386, 647, 1206, 1230, 1231, 1455, 1556, 1704, 1738, 1743, 1754, 1755, 1756, 1757, 1759, 1763, 1764, 1770, 1771, 1772, 1774, 1786, 1791, 1795, 1804, 1809, 1810, 1817, 1821, 1824, 1828, 1833, 1837, 1838, 1844], "mukherje": [295, 653, 1206, 1704, 1734, 1766, 1829], "muller": [1734, 1774], "mulliken": [106, 983, 1214, 1685, 1704, 1759, 1774, 1776, 1799], "mulliken_charg": [111, 1799], "mult": [106, 1743], "multi": [381, 382, 1210, 1226, 1313, 1673, 1704, 1714, 1755, 1767, 1776, 1777, 1785, 1790, 1794, 1826, 1829, 1833, 1838, 1842], "multiarch": [1748, 1788], "multiconfigur": [295, 1766, 1776, 1829], "multidimension": 1810, "multiexp": [1231, 1534, 1704], "multilevel": [1714, 1794, 1842], "multilin": [313, 364, 366, 379], "multipass": [575, 1206, 1704], "multipl": [2, 8, 100, 106, 182, 259, 327, 335, 390, 575, 620, 654, 837, 884, 997, 1206, 1210, 1215, 1229, 1401, 1704, 1714, 1730, 1738, 1739, 1743, 1746, 1748, 1750, 1756, 1767, 1768, 1770, 1779, 1781, 1782, 1785, 1790, 1794, 1797, 1799, 1801, 1805, 1809, 1810, 1817, 1828, 1829, 1832, 1835, 1838, 1842, 1844], "multiplet": 1837, "multipli": [13, 100, 259, 575, 835, 1202, 1206, 1210, 1704, 1801, 1828, 1844], "multipol": [89, 103, 107, 150, 255, 262, 263, 367, 762, 764, 1097, 1099, 1209, 1220, 1228, 1386, 1388, 1395, 1681, 1704, 1714, 1719, 1738, 1754, 1776, 1777, 1780, 1799, 1817, 1842], "multipole_grad": 103, "multipoleint": [1817, 1827], "multipolepotentialint": 1817, "multipolesymmetri": 1827, "multirefer": [232, 295, 393, 1222, 1229, 1682, 1688, 1756, 1766, 1776, 1781, 1812, 1829, 1838], "multiroot": [655, 1206, 1704], "multistag": [284, 300, 301, 302, 318, 319, 1740, 1772, 1800], "multithread": 1738, "multp": 1785, "muon": 1706, "muon_compton_wavelength": 1706, "muon_compton_wavelength_over_2_pi": 1706, "muon_electron_mass_ratio": 1706, "muon_g_factor": 1706, "muon_mag_mom": 1706, "muon_mag_mom_anomali": 1706, "muon_mag_mom_to_bohr_magneton_ratio": 1706, "muon_mag_mom_to_nuclear_magneton_ratio": 1706, "muon_mass": 1706, "muon_mass_energy_equival": 1706, "muon_mass_energy_equivalent_in_mev": 1706, "muon_mass_in_u": 1706, "muon_molar_mass": 1706, "muon_neutron_mass_ratio": 1706, "muon_proton_mag_mom_ratio": 1706, "muon_proton_mass_ratio": 1706, "muon_tau_mass_ratio": 1706, "mura": [1231, 1534, 1633, 1704, 1838], "must": [2, 100, 106, 150, 267, 303, 314, 335, 342, 356, 383, 389, 399, 550, 569, 573, 577, 593, 601, 614, 622, 637, 660, 665, 681, 690, 694, 709, 711, 712, 830, 861, 1203, 1206, 1210, 1224, 1229, 1238, 1401, 1704, 1714, 1730, 1735, 1738, 1740, 1742, 1743, 1748, 1750, 1752, 1753, 1755, 1757, 1759, 1767, 1774, 1775, 1782, 1788, 1791, 1792, 1794, 1795, 1796, 1799, 1801, 1808, 1809, 1810, 1817, 1828, 1829, 1832, 1833, 1835, 1838, 1842], "muster_modelchem": 1743, "muster_psi4opt": 1743, "muto": 1759, "mv": [288, 289, 339, 340], "mvd1": [677, 1206, 1704], "mvd2": [677, 1206, 1704], "mvg": [1669, 1776], "mx": [1692, 1752], "my": 1737, "my_mo": 1838, "my_pbe0": 1757, "my_str": 1802, "my_unique_nam": 1757, "my_wfn": [1767, 1838], "myba": 1730, "mycalc": [150, 296, 314, 1769, 1791, 1832], "mymodul": 1801, "mymodule__data_fil": 1801, "mymol": 1796, "myplugin": 1808, "myscratch": 1767, "myself": 1737, "myxtplfn_2": [295, 318, 319, 1766, 1800], "m\u00f8ller": 1806, "n": [0, 2, 20, 64, 82, 86, 92, 100, 103, 106, 139, 150, 215, 265, 284, 295, 303, 314, 323, 329, 342, 352, 356, 368, 369, 377, 574, 582, 586, 588, 594, 606, 611, 612, 614, 632, 645, 659, 661, 665, 681, 684, 710, 808, 811, 833, 864, 979, 1147, 1206, 1210, 1214, 1221, 1224, 1226, 1231, 1240, 1323, 1490, 1568, 1668, 1669, 1673, 1675, 1683, 1684, 1685, 1690, 1692, 1704, 1706, 1707, 1714, 1731, 1733, 1734, 1737, 1738, 1739, 1740, 1742, 1743, 1748, 1749, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1763, 1764, 1766, 1767, 1768, 1771, 1775, 1776, 1781, 1785, 1786, 1788, 1791, 1792, 1794, 1798, 1799, 1802, 1803, 1805, 1806, 1810, 1817, 1828, 1829, 1833, 1834, 1836, 1838, 1841, 1842, 1844], "n0": [295, 1766], "n1": [621, 1100, 1206, 1220, 1704, 1775], "n12": [295, 318, 319, 1695, 1697, 1698, 1699, 1700, 1701, 1703, 1758, 1766, 1800], "n2": [621, 1100, 1206, 1220, 1692, 1704, 1712, 1714, 1729, 1752, 1775, 1788, 1842], "n3": [621, 1100, 1206, 1220, 1704, 1775], "n4": [621, 1206, 1704, 1767], "n5": [621, 1206, 1704], "n_": [368, 369, 377, 1759, 1776], "n_atom": 110, "n_data": 110, "n_ecp_cor": 8, "n_ecp_shell_on_cent": 8, "n_frozen_cor": 8, "n_guess": [1, 404, 1197, 1704], "n_pair": 1817, "n_point": 110, "n_site": 103, "na": [1692, 1706, 1707, 1731, 1752], "nabla": [89, 103, 109, 1757, 1817, 1838], "nabla_i": 1838, "nablaint": [1817, 1827], "nacl": [1714, 1842], "nact": 1746, "nacv": [655, 1206, 1704], "naiv": [1231, 1518, 1528, 1704, 1740, 1753, 1757], "nallatom": 106, "nalpha": [11, 150, 1810, 1838], "nalphapi": 150, "name": [0, 2, 8, 16, 27, 62, 63, 64, 68, 73, 79, 80, 82, 83, 84, 88, 92, 96, 100, 101, 106, 111, 115, 122, 126, 135, 138, 148, 150, 202, 221, 222, 223, 225, 226, 252, 265, 267, 268, 283, 284, 288, 289, 290, 292, 295, 296, 297, 298, 300, 301, 302, 304, 306, 307, 314, 315, 316, 318, 319, 320, 326, 331, 333, 339, 340, 343, 346, 347, 348, 350, 355, 358, 371, 372, 373, 381, 382, 391, 392, 393, 394, 679, 934, 993, 1025, 1026, 1027, 1206, 1213, 1215, 1217, 1225, 1227, 1228, 1231, 1254, 1255, 1283, 1294, 1377, 1393, 1578, 1584, 1692, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1709, 1730, 1736, 1739, 1740, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1752, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1764, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1774, 1775, 1776, 1781, 1782, 1787, 1788, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1808, 1809, 1812, 1814, 1822, 1823, 1826, 1828, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1841, 1844], "name_frag": 2, "name_hint": [267, 1759], "namedtupl": 106, "namelist": [599, 1206, 1704], "namespac": [86, 288, 289, 339, 340, 354, 1785, 1808, 1810, 1828, 1844], "nan": [2, 1714, 1757, 1842], "nanohartre": 1838, "nanomet": 377, "nao": [8, 1810], "napthalen": [1692, 1752], "narr": [1738, 1743, 1764], "narrow": [377, 1714, 1742, 1842], "nascimento": 1734, "nat": [106, 267, 386, 387, 388, 389, 399, 1759, 1774, 1776, 1794], "nat_orb": [0, 1, 2, 1084, 1085, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "nat_orbs_t2": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "nat_orbs_t3": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "nat_orbs_v4": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "national_schem": 1750, "nativ": [8, 318, 319, 1722, 1737, 1738, 1748, 1752, 1766, 1772, 1781, 1782, 1797, 1800, 1801, 1802], "native_fil": [265, 1740, 1794], "nativefilesprotocolenum": [265, 1740, 1794], "natom": [100, 103, 106, 1226, 1336, 1704, 1752, 1799, 1802, 1833], "natur": [106, 150, 255, 262, 263, 295, 314, 367, 424, 675, 851, 866, 940, 1000, 1065, 1198, 1206, 1210, 1213, 1215, 1219, 1225, 1230, 1276, 1459, 1460, 1461, 1462, 1704, 1706, 1712, 1714, 1738, 1743, 1746, 1766, 1777, 1781, 1785, 1790, 1791, 1794, 1798, 1799, 1808, 1809, 1824, 1828, 1838, 1841, 1842, 1844], "natural_unit_of_act": 1706, "natural_unit_of_action_in_ev_": 1706, "natural_unit_of_energi": 1706, "natural_unit_of_energy_in_mev": 1706, "natural_unit_of_length": 1706, "natural_unit_of_mass": 1706, "natural_unit_of_momum": 1706, "natural_unit_of_momum_in_mevpc": 1706, "natural_unit_of_tim": 1706, "natural_unit_of_veloc": 1706, "naux": [1675, 1680, 1776], "navig": [1737, 1738, 1788, 1824], "nb": [430, 1199, 1704, 1707, 1731, 1794], "nbasi": 1740, "nbc1": 1743, "nbc10": [1743, 1832, 1835], "nbc100": [1692, 1752], "nbc10a": [1692, 1752], "nbeta": [150, 1810, 1838], "nbetapi": 150, "nbf": [2, 8, 103, 1810], "nblock": 147, "nbo": [150, 1714, 1842], "nbodi": [1714, 1715, 1740, 1743, 1776, 1794, 1831, 1832, 1842, 1844], "nbodies_per_mc_level": 1794, "nbody_level": 1794, "nbody_list": 1794, "nbody_result": 1794, "nbsphinx": 1738, "ncart": 1810, "ncartesian": 81, "ncb31": 1832, "ncbi": 1734, "ncc": [586, 1206, 1704], "nccl": [1231, 1634, 1704], "ncd": 16, "ncenter": 81, "nch": [1714, 1842], "nconda": 1748, "ncprec": 389, "nctu": [2, 285, 296, 336, 1769], "ndarrai": [2, 8, 64, 100, 106, 147, 148, 150, 255, 262, 263, 277, 322, 324, 325, 331, 334, 342, 356, 367, 377, 385, 386, 387, 388, 390, 399, 1740, 1759, 1772, 1774, 1797], "ndb_rgt": 1752, "ndb_rxn": 1752, "ndet": 13, "ndocc": 1838, "ndof": [386, 1772], "ndoub": [1224, 1237, 1704], "ne": [11, 295, 1692, 1707, 1714, 1731, 1743, 1752, 1759, 1763, 1766, 1774, 1828, 1842, 1844], "ne2": [1714, 1828, 1842, 1844], "ne2_geometri": 1828, "ne3": 1759, "nearbi": [1226, 1298, 1704], "nearest": [1776, 1796, 1802], "nearli": 1810, "neatli": 1801, "neccesari": [1829, 1832], "necessari": [2, 86, 430, 935, 1199, 1205, 1213, 1226, 1306, 1704, 1730, 1733, 1738, 1743, 1753, 1755, 1764, 1767, 1779, 1780, 1781, 1788, 1794, 1802, 1808, 1809, 1834, 1835, 1838], "necessarili": [267, 1748, 1755, 1759, 1763, 1781, 1788, 1835], "neck": 1781, "need": [0, 1, 2, 84, 103, 138, 258, 284, 314, 342, 352, 393, 574, 599, 616, 626, 628, 658, 680, 682, 761, 774, 921, 922, 1202, 1206, 1209, 1213, 1229, 1230, 1409, 1464, 1465, 1466, 1704, 1708, 1714, 1730, 1735, 1736, 1737, 1738, 1740, 1743, 1747, 1748, 1750, 1753, 1754, 1757, 1759, 1761, 1763, 1764, 1767, 1770, 1771, 1772, 1776, 1780, 1785, 1786, 1788, 1791, 1797, 1798, 1800, 1801, 1802, 1804, 1808, 1809, 1815, 1817, 1819, 1821, 1822, 1828, 1829, 1832, 1833, 1835, 1836, 1837, 1838, 1841, 1842, 1844], "needn": [1739, 1785], "needs_exchang": [89, 1817], "needs_grac": 138, "needs_vv10": 138, "needs_xc": 138, "nees": [1734, 1838], "neg": [0, 1, 374, 385, 388, 395, 404, 407, 408, 601, 640, 656, 1197, 1206, 1231, 1520, 1704, 1795, 1796, 1801, 1817, 1828, 1836, 1838, 1844], "negat": 1743, "neglect": [415, 446, 484, 608, 710, 740, 905, 1053, 1198, 1199, 1200, 1206, 1208, 1212, 1218, 1224, 1230, 1231, 1234, 1455, 1569, 1704, 1759, 1763, 1789, 1837], "neglig": [608, 1206, 1704, 1757, 1798, 1817, 1832, 1837, 1838], "negoti": [195, 197], "neighbor": [1228, 1379, 1704, 1749], "neither": [2, 1730, 1736, 1737, 1738, 1748, 1776, 1786], "nekr": [1692, 1752], "nelec": [2, 11, 286, 298, 337, 348, 1810], "nene": [1692, 1752, 1759, 1774], "neoformat": 1747, "neon": [1692, 1738, 1752, 1759, 1828, 1832, 1844], "neq": 1759, "nervou": 1786, "ness": [8, 1714, 1738, 1748, 1842], "nest": [2, 300, 301, 302, 318, 319, 370, 1752, 1767, 1772, 1776, 1800], "net": 1738, "netherland": 1791, "netlib": 1738, "netlifi": [1748, 1788], "network": [1738, 1748, 1767, 1777, 1780], "networkx": 1738, "neugebau": 1734, "neuhaus": 1734, "neural": 1806, "neutral": [1714, 1757, 1768, 1770, 1828, 1833, 1837, 1838, 1842, 1844], "neutral_guess": 1768, "neutron": 1706, "neutron_compton_wavelength": 1706, "neutron_compton_wavelength_over_2_pi": 1706, "neutron_electron_mag_mom_ratio": 1706, "neutron_electron_mass_ratio": 1706, "neutron_g_factor": 1706, "neutron_gyromag_ratio": 1706, "neutron_gyromag_ratio_over_2_pi": 1706, "neutron_mag_mom": 1706, "neutron_mag_mom_to_bohr_magneton_ratio": 1706, "neutron_mag_mom_to_nuclear_magneton_ratio": 1706, "neutron_mass": 1706, "neutron_mass_energy_equival": 1706, "neutron_mass_energy_equivalent_in_mev": 1706, "neutron_mass_in_u": 1706, "neutron_molar_mass": 1706, "neutron_muon_mass_ratio": 1706, "neutron_proton_mag_mom_ratio": 1706, "neutron_proton_mass_differ": 1706, "neutron_proton_mass_difference_energy_equival": 1706, "neutron_proton_mass_difference_energy_equivalent_in_mev": 1706, "neutron_proton_mass_difference_in_u": 1706, "neutron_proton_mass_ratio": 1706, "neutron_tau_mass_ratio": 1706, "neutron_to_shielded_proton_mag_mom_ratio": 1706, "never": [611, 1206, 1226, 1323, 1704, 1738, 1743, 1786, 1788, 1802, 1808, 1809], "nevertheless": [1764, 1822, 1829], "new": [2, 14, 64, 84, 86, 88, 96, 100, 101, 106, 115, 128, 130, 145, 148, 150, 240, 259, 279, 329, 331, 346, 428, 451, 465, 486, 512, 535, 685, 1101, 1199, 1200, 1202, 1203, 1206, 1220, 1669, 1704, 1714, 1715, 1724, 1730, 1734, 1736, 1737, 1738, 1740, 1743, 1747, 1748, 1757, 1759, 1764, 1767, 1770, 1775, 1776, 1777, 1781, 1782, 1783, 1785, 1786, 1787, 1794, 1797, 1798, 1801, 1809, 1810, 1814, 1818, 1824, 1828, 1833, 1834, 1835, 1838, 1841, 1842, 1844], "new_basis_nam": 1730, "new_charg": 1805, "new_civector": 13, "new_mat": 1797, "new_multipl": 1805, "new_tripl": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "new_vec": 1797, "new_vector": 329, "new_x_k": 329, "newer": [1759, 1774, 1786, 1802, 1817, 1828, 1838], "newest": [1748, 1774, 1828], "newfangl": 1737, "newli": [1730, 1781, 1788, 1801, 1834, 1837, 1838], "newlin": 1799, "newton": [635, 652, 746, 944, 1206, 1208, 1213, 1225, 1226, 1279, 1368, 1704, 1753, 1789, 1798, 1802, 1838], "newtonian": 1706, "newtonian_constant_of_gravit": 1706, "newtonian_constant_of_gravitation_over_h_bar_c": 1706, "next": [3, 243, 279, 284, 314, 318, 319, 321, 603, 669, 1206, 1704, 1714, 1730, 1740, 1743, 1754, 1767, 1782, 1786, 1787, 1791, 1800, 1824, 1828, 1832, 1833, 1835, 1837, 1838, 1842, 1844], "next_geom_coords_as_numpy_arrai": [318, 319, 1800], "nez": 1734, "nf": [1738, 1768], "nfli": [1229, 1433, 1704, 1833], "nfragment": [106, 1768, 1794], "nfrzc": 150, "nfunction": 81, "ng": 1748, "ngamma": 20, "ngstr": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "nh": [295, 1692, 1714, 1752, 1766, 1768, 1842], "nh2": [1692, 1711, 1714, 1752, 1842], "nh3": [284, 1692, 1714, 1740, 1752, 1754, 1782, 1803, 1842], "ni": [1707, 1731], "nice": [1738, 1748, 1764, 1788, 1794, 1828, 1834, 1844], "nicknam": 1759, "nightli": [1737, 1738, 1748, 1788], "nih": 1734, "nij": [574, 1206, 1704], "nijmegen": 1791, "nil": 98, "nine": 1748, "ninja": [1738, 1764], "nirrep": [2, 11, 16, 88, 90, 100, 115, 148, 150, 187, 569, 593, 660, 1206, 1704, 1810], "nist": [1832, 1837], "nitrat": [1714, 1842], "nitrogen": [1712, 1714, 1842], "nl": [2, 267, 287, 295, 318, 319, 338, 388, 1231, 1542, 1543, 1544, 1582, 1695, 1696, 1698, 1699, 1700, 1702, 1703, 1704, 1757, 1758, 1759, 1766, 1777, 1781, 1790, 1791, 1800], "nl_dispersion_paramet": [0, 1, 2, 1704, 1714, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "nl_dispersion_paramt": 1760, "nlc": [1710, 1757], "nlevel": 1794, "nlm": 1734, "nm": [377, 550, 1203, 1704, 1714, 1742, 1841, 1842], "nmax": 1757, "nmo": [150, 1810, 1838], "nmopi": [150, 1810], "nmp2": 1752, "nmr": [636, 669, 695, 703, 1206, 1704], "nn": 1776, "nne": [295, 1766], "no_com": [1749, 1754, 1770, 1782, 1802, 1803, 1833, 1837], "no_dfil": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "no_occup": [111, 150, 1799], "no_reori": [1749, 1754, 1770, 1782, 1802, 1803, 1833, 1837], "no_root1": [150, 314, 1791], "no_singl": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "nobeta": [1714, 1842], "nobl": [1125, 1221, 1704, 1714, 1771, 1837, 1842], "noc1": 2, "nocc": [95, 140, 1746], "nocom": [1802, 1833], "nocp": [1714, 1794, 1842], "nocp_energy_body_dict": 1794, "nocp_gradient_body_dict": 1794, "nocp_hessian_body_dict": 1794, "node": [1735, 1763, 1767, 1832], "nois": [1008, 1215, 1704, 1746], "nojacobi": [584, 1206, 1704], "nomenclatur": 1810, "nomin": [268, 1743], "non": [2, 8, 84, 106, 267, 295, 296, 307, 318, 319, 342, 356, 384, 386, 399, 418, 573, 575, 577, 605, 609, 617, 655, 658, 677, 681, 704, 780, 819, 1024, 1147, 1198, 1204, 1206, 1209, 1210, 1217, 1221, 1226, 1230, 1231, 1298, 1372, 1448, 1449, 1450, 1591, 1689, 1692, 1704, 1714, 1715, 1730, 1733, 1735, 1738, 1743, 1744, 1745, 1748, 1752, 1753, 1759, 1760, 1763, 1766, 1767, 1768, 1769, 1770, 1772, 1776, 1781, 1785, 1787, 1790, 1794, 1797, 1800, 1803, 1808, 1809, 1814, 1817, 1824, 1828, 1831, 1832, 1836, 1837, 1838, 1839, 1842, 1844], "non_h": [1692, 1752], "nonabelian": [573, 1206, 1704], "nonapproxim": 1734, "nonbond": 1833, "noncontigu": 1721, "noncoval": [1692, 1730, 1733, 1752, 1757, 1770, 1781, 1802, 1837], "nondynam": [1226, 1305, 1704], "none": [2, 3, 5, 6, 7, 8, 9, 12, 13, 15, 16, 18, 19, 21, 23, 24, 27, 31, 33, 34, 35, 43, 44, 45, 46, 48, 49, 50, 51, 52, 53, 55, 56, 57, 58, 59, 60, 61, 64, 68, 73, 74, 75, 76, 78, 80, 84, 86, 87, 88, 90, 92, 94, 96, 97, 99, 100, 103, 104, 105, 106, 111, 112, 114, 115, 118, 119, 131, 133, 138, 139, 141, 143, 147, 148, 149, 150, 153, 154, 155, 156, 157, 158, 159, 163, 166, 168, 169, 170, 171, 172, 174, 175, 176, 187, 188, 189, 206, 223, 224, 226, 227, 228, 229, 230, 234, 235, 236, 240, 243, 244, 245, 249, 250, 251, 252, 253, 254, 255, 257, 258, 260, 261, 264, 265, 266, 267, 282, 290, 291, 296, 297, 303, 308, 311, 314, 317, 321, 326, 328, 331, 332, 335, 341, 342, 346, 347, 351, 355, 356, 357, 362, 365, 372, 375, 376, 378, 381, 382, 383, 384, 386, 389, 390, 396, 397, 399, 411, 430, 446, 464, 484, 513, 523, 546, 547, 557, 589, 613, 725, 727, 758, 898, 900, 968, 1011, 1048, 1119, 1167, 1198, 1199, 1200, 1202, 1203, 1204, 1206, 1207, 1208, 1212, 1214, 1216, 1218, 1221, 1225, 1226, 1229, 1230, 1231, 1293, 1329, 1403, 1470, 1507, 1532, 1553, 1615, 1631, 1649, 1658, 1704, 1714, 1738, 1740, 1750, 1757, 1759, 1761, 1765, 1768, 1769, 1770, 1772, 1773, 1774, 1775, 1783, 1784, 1788, 1791, 1794, 1796, 1801, 1809, 1826, 1837, 1839, 1841, 1842], "nonempti": 267, "nonequilibrium": 1803, "noninteract": [1048, 1218, 1704, 1757, 1770], "nonit": [1771, 1781], "nonlinear": [377, 1734, 1771, 1838], "nonlinearli": [596, 1206, 1704], "nonloc": [1757, 1776], "nonneg_onli": 342, "nonphys": [106, 1714, 1768, 1842], "nonrelativist": [284, 1740, 1836], "nonsens": [1771, 1776], "nonsepar": [295, 318, 319, 1695, 1697, 1698, 1699, 1700, 1701, 1703, 1758, 1766, 1800], "nonsingular": 100, "nonsuperimpos": 106, "nontrivi": 1755, "nonun": 1759, "nonunit": 1841, "nonzero": [635, 652, 827, 1206, 1210, 1704, 1756, 1810, 1838], "nooijen": [1734, 1805], "noon": [1154, 1221, 1231, 1662, 1704], "nor": [1127, 1128, 1221, 1704, 1730, 1736, 1737, 1738, 1748, 1755, 1776, 1786], "norb": [2, 286, 298, 337, 348], "noreori": 1833, "norm": [12, 149, 277, 335, 342, 356, 388, 491, 500, 594, 683, 722, 903, 904, 1001, 1200, 1206, 1207, 1212, 1215, 1230, 1231, 1444, 1638, 1654, 1673, 1704, 1746, 1757, 1776, 1810, 1837, 1841], "normal": [2, 69, 81, 122, 149, 265, 342, 356, 384, 386, 389, 399, 572, 657, 679, 707, 804, 975, 1027, 1206, 1210, 1214, 1217, 1226, 1312, 1704, 1735, 1740, 1748, 1763, 1767, 1771, 1777, 1782, 1789, 1794, 1798, 1802, 1810, 1828, 1831, 1837, 1838, 1840, 1844], "normal_modes_writ": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "norman": 1734, "norman2018": [1734, 1841], "normco": 389, "nosampl": 2, "notabl": [1755, 1757, 1837], "notat": [229, 1743, 1771, 1801, 1804, 1810, 1832, 1833, 1837, 1838], "note": [0, 2, 8, 100, 106, 148, 150, 259, 265, 267, 285, 287, 295, 296, 314, 318, 319, 322, 324, 325, 331, 335, 336, 338, 342, 356, 368, 369, 377, 386, 388, 390, 430, 539, 561, 570, 573, 574, 586, 590, 592, 599, 609, 610, 627, 655, 660, 664, 665, 669, 672, 680, 699, 833, 887, 1078, 1079, 1086, 1093, 1095, 1126, 1199, 1203, 1204, 1206, 1210, 1219, 1221, 1224, 1230, 1231, 1232, 1239, 1445, 1507, 1619, 1658, 1665, 1666, 1667, 1692, 1704, 1714, 1730, 1735, 1738, 1739, 1740, 1742, 1743, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1763, 1764, 1766, 1767, 1768, 1769, 1771, 1772, 1777, 1782, 1783, 1784, 1785, 1786, 1788, 1790, 1791, 1794, 1797, 1798, 1799, 1800, 1801, 1802, 1805, 1806, 1808, 1810, 1817, 1821, 1828, 1829, 1831, 1832, 1833, 1835, 1836, 1837, 1838, 1839, 1841, 1842, 1843, 1844], "notebook": [1738, 1828], "noth": [640, 855, 1206, 1210, 1704, 1738, 1767, 1786, 1789, 1801], "notic": [2, 1231, 1564, 1704, 1730, 1738, 1756, 1770, 1801, 1828, 1844], "notori": 1757, "nottoli": [1734, 1777, 1780], "notwithstand": [208, 209, 210, 1801], "nov": [267, 1230, 1469, 1470, 1704, 1738, 1759, 1783, 1837], "novemb": 1770, "novic": 1748, "now": [2, 267, 279, 603, 682, 1206, 1226, 1231, 1326, 1629, 1704, 1714, 1738, 1743, 1748, 1753, 1756, 1757, 1759, 1764, 1767, 1770, 1774, 1781, 1785, 1786, 1788, 1798, 1801, 1802, 1808, 1809, 1810, 1817, 1828, 1833, 1837, 1842, 1844], "nowher": [1692, 1752], "np": [2, 11, 12, 100, 148, 150, 262, 277, 306, 307, 318, 319, 331, 342, 356, 377, 1772, 1797, 1800, 1832, 1838, 1841], "np_out": 106, "np_read": [100, 148], "np_write": [100, 148], "nph": [100, 148, 1797], "npoint": [9, 105, 138, 377], "nprimit": [8, 81], "npy": 1838, "npz": [100, 148, 1838], "nr": [635, 652, 656, 1206, 1225, 1226, 1279, 1368, 1694, 1704, 1707, 1731, 1732, 1733, 1798, 1802], "nre": 1833, "nremov": 100, "nroot": [277, 342, 356], "ns1": 86, "ns2": 86, "nsf": 1805, "nshell": [8, 1817], "nshell_on_cent": 8, "nsing": [1224, 1238, 1704], "nso": [2, 100, 150, 1810, 1821, 1838], "nsocc": 1838, "nsopi": 150, "ntask": 1794, "nthread": [156, 251, 1767], "ntrip": [1224, 1239, 1704], "nu": [377, 1757, 1761, 1829, 1836, 1838], "nucelobas": [1692, 1752], "nucenergi": 2, "nuclear": [2, 73, 76, 89, 103, 106, 147, 294, 298, 345, 348, 695, 1206, 1217, 1231, 1528, 1670, 1690, 1704, 1706, 1714, 1743, 1750, 1770, 1776, 1798, 1799, 1802, 1803, 1817, 1828, 1833, 1836, 1838, 1842, 1844], "nuclear_charg": 1799, "nuclear_dipol": 106, "nuclear_magneton": 1706, "nuclear_magneton_in_evpt": 1706, "nuclear_magneton_in_inverse_meters_per_tesla": 1706, "nuclear_magneton_in_kpt": 1706, "nuclear_magneton_in_mhzpt": 1706, "nuclear_repulsion_energi": [2, 106, 1833], "nuclear_repulsion_energy_deriv1": 106, "nuclear_repulsion_energy_deriv2": 106, "nuclei": [76, 150, 1770, 1781, 1799, 1843], "nucleic": [460, 1199, 1704, 1837], "nucleobas": [295, 1766, 1798], "nucleophil": 1750, "nucleu": [1231, 1532, 1704, 1757], "null": [153, 1814, 1817, 1819], "nullifi": 1801, "nullptr": [1231, 1553, 1704, 1814, 1819], "num": [795, 1210, 1704], "num_": 1785, "num_amps_print": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "num_core_orbit": [0, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "num_dets_print": [0, 1, 2, 525, 549, 868, 1202, 1203, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "num_frozen_docc": [0, 1, 2, 1125, 1127, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "num_frozen_uocc": [0, 1, 2, 1128, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "num_guess": [2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "num_init_vec": [0, 1, 2, 830, 842, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "num_root": [0, 1, 2, 150, 314, 830, 842, 867, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "num_thread": [1785, 1817], "number": [0, 1, 2, 5, 8, 9, 16, 20, 81, 84, 86, 87, 88, 92, 100, 103, 105, 106, 115, 138, 147, 148, 150, 199, 251, 266, 267, 270, 276, 277, 284, 285, 286, 288, 289, 298, 317, 321, 329, 334, 335, 336, 337, 339, 340, 342, 348, 356, 365, 374, 389, 390, 395, 404, 405, 406, 407, 410, 419, 422, 431, 435, 447, 452, 469, 470, 485, 487, 489, 495, 524, 525, 527, 531, 548, 549, 564, 569, 575, 580, 583, 585, 593, 595, 601, 607, 609, 614, 616, 621, 628, 633, 640, 644, 646, 660, 671, 686, 689, 692, 724, 734, 735, 741, 751, 756, 757, 760, 768, 770, 775, 776, 782, 783, 785, 789, 790, 793, 796, 797, 798, 805, 806, 808, 811, 814, 815, 823, 824, 825, 827, 829, 835, 840, 842, 847, 852, 853, 859, 860, 868, 869, 870, 871, 875, 877, 878, 879, 881, 884, 890, 893, 894, 895, 896, 901, 911, 912, 914, 931, 932, 950, 966, 969, 970, 984, 993, 1003, 1007, 1009, 1028, 1031, 1055, 1062, 1065, 1066, 1077, 1080, 1084, 1102, 1114, 1123, 1125, 1126, 1127, 1128, 1134, 1136, 1138, 1141, 1143, 1144, 1148, 1149, 1159, 1160, 1161, 1162, 1164, 1165, 1168, 1176, 1177, 1185, 1190, 1191, 1192, 1197, 1198, 1199, 1200, 1202, 1203, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1217, 1218, 1219, 1221, 1222, 1224, 1225, 1226, 1228, 1229, 1230, 1231, 1232, 1237, 1238, 1239, 1243, 1250, 1251, 1263, 1267, 1286, 1302, 1303, 1325, 1333, 1341, 1347, 1379, 1391, 1397, 1408, 1409, 1416, 1433, 1456, 1457, 1458, 1477, 1493, 1494, 1495, 1496, 1508, 1515, 1517, 1533, 1536, 1542, 1544, 1547, 1548, 1575, 1577, 1590, 1592, 1597, 1607, 1625, 1632, 1635, 1640, 1641, 1642, 1645, 1646, 1652, 1655, 1659, 1662, 1666, 1704, 1706, 1708, 1714, 1730, 1735, 1738, 1740, 1742, 1743, 1746, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1761, 1763, 1764, 1767, 1768, 1770, 1771, 1776, 1781, 1782, 1785, 1788, 1789, 1794, 1795, 1798, 1799, 1801, 1802, 1804, 1805, 1810, 1817, 1823, 1824, 1828, 1829, 1832, 1833, 1835, 1837, 1838, 1840, 1841, 1842, 1843, 1844], "numer": [2, 100, 110, 615, 657, 666, 707, 918, 1206, 1213, 1225, 1231, 1249, 1491, 1638, 1639, 1704, 1714, 1738, 1753, 1757, 1770, 1771, 1780, 1781, 1785, 1797, 1802, 1810, 1833, 1837, 1838, 1842], "numint_grid": 110, "numinthelp": 1827, "numpi": [2, 8, 100, 106, 147, 148, 150, 322, 325, 331, 334, 342, 356, 367, 377, 387, 1714, 1738, 1740, 1748, 1759, 1767, 1777, 1780, 1824, 1838, 1841, 1842], "numpy_help": 1797, "numpy_mat": 1797, "numpy_mat_view": 1797, "numpy_vec": 1797, "nvir": 1810, "nvirt": [95, 140], "nwarn": [265, 1740, 1794], "nwchem": [265, 1740, 1794, 1802], "nwchem_loos": [1226, 1324, 1704, 1802], "nweight": [95, 140], "nx3": 70, "nxn": [342, 356], "nyi": [586, 672, 1206, 1704, 1759], "nzapa": 1733, "o": [0, 2, 106, 138, 188, 213, 307, 354, 374, 395, 580, 641, 727, 837, 856, 857, 907, 1206, 1208, 1210, 1212, 1230, 1435, 1436, 1695, 1696, 1697, 1699, 1700, 1701, 1702, 1704, 1707, 1714, 1728, 1730, 1731, 1734, 1736, 1742, 1743, 1748, 1749, 1750, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1763, 1764, 1767, 1770, 1771, 1772, 1781, 1782, 1785, 1788, 1789, 1792, 1794, 1798, 1802, 1808, 1817, 1824, 1828, 1829, 1832, 1833, 1837, 1838, 1839, 1841, 1842, 1844], "o1": 1802, "o2": [1692, 1714, 1727, 1752, 1829, 1842], "o24": [1692, 1752], "o24x5": [1692, 1752], "o2h": [1692, 1752], "o3lyp": [295, 318, 319, 1695, 1697, 1698, 1700, 1703, 1758, 1766, 1800], "o4": 1781, "o_i": [1032, 1115, 1218, 1221, 1704, 1750], "o_x": [1032, 1115, 1218, 1221, 1704, 1750], "o_z": [1032, 1115, 1218, 1221, 1704, 1750], "obara": [1817, 1839], "obei": [1798, 1832], "obj": [1740, 1772], "objdir": [2, 323, 1736, 1748, 1767, 1786, 1828], "objdir8": 1786, "object": [0, 8, 14, 21, 64, 74, 84, 86, 87, 88, 89, 92, 100, 101, 102, 103, 106, 128, 130, 132, 137, 145, 147, 148, 150, 191, 195, 197, 200, 249, 262, 265, 267, 274, 275, 281, 304, 314, 321, 323, 324, 326, 327, 329, 331, 335, 355, 358, 370, 383, 386, 849, 1210, 1231, 1613, 1704, 1714, 1726, 1736, 1738, 1740, 1743, 1752, 1757, 1764, 1767, 1772, 1777, 1780, 1785, 1791, 1794, 1796, 1801, 1808, 1809, 1810, 1823, 1828, 1833, 1838, 1842], "oblig": [1781, 1785], "oblivi": 329, "oblyp": [295, 318, 319, 1695, 1697, 1698, 1699, 1703, 1758, 1766, 1800], "observ": [368, 369, 729, 1208, 1229, 1405, 1704, 1714, 1726, 1753, 1757, 1770, 1785, 1786, 1798, 1841, 1842], "obsolet": 1804, "obsur": 1785, "obtain": [1, 13, 75, 106, 284, 410, 608, 655, 707, 811, 874, 1197, 1206, 1210, 1225, 1279, 1704, 1714, 1726, 1735, 1740, 1742, 1743, 1746, 1748, 1749, 1750, 1753, 1754, 1755, 1757, 1759, 1761, 1762, 1765, 1767, 1770, 1771, 1773, 1774, 1775, 1777, 1781, 1782, 1783, 1784, 1785, 1792, 1794, 1798, 1801, 1803, 1806, 1807, 1824, 1828, 1829, 1832, 1833, 1836, 1837, 1838, 1839, 1841, 1842, 1844], "obvious": [1730, 1837], "occ": [98, 150, 400, 941, 1158, 1213, 1221, 1231, 1258, 1261, 1262, 1264, 1266, 1277, 1283, 1290, 1294, 1562, 1704, 1705, 1708, 1709, 1714, 1739, 1742, 1755, 1771, 1777, 1785, 1790, 1809, 1810, 1829, 1842], "occ_orbs_print": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "occ_percentag": [0, 1, 2, 1065, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "occ_toler": [0, 1, 2, 1065, 1084, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "occa": 104, "occasion": [1754, 1764, 1768, 1810], "occb": 104, "occup": [2, 84, 150, 287, 338, 648, 660, 671, 984, 1084, 1085, 1206, 1214, 1219, 1230, 1462, 1561, 1562, 1606, 1610, 1704, 1713, 1714, 1743, 1757, 1763, 1768, 1771, 1785, 1798, 1799, 1810, 1829, 1833, 1837, 1838, 1842], "occupation_a": 84, "occupation_b": 84, "occupations_and_eigenvalu": [265, 1740, 1794], "occupi": [2, 11, 76, 84, 95, 140, 150, 476, 575, 589, 660, 664, 665, 671, 1102, 1123, 1127, 1164, 1165, 1168, 1177, 1192, 1200, 1206, 1221, 1222, 1225, 1231, 1260, 1559, 1561, 1606, 1704, 1714, 1742, 1750, 1755, 1756, 1757, 1763, 1768, 1770, 1771, 1776, 1785, 1789, 1801, 1810, 1829, 1833, 1838, 1841, 1842], "occur": [0, 833, 1210, 1704, 1743, 1756, 1789, 1798, 1802, 1810, 1838], "occurr": 111, "ocepa": [1225, 1297, 1704, 1734, 1776, 1798], "ochsenfeld": [1734, 1838], "octob": [1740, 1792], "octohedr": 1757, "octre": [1231, 1516, 1518, 1704, 1757], "octupol": [1685, 1776, 1799], "od": [1734, 1798], "odc": [730, 742, 1208, 1704, 1714, 1753, 1781, 1842], "odc_guess": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "odd": [374, 395, 1224, 1239, 1704], "odditi": 1782, "odtl": [1734, 1798], "oe": 1767, "oe_int": [297, 347], "oe_integr": 1785, "oei": [103, 1785], "oei_typ": 103, "oeprop": [0, 1, 2, 400, 1154, 1221, 1704, 1709, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1790, 1791, 1792, 1794, 1795, 1797, 1798, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "off": [100, 106, 295, 300, 301, 302, 318, 319, 321, 561, 574, 579, 584, 596, 597, 598, 602, 608, 610, 617, 625, 626, 636, 637, 639, 640, 641, 642, 648, 655, 658, 669, 673, 677, 678, 679, 682, 688, 691, 692, 693, 695, 696, 698, 699, 701, 702, 706, 1013, 1015, 1018, 1024, 1204, 1206, 1216, 1217, 1229, 1230, 1231, 1420, 1441, 1480, 1520, 1692, 1704, 1738, 1742, 1743, 1748, 1752, 1757, 1766, 1772, 1782, 1785, 1794, 1795, 1796, 1800, 1817, 1822, 1837, 1838], "offdiagonal_ccsd_t": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "offend": 1786, "offer": [647, 680, 1206, 1704, 1757, 1781, 1804, 1837], "offlin": 1764, "offset": [671, 1206, 1704, 1764], "ofil": 1768, "ofnam": 252, "often": [2, 149, 150, 255, 314, 584, 681, 685, 700, 813, 846, 1206, 1210, 1704, 1738, 1740, 1743, 1748, 1753, 1757, 1764, 1767, 1768, 1771, 1776, 1789, 1791, 1802, 1809, 1837, 1838], "oh": [1692, 1714, 1752, 1770, 1802, 1842], "ohm": 1706, "ok": [1786, 1788, 1833, 1838], "olccd": [284, 295, 318, 319, 381, 382, 1675, 1684, 1714, 1739, 1740, 1766, 1776, 1781, 1798, 1800, 1826, 1842], "olccd1": [1714, 1842], "olccd2": [1714, 1842], "olccd3": [1714, 1842], "old": [279, 350, 428, 457, 465, 488, 530, 574, 685, 1199, 1200, 1202, 1206, 1226, 1360, 1704, 1708, 1714, 1738, 1740, 1742, 1748, 1752, 1788, 1802, 1817, 1838, 1842], "older": [2, 285, 336, 1101, 1220, 1704, 1757, 1759, 1774, 1775, 1777, 1781, 1837, 1839], "oldest": [321, 434, 1199, 1704, 1742], "oliveira": [1781, 1784], "olsen": [811, 833, 889, 1210, 1704, 1714, 1734, 1740, 1749, 1755, 1842], "omega": [0, 1, 2, 80, 89, 92, 103, 377, 383, 385, 386, 1196, 1223, 1231, 1663, 1704, 1710, 1714, 1730, 1733, 1735, 1739, 1740, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "omega_": 1841, "omega_converg": 1768, "omega_erf": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "omega_l": 1768, "omega_r": 1768, "omega_toler": 1768, "omit": [648, 660, 1206, 1704, 1730, 1771, 1832], "omp": [1738, 1798], "omp2": [284, 295, 296, 318, 319, 381, 382, 917, 921, 922, 962, 1213, 1225, 1258, 1261, 1262, 1264, 1268, 1297, 1675, 1684, 1704, 1714, 1727, 1734, 1739, 1740, 1766, 1769, 1776, 1781, 1798, 1800, 1826, 1842], "omp2grad": [1734, 1798], "omp2p5": [1714, 1842], "omp3": [284, 295, 318, 319, 381, 382, 1225, 1268, 1297, 1675, 1684, 1704, 1714, 1734, 1739, 1740, 1766, 1776, 1781, 1798, 1800, 1826, 1842], "omp3grad": [1734, 1798], "omp_nest": [1756, 1767], "omp_num_thread": [661, 1206, 1224, 1240, 1704, 1743, 1767], "onc": [84, 260, 321, 703, 1206, 1704, 1708, 1738, 1743, 1747, 1752, 1757, 1759, 1767, 1782, 1788, 1794, 1798, 1804, 1805, 1806, 1838, 1844], "one": [0, 2, 8, 13, 87, 90, 92, 100, 103, 106, 112, 113, 115, 150, 260, 267, 282, 284, 285, 286, 287, 295, 296, 297, 306, 317, 327, 332, 336, 337, 338, 342, 347, 356, 365, 369, 377, 378, 389, 399, 416, 417, 434, 443, 476, 479, 519, 543, 550, 574, 589, 608, 609, 616, 669, 671, 681, 693, 743, 808, 811, 828, 829, 833, 835, 837, 842, 872, 875, 909, 910, 921, 922, 942, 1126, 1156, 1198, 1199, 1200, 1202, 1203, 1206, 1208, 1210, 1212, 1213, 1221, 1224, 1225, 1231, 1236, 1241, 1244, 1278, 1663, 1704, 1711, 1714, 1726, 1730, 1738, 1739, 1740, 1742, 1743, 1748, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1762, 1766, 1768, 1769, 1770, 1771, 1774, 1776, 1779, 1781, 1782, 1785, 1786, 1788, 1789, 1790, 1792, 1794, 1796, 1798, 1800, 1802, 1804, 1805, 1808, 1809, 1810, 1817, 1823, 1828, 1829, 1832, 1833, 1835, 1836, 1837, 1838, 1842, 1844], "one_electron_integr": 103, "oneapi": 1738, "onebodi": [310, 361], "onebodyaoint": [4, 65, 71, 72, 89, 93, 107, 109, 116, 121, 127, 142, 1827], "onebodyint": 89, "onebodysoint": [89, 1827], "onel_hx": 84, "onelin": [1786, 1788], "onepdm": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "onepot_grid_read": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ones": [277, 342, 356, 367, 1738, 1740, 1743, 1838], "ongo": 1785, "onli": [0, 1, 2, 8, 11, 13, 75, 86, 87, 89, 100, 106, 111, 148, 150, 248, 249, 260, 265, 267, 271, 284, 285, 287, 297, 300, 301, 302, 318, 319, 326, 329, 331, 336, 338, 342, 347, 367, 370, 381, 382, 399, 401, 404, 406, 407, 416, 430, 471, 539, 550, 573, 574, 575, 576, 592, 597, 608, 609, 610, 615, 616, 625, 626, 628, 641, 657, 662, 665, 675, 681, 694, 699, 718, 739, 742, 745, 746, 749, 786, 787, 795, 810, 811, 833, 851, 867, 881, 882, 887, 906, 948, 1041, 1078, 1079, 1084, 1085, 1086, 1089, 1090, 1091, 1096, 1126, 1150, 1175, 1197, 1198, 1199, 1200, 1203, 1206, 1207, 1208, 1210, 1212, 1213, 1218, 1219, 1221, 1222, 1224, 1225, 1226, 1228, 1229, 1230, 1231, 1235, 1236, 1238, 1241, 1248, 1258, 1261, 1262, 1264, 1300, 1323, 1334, 1352, 1380, 1441, 1463, 1464, 1465, 1466, 1532, 1564, 1588, 1591, 1620, 1651, 1655, 1658, 1688, 1704, 1708, 1711, 1714, 1722, 1730, 1735, 1737, 1738, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1763, 1764, 1767, 1768, 1770, 1771, 1772, 1774, 1776, 1781, 1782, 1785, 1786, 1788, 1792, 1794, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1809, 1810, 1817, 1824, 1826, 1828, 1829, 1832, 1833, 1836, 1837, 1838, 1840, 1841, 1842, 1844], "onlin": [1738, 1764, 1788], "ons": [1738, 1748, 1781, 1785], "onto": [1229, 1415, 1431, 1432, 1434, 1704, 1743, 1756, 1771, 1788, 1838], "onward": 1759, "oo": [943, 1213, 1704, 1714, 1730, 1733, 1734, 1781, 1790, 1842], "oo_scal": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ooc": [1225, 1296, 1704, 1798], "oovv": [1714, 1842], "op": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1788, 1800], "opa": [377, 1841], "opa_hf_h2o_noneq_pcmsolv": 1724, "opa_residu": 1841, "opa_spectrum": 1841, "opac": 1750, "opb": [295, 318, 319, 1695, 1697, 1698, 1699, 1703, 1758, 1766, 1800], "opdm": [0, 1, 2, 13, 1225, 1230, 1295, 1462, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "opdm_comput": 1785, "opdm_onli": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "opdm_relax": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "open": [2, 86, 87, 224, 660, 662, 676, 695, 861, 1206, 1210, 1224, 1228, 1231, 1237, 1396, 1615, 1692, 1704, 1714, 1734, 1737, 1738, 1739, 1742, 1750, 1752, 1753, 1755, 1756, 1757, 1781, 1783, 1786, 1788, 1798, 1810, 1817, 1825, 1827, 1828, 1829, 1832, 1838, 1842, 1844], "open_check": 86, "openbla": 1738, "openfermion": 1738, "openmp": [1737, 1738, 1756, 1767, 1824, 1838], "openmp_library_dir": 1738, "openssl": 1788, "oper": [2, 17, 87, 91, 103, 139, 149, 159, 259, 329, 342, 356, 402, 539, 573, 738, 1051, 1197, 1203, 1206, 1208, 1218, 1231, 1589, 1704, 1714, 1735, 1738, 1742, 1753, 1757, 1767, 1771, 1773, 1780, 1782, 1797, 1798, 1810, 1818, 1824, 1829, 1836, 1837, 1838, 1840, 1841, 1842], "oppenheim": [597, 1206, 1704], "opportun": 1817, "oppos": [351, 1232, 1666, 1704, 1738, 1743, 1748, 1770, 1785, 1796, 1816, 1837, 1843], "opposit": [2, 106, 150, 295, 436, 449, 922, 923, 936, 937, 938, 1081, 1199, 1213, 1219, 1225, 1283, 1669, 1670, 1674, 1675, 1676, 1680, 1684, 1704, 1743, 1756, 1757, 1766, 1770, 1771, 1776, 1781, 1798], "oppposit": [1067, 1219, 1704, 1771], "opt": [2, 300, 301, 302, 319, 1711, 1714, 1724, 1738, 1740, 1743, 1772, 1779, 1782, 1798, 1800, 1803, 1828, 1840, 1842, 1844], "opt1": [1714, 1842], "opt11": [1714, 1842], "opt12": [1714, 1842], "opt13": [1714, 1842], "opt14": [1714, 1842], "opt15": [1714, 1842], "opt16": [1714, 1842], "opt2": [1714, 1842], "opt3": [1714, 1842], "opt4": [1714, 1842], "opt5": [1714, 1842], "opt6": [1714, 1842], "opt7": [1714, 1842], "opt8": [1714, 1842], "opt9": [1714, 1842], "opt_coordin": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "opt_func": [318, 319, 1779, 1800], "opt_method": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "opt_mod": 1779, "opt_rec": [669, 1206, 1704], "opt_restart": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "opt_typ": [0, 1, 2, 652, 1206, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "optfreq": 1723, "optic": [377, 381, 382, 454, 539, 551, 669, 780, 1199, 1203, 1206, 1209, 1704, 1714, 1734, 1742, 1826, 1842], "optim": [106, 179, 218, 266, 270, 284, 295, 296, 300, 301, 302, 306, 318, 381, 382, 457, 460, 575, 586, 592, 599, 611, 632, 633, 634, 635, 648, 652, 656, 706, 739, 828, 921, 922, 933, 938, 944, 945, 1066, 1127, 1128, 1147, 1164, 1165, 1179, 1199, 1206, 1208, 1210, 1213, 1217, 1219, 1221, 1222, 1225, 1231, 1269, 1279, 1280, 1302, 1305, 1323, 1324, 1325, 1352, 1353, 1368, 1373, 1374, 1565, 1575, 1675, 1684, 1692, 1704, 1708, 1710, 1711, 1714, 1723, 1724, 1735, 1737, 1738, 1740, 1742, 1743, 1746, 1752, 1753, 1755, 1757, 1759, 1763, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1774, 1776, 1777, 1778, 1779, 1782, 1785, 1789, 1790, 1792, 1794, 1796, 1803, 1817, 1824, 1826, 1829, 1831, 1832, 1833, 1834, 1837, 1838, 1840, 1842], "optima": 1738, "optimizationconvergenceerror": [318, 319, 1800, 1827], "optimizationresult": [1226, 1372, 1704], "optimizer_keyword": [318, 319, 1800, 1802], "optimz": [1714, 1802, 1842], "option": [0, 1, 2, 8, 21, 84, 92, 100, 106, 148, 150, 169, 182, 196, 201, 208, 209, 210, 220, 226, 227, 228, 235, 236, 247, 259, 265, 266, 267, 272, 282, 284, 297, 299, 303, 308, 314, 318, 319, 321, 326, 329, 331, 332, 335, 346, 347, 349, 351, 357, 370, 371, 372, 375, 376, 378, 383, 384, 386, 389, 390, 393, 396, 397, 399, 401, 404, 406, 407, 430, 521, 523, 545, 547, 561, 573, 586, 592, 599, 608, 613, 617, 619, 621, 623, 627, 637, 640, 641, 655, 661, 662, 665, 670, 671, 672, 675, 679, 692, 696, 703, 713, 727, 794, 811, 823, 827, 865, 874, 881, 882, 884, 897, 906, 935, 944, 946, 1084, 1085, 1095, 1125, 1126, 1129, 1130, 1197, 1199, 1202, 1203, 1204, 1206, 1208, 1211, 1212, 1213, 1219, 1221, 1224, 1225, 1226, 1228, 1230, 1231, 1232, 1233, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1244, 1279, 1281, 1296, 1324, 1378, 1441, 1483, 1521, 1532, 1563, 1589, 1633, 1636, 1658, 1666, 1692, 1704, 1711, 1714, 1736, 1740, 1743, 1746, 1747, 1748, 1749, 1752, 1753, 1754, 1755, 1757, 1759, 1762, 1765, 1768, 1770, 1771, 1772, 1774, 1776, 1777, 1780, 1782, 1785, 1788, 1790, 1792, 1794, 1797, 1798, 1799, 1800, 1802, 1803, 1808, 1809, 1810, 1812, 1815, 1817, 1827, 1828, 1829, 1831, 1832, 1835, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "option_molecule_nam": 1833, "option_nam": [376, 397], "optional_basis_nam": 1730, "optional_molecule_nam": [1743, 1833], "options1": [1714, 1842], "options_dict": [375, 376, 396, 397], "options_lo": [284, 1740], "optionsst": [328, 1801, 1809, 1827], "optionst": [327, 1827], "optk": [318, 319, 400, 611, 632, 633, 634, 652, 656, 1206, 1304, 1352, 1353, 1355, 1367, 1704, 1705, 1738, 1743, 1790, 1800], "optmiz": [1226, 1349, 1350, 1351, 1364, 1365, 1704, 1802], "optproc": 1827, "optri": [1707, 1731], "optshandl": 1788, "optstash": [327, 1801, 1809], "opwlyp": [295, 318, 319, 1695, 1697, 1698, 1699, 1703, 1758, 1766, 1800], "orb": [1713, 1714, 1785, 1842], "orb1": [897, 1211, 1704], "orb2": [897, 1211, 1704], "orb_en": [835, 861, 1210, 1704, 1755], "orb_opt": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "orb_resp": [1225, 1279, 1704, 1798], "orb_resp_solv": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "orb_rot": 1713, "orb_spac": 115, "orbit": [0, 1, 2, 8, 10, 13, 21, 26, 76, 84, 92, 95, 97, 98, 106, 115, 117, 132, 140, 150, 179, 218, 268, 286, 291, 295, 296, 297, 298, 303, 314, 317, 318, 319, 337, 341, 347, 348, 365, 381, 382, 406, 424, 432, 433, 443, 466, 479, 507, 514, 519, 543, 568, 569, 575, 579, 589, 593, 600, 601, 608, 625, 626, 636, 640, 648, 658, 660, 662, 664, 665, 669, 671, 672, 674, 675, 677, 681, 693, 704, 726, 729, 731, 739, 744, 746, 747, 749, 799, 809, 835, 845, 851, 854, 855, 856, 857, 866, 897, 930, 931, 932, 933, 938, 940, 941, 944, 945, 946, 958, 965, 973, 995, 1000, 1036, 1037, 1041, 1048, 1054, 1065, 1066, 1102, 1103, 1111, 1112, 1123, 1125, 1126, 1127, 1128, 1147, 1148, 1149, 1159, 1160, 1161, 1162, 1164, 1165, 1168, 1171, 1172, 1174, 1177, 1188, 1189, 1190, 1191, 1192, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1206, 1208, 1210, 1211, 1213, 1214, 1215, 1218, 1219, 1221, 1222, 1225, 1230, 1231, 1242, 1259, 1260, 1266, 1267, 1269, 1271, 1276, 1277, 1279, 1280, 1281, 1288, 1290, 1437, 1454, 1459, 1460, 1461, 1462, 1497, 1510, 1558, 1559, 1561, 1562, 1563, 1565, 1573, 1574, 1575, 1579, 1581, 1584, 1594, 1606, 1675, 1684, 1694, 1704, 1708, 1712, 1713, 1714, 1726, 1729, 1730, 1732, 1739, 1742, 1743, 1746, 1753, 1756, 1757, 1764, 1766, 1767, 1768, 1769, 1775, 1776, 1777, 1785, 1790, 1791, 1799, 1800, 1801, 1812, 1814, 1823, 1824, 1826, 1828, 1831, 1833, 1836, 1838, 1841, 1842, 1844], "orbital1": [855, 1210, 1704, 1789], "orbital2": [855, 1210, 1704, 1789], "orbital_basi": 92, "orbital_level_shift": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "orbital_nam": 13, "orbital_valu": 119, "orbitals_and_eigenvalu": [265, 1740, 1794], "orbitals_writ": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "orbitalspac": [150, 1827], "orbsym": [2, 286, 298, 337, 348], "order": [0, 2, 13, 15, 17, 20, 26, 27, 63, 64, 84, 89, 100, 103, 106, 107, 120, 133, 150, 267, 295, 300, 301, 302, 318, 319, 329, 342, 381, 382, 446, 484, 575, 601, 614, 660, 662, 669, 677, 696, 856, 857, 861, 863, 921, 922, 1000, 1065, 1097, 1122, 1123, 1168, 1189, 1199, 1200, 1206, 1213, 1215, 1219, 1220, 1221, 1222, 1225, 1228, 1229, 1230, 1231, 1244, 1256, 1380, 1395, 1403, 1413, 1433, 1448, 1449, 1450, 1452, 1455, 1459, 1464, 1465, 1466, 1521, 1643, 1644, 1645, 1646, 1648, 1673, 1695, 1696, 1698, 1700, 1704, 1714, 1730, 1734, 1738, 1739, 1742, 1743, 1744, 1745, 1746, 1747, 1749, 1750, 1753, 1754, 1757, 1758, 1759, 1761, 1762, 1763, 1766, 1767, 1771, 1772, 1775, 1776, 1777, 1781, 1783, 1785, 1786, 1788, 1790, 1794, 1798, 1799, 1800, 1801, 1802, 1806, 1808, 1809, 1810, 1817, 1826, 1828, 1832, 1834, 1840, 1842, 1844], "ordered_param": [267, 1759], "ordinari": [2, 1737, 1738, 1752, 1831], "oremp": [1225, 1297, 1704, 1714, 1734, 1798, 1842], "oremp2": [295, 318, 319, 1675, 1684, 1739, 1766, 1776, 1781, 1798, 1800], "org": [0, 297, 308, 347, 377, 1692, 1714, 1717, 1734, 1737, 1738, 1740, 1748, 1750, 1752, 1761, 1764, 1768, 1776, 1781, 1787, 1821, 1828, 1839, 1842], "organ": [1777, 1804], "oribit": [1771, 1776], "oribt": 150, "orient": [105, 106, 1721, 1743, 1757, 1770, 1782, 1802, 1833], "orientation_fix": 106, "origin": [0, 2, 8, 103, 106, 112, 386, 539, 681, 1084, 1099, 1156, 1203, 1206, 1219, 1220, 1221, 1669, 1692, 1704, 1714, 1737, 1742, 1752, 1759, 1760, 1770, 1771, 1775, 1776, 1786, 1788, 1789, 1804, 1809, 1817, 1836, 1838, 1841, 1842], "original_coef": 81, "orth_typ": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "orthogon": [100, 115, 130, 647, 752, 947, 1048, 1206, 1208, 1213, 1218, 1225, 1231, 1282, 1601, 1704, 1757, 1763, 1770, 1776, 1781, 1790, 1798, 1799, 1810], "orthonorm": [863, 1210, 1704, 1810, 1838], "os": 1788, "os_scal": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "oscil": [0, 1668, 1669, 1690, 1776, 1838, 1841], "oscillator_strength": [0, 381, 382, 1826], "oscillatori": [729, 1208, 1229, 1231, 1405, 1499, 1704, 1753, 1838], "osd": 328, "oso": [1810, 1838], "ostlund": 1734, "osx": 1788, "other": [0, 2, 8, 73, 75, 111, 115, 148, 150, 262, 263, 278, 284, 292, 300, 301, 302, 318, 319, 343, 346, 377, 381, 382, 386, 390, 393, 599, 608, 615, 699, 700, 813, 1206, 1210, 1229, 1230, 1231, 1431, 1432, 1434, 1441, 1620, 1704, 1707, 1714, 1730, 1731, 1734, 1737, 1738, 1740, 1742, 1743, 1746, 1748, 1752, 1755, 1756, 1757, 1762, 1763, 1764, 1765, 1767, 1768, 1771, 1772, 1773, 1775, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1790, 1792, 1794, 1798, 1800, 1801, 1802, 1804, 1808, 1809, 1810, 1817, 1823, 1826, 1828, 1829, 1832, 1835, 1837, 1838, 1839, 1842, 1843, 1844], "otherwis": [2, 92, 100, 148, 150, 267, 284, 296, 326, 383, 596, 636, 836, 865, 872, 888, 1129, 1206, 1210, 1221, 1224, 1231, 1238, 1500, 1704, 1714, 1730, 1738, 1740, 1743, 1752, 1755, 1759, 1767, 1769, 1794, 1797, 1801, 1802, 1810, 1817, 1828, 1829, 1838, 1842, 1844], "otpss": [295, 318, 319, 1695, 1697, 1698, 1702, 1703, 1758, 1766, 1800], "oughtn": 1809, "our": [1748, 1753, 1757, 1770, 1798, 1817, 1828, 1832, 1836, 1837, 1841, 1844], "out": [2, 64, 92, 106, 115, 138, 139, 150, 284, 288, 289, 306, 314, 321, 329, 339, 340, 374, 386, 395, 570, 573, 617, 623, 706, 823, 827, 828, 861, 890, 998, 1041, 1124, 1206, 1210, 1215, 1218, 1221, 1226, 1231, 1311, 1322, 1360, 1649, 1657, 1704, 1708, 1714, 1724, 1725, 1737, 1740, 1742, 1743, 1746, 1748, 1750, 1752, 1755, 1756, 1757, 1767, 1768, 1770, 1786, 1788, 1791, 1794, 1799, 1800, 1801, 1802, 1804, 1810, 1817, 1824, 1828, 1833, 1837, 1838, 1841, 1842, 1844], "out_fnam": [9, 119], "out_of_cor": [721, 1166, 1207, 1221, 1231, 1609, 1620, 1704, 1749, 1754, 1803, 1838], "out_unit": [377, 1841], "outer": [1794, 1810], "outermost": 1779, "outfil": [8, 9, 73, 100, 118, 119, 261, 278, 280, 1788, 1810, 1821], "outlin": [1738, 1752, 1763, 1771, 1779, 1798, 1806, 1824, 1838], "output": [8, 16, 64, 88, 100, 106, 115, 148, 150, 153, 172, 189, 202, 221, 227, 228, 229, 230, 234, 252, 265, 267, 271, 278, 280, 282, 285, 287, 300, 301, 302, 318, 319, 332, 336, 338, 350, 374, 377, 380, 390, 393, 395, 667, 701, 716, 720, 934, 1021, 1025, 1026, 1027, 1104, 1118, 1153, 1170, 1206, 1207, 1213, 1216, 1217, 1221, 1230, 1231, 1463, 1578, 1608, 1704, 1708, 1714, 1730, 1738, 1750, 1757, 1759, 1767, 1768, 1769, 1770, 1772, 1775, 1780, 1785, 1787, 1788, 1790, 1791, 1794, 1799, 1800, 1801, 1810, 1814, 1821, 1828, 1831, 1832, 1833, 1834, 1837, 1838, 1840, 1841, 1842, 1844], "output_alpha": 323, "output_file_typ": 323, "output_nam": 1802, "outright": [1714, 1726, 1737, 1740, 1842], "outsid": [2, 106, 586, 1206, 1704, 1738, 1804, 1805], "ov": [1730, 1733, 1756, 1841], "over": [2, 13, 112, 295, 318, 319, 576, 609, 667, 835, 1125, 1206, 1210, 1221, 1229, 1231, 1411, 1507, 1704, 1706, 1708, 1714, 1718, 1735, 1743, 1744, 1745, 1753, 1754, 1755, 1756, 1757, 1759, 1766, 1767, 1770, 1771, 1772, 1776, 1783, 1788, 1798, 1800, 1804, 1817, 1828, 1832, 1837, 1838, 1842, 1844], "overal": [100, 106, 259, 1739, 1759, 1770, 1824, 1828, 1833, 1837, 1838, 1843, 1844], "overcom": [1770, 1771, 1786, 1808, 1838], "overcomplet": 1838, "overestim": 1757, "overhaul": 247, "overhead": [1742, 1756, 1770], "overlap": [76, 89, 103, 116, 141, 150, 323, 488, 761, 774, 829, 886, 977, 1013, 1015, 1135, 1200, 1209, 1210, 1214, 1216, 1221, 1231, 1491, 1509, 1600, 1669, 1704, 1714, 1754, 1763, 1776, 1781, 1801, 1802, 1809, 1810, 1817, 1828, 1836, 1838, 1842, 1844], "overlap_3c": 89, "overlap_check": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "overlap_grad": 103, "overlapint": [1817, 1827], "overli": 0, "overload": [5, 8, 13, 20, 27, 29, 64, 88, 90, 92, 96, 100, 101, 103, 106, 114, 119, 147, 148, 246, 248, 252, 1821], "overrid": [8, 106, 267, 284, 661, 697, 821, 897, 1065, 1084, 1100, 1206, 1210, 1211, 1219, 1220, 1224, 1231, 1236, 1240, 1642, 1704, 1738, 1740, 1743, 1755, 1757, 1759, 1767, 1771, 1775, 1819, 1832], "overridden": [267, 1231, 1641, 1704, 1808, 1838], "overriden": [284, 1740], "overrul": [284, 1740], "overview": [0, 1738, 1743, 1760, 1777, 1797, 1819], "overwhelmingli": 1788, "overwrit": [106, 1226, 1231, 1324, 1636, 1704, 1714, 1740, 1759, 1788, 1802, 1842], "overwritten": [106, 267, 1743, 1759, 1776], "ovvv": [1714, 1842], "ow": 1838, "own": [329, 1226, 1304, 1704, 1737, 1738, 1743, 1748, 1759, 1774, 1775, 1781, 1782, 1785, 1786, 1795, 1817, 1823, 1837], "owner": [265, 1740, 1785, 1786, 1794], "owner_group": [265, 1740, 1794], "oxford": 1734, "oxid": [1714, 1842], "oxygen": [0, 1714, 1789, 1829, 1838, 1842], "ozon": [1714, 1842], "p": [0, 1, 2, 3, 13, 103, 143, 144, 295, 300, 301, 302, 346, 390, 392, 443, 479, 519, 543, 628, 721, 903, 904, 1199, 1200, 1202, 1203, 1206, 1207, 1212, 1231, 1485, 1704, 1714, 1730, 1734, 1738, 1740, 1747, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1793, 1794, 1795, 1798, 1800, 1801, 1803, 1805, 1806, 1807, 1808, 1809, 1811, 1813, 1820, 1821, 1822, 1823, 1826, 1829, 1832, 1834, 1835, 1836, 1837, 1839, 1840, 1841, 1842], "p4": 1743, "p4c4": 1743, "p4c4_info": 1743, "p4dep": 1738, "p4dev": [1738, 1748], "p4env": [1737, 1738, 1748], "p4mol": 1833, "p4util": [2, 84, 278, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 396, 1777, 1797, 1801, 1832, 1841], "p_": 1837, "p_gaussian": [968, 1214, 1231, 1532, 1704], "p_rfo": [1226, 1368, 1704, 1802], "p_slater": [968, 1214, 1231, 1532, 1704, 1757], "pa": [390, 1706], "pack": [90, 100, 148, 1726], "packag": [0, 1, 1129, 1221, 1704, 1736, 1738, 1746, 1749, 1754, 1762, 1765, 1767, 1773, 1774, 1775, 1777, 1780, 1782, 1783, 1784, 1785, 1786, 1787, 1790, 1803, 1806, 1807, 1839], "page": [1734, 1736, 1737, 1738, 1748, 1757, 1764, 1770, 1777, 1785, 1787, 1798, 1817], "pai": 1738, "pain": 1810, "pair": [106, 112, 258, 295, 445, 446, 453, 484, 522, 523, 546, 547, 704, 833, 985, 1070, 1071, 1101, 1199, 1200, 1202, 1203, 1206, 1210, 1214, 1219, 1220, 1231, 1488, 1622, 1669, 1680, 1692, 1704, 1714, 1752, 1759, 1766, 1770, 1775, 1776, 1777, 1781, 1790, 1801, 1802, 1828, 1837, 1838, 1841, 1842, 1844], "pair_energies_print": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "pairpq": 1817, "pairr": 1817, "pairwis": [267, 1759, 1770, 1776, 1837], "pam": 1817, "panda": 1832, "pao": [979, 980, 982, 1214, 1704, 1763], "papajak": [1730, 1733, 1734, 1828, 1844], "paper": [786, 1210, 1704, 1714, 1757, 1762, 1770, 1781, 1799, 1805, 1810, 1837, 1842], "paradigm": [1209, 1672], "paragraph": [1752, 1810], "parallel": [0, 1, 2, 199, 251, 570, 624, 1041, 1206, 1218, 1692, 1704, 1730, 1733, 1735, 1737, 1738, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1841, 1843, 1844], "param": [106, 1695, 1696, 1697, 1700, 1757, 1758, 1759], "param_tweak": [267, 1759], "paramet": [0, 2, 8, 13, 14, 64, 92, 96, 100, 106, 128, 130, 138, 145, 147, 148, 150, 176, 212, 255, 259, 262, 263, 265, 266, 267, 268, 269, 270, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 308, 309, 312, 313, 314, 317, 318, 319, 321, 322, 324, 325, 326, 327, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 346, 347, 348, 349, 350, 351, 352, 354, 355, 356, 358, 359, 360, 363, 364, 365, 366, 367, 370, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 395, 396, 397, 399, 460, 658, 755, 761, 774, 781, 832, 833, 955, 957, 1070, 1088, 1199, 1206, 1208, 1209, 1210, 1213, 1219, 1224, 1225, 1226, 1231, 1241, 1279, 1283, 1284, 1289, 1294, 1355, 1511, 1512, 1513, 1521, 1529, 1530, 1539, 1540, 1582, 1695, 1696, 1698, 1700, 1702, 1704, 1706, 1710, 1714, 1735, 1740, 1742, 1743, 1750, 1752, 1753, 1757, 1758, 1759, 1760, 1761, 1766, 1768, 1769, 1771, 1772, 1774, 1775, 1776, 1780, 1782, 1790, 1791, 1794, 1797, 1798, 1799, 1800, 1810, 1817, 1821, 1826, 1837, 1838, 1842], "parameter": [2, 295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1758, 1766, 1800, 1837], "parametr": 1841, "parent": [106, 1150, 1221, 1704, 1737, 1776, 1808], "parent_atom": 9, "parent_symmetri": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "parenthes": [8, 1730, 1737, 1772], "parenthesi": 1733, "parenthet": 1776, "parker": [106, 1734, 1781, 1837], "parr": [1734, 1757], "parrish": [94, 288, 289, 339, 340, 1135, 1221, 1704, 1734, 1750, 1756, 1757, 1770, 1781, 1786, 1799, 1837, 1838], "pars": [271, 380, 1227, 1377, 1704, 1714, 1730, 1743, 1767, 1768, 1788, 1801, 1832, 1842], "parser": [1714, 1743, 1781, 1785, 1833, 1842], "parsingerror": 1827, "part": [0, 2, 267, 284, 574, 603, 664, 677, 680, 681, 1199, 1206, 1231, 1612, 1669, 1692, 1704, 1708, 1711, 1714, 1722, 1738, 1740, 1743, 1747, 1752, 1753, 1757, 1759, 1763, 1767, 1781, 1785, 1786, 1788, 1802, 1808, 1817, 1823, 1828, 1837, 1838, 1842, 1844], "parti": 1785, "partial": [100, 386, 641, 662, 708, 1206, 1231, 1600, 1606, 1704, 1753, 1757, 1771, 1772, 1776, 1786, 1794, 1798, 1802, 1828, 1829, 1838, 1844], "partial_cholesky_factor": 100, "partialcholeski": [1231, 1601, 1704, 1838], "particip": [1743, 1786], "particl": [13, 416, 417, 627, 743, 758, 794, 828, 872, 875, 888, 909, 910, 1198, 1206, 1208, 1210, 1212, 1671, 1704, 1706, 1753, 1755, 1771, 1776, 1781, 1785, 1790, 1798, 1799, 1805, 1823, 1829, 1838, 1843], "particular": [86, 268, 568, 569, 593, 628, 640, 660, 679, 685, 827, 829, 1206, 1210, 1704, 1714, 1730, 1735, 1738, 1740, 1743, 1747, 1748, 1752, 1754, 1756, 1757, 1759, 1774, 1779, 1781, 1788, 1794, 1802, 1808, 1809, 1828, 1829, 1833, 1834, 1837, 1838, 1842], "particularli": [2, 433, 466, 507, 514, 611, 628, 632, 633, 634, 635, 652, 1199, 1200, 1201, 1202, 1206, 1225, 1242, 1704, 1742, 1748, 1753, 1755, 1757, 1761, 1767, 1783, 1788, 1824, 1833, 1837, 1838], "partit": [76, 352, 1230, 1442, 1704, 1714, 1738, 1757, 1776, 1781, 1790, 1799, 1837, 1842], "pascal": [1232, 1665, 1704, 1843], "pass": [0, 2, 64, 86, 92, 100, 103, 106, 148, 150, 265, 275, 281, 285, 287, 291, 304, 306, 312, 314, 318, 319, 329, 331, 336, 338, 341, 350, 374, 378, 383, 395, 575, 1130, 1206, 1221, 1225, 1254, 1255, 1704, 1710, 1714, 1722, 1738, 1740, 1743, 1746, 1750, 1759, 1767, 1768, 1769, 1775, 1779, 1785, 1787, 1791, 1794, 1797, 1800, 1802, 1803, 1805, 1808, 1809, 1810, 1817, 1828, 1838, 1842], "passabl": 1738, "passnon": 2, "past": [106, 137, 1804], "pastur": 1738, "pasturerequirederror": 1827, "patch": [1714, 1759, 1788, 1833, 1842], "patch_grimme_dftd3": 1759, "path": [2, 87, 106, 150, 194, 245, 285, 287, 288, 289, 336, 338, 339, 340, 354, 1735, 1736, 1737, 1743, 1746, 1748, 1750, 1752, 1759, 1762, 1764, 1765, 1767, 1768, 1773, 1774, 1775, 1782, 1783, 1784, 1786, 1788, 1790, 1792, 1808, 1824, 1828, 1839, 1844], "pathlib": 2, "patkowski": [1734, 1770, 1781, 1786, 1837], "patter": 1785, "pattern": [106, 1736, 1737, 1738, 1740, 1748, 1768, 1770, 1785, 1788, 1801, 1809, 1817], "paus": 1788, "pb": [1707, 1731, 1736, 1748, 1777], "pbe": [295, 318, 319, 1695, 1697, 1698, 1699, 1700, 1701, 1703, 1739, 1757, 1758, 1759, 1766, 1781, 1800], "pbe0": [295, 318, 319, 1230, 1471, 1695, 1696, 1697, 1698, 1700, 1701, 1703, 1704, 1714, 1757, 1758, 1766, 1800, 1837, 1842], "pbe1w": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "pbe50": [295, 318, 319, 1695, 1698, 1700, 1703, 1758, 1766, 1800], "pbe_c": 1757, "pbe_x": 1757, "pbeb95": [295, 1695, 1696, 1697, 1698, 1700, 1702, 1758, 1766], "pbeh": [106, 295, 1718, 1757, 1766, 1774, 1781], "pbeh3c": [106, 295, 318, 319, 1695, 1698, 1700, 1703, 1718, 1758, 1766, 1774, 1800], "pbelyp1w": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "pbep86": [295, 1695, 1696, 1697, 1698, 1700, 1714, 1758, 1766, 1842], "pbepb": [295, 1695, 1696, 1697, 1698, 1700, 1758, 1766], "pbs_jobid": 1767, "pbs_nodefil": 1767, "pbs_o_workdir": 1767, "pccp": [1692, 1752, 1837], "pcg": [946, 1213, 1225, 1281, 1284, 1704], "pcg_beta_typ": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "pcg_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "pcg_maxit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "pcm": [0, 1, 2, 150, 366, 376, 379, 397, 400, 769, 1209, 1375, 1376, 1704, 1705, 1709, 1724, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "pcm__input": [366, 376, 379, 397], "pcm_cc_type": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "pcm_enabl": 150, "pcm_scf_type": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "pcmpotentialint": 1817, "pcmsolver": [366, 379, 400, 1151, 1221, 1227, 1377, 1704, 1736, 1738, 1748, 1754, 1777, 1780, 1785, 1786, 1842], "pcmsolver_dir": 1803, "pcmsolver_librari": 1785, "pcmsolver_parsed_fnam": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "pcmsolverconfig": 1803, "pcseg": [1231, 1485, 1694, 1704, 1707, 1731, 1732, 1733, 1838], "pcsseg": [1694, 1707, 1731, 1732, 1733], "pctc": [106, 1759, 1774], "pcv": [1694, 1732, 1733], "pcv5z": [1694, 1707, 1731, 1732], "pcv6z": [1694, 1707, 1731, 1732], "pcv_5pd_z": [1694, 1707, 1731, 1732], "pcv_6pd_z": [1694, 1707, 1731, 1732], "pcv_dpd_z": [1694, 1707, 1731, 1732], "pcv_qpd_z": [1694, 1707, 1731, 1732], "pcv_tpd_z": [1694, 1707, 1731, 1732], "pcvdz": [1694, 1707, 1714, 1731, 1732, 1842], "pcvqz": [1694, 1707, 1731, 1732, 1740], "pcvtz": [1692, 1694, 1707, 1731, 1732, 1752], "pcvxz": [1733, 1836], "pd": [1707, 1731, 1832], "pdb": 1770, "pdf": [1735, 1764], "pdm": [1225, 1288, 1704, 1708, 1798], "pe": [0, 1, 2, 103, 400, 1392, 1704, 1705, 1709, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "pe_ecp": [0, 1, 2, 1704, 1707, 1730, 1731, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "peak": 1735, "pedersen": [1734, 1798], "pedersen1995": [1734, 1841], "peform": [303, 1775], "penalti": 1838, "pend": 1776, "penetr": [1015, 1216, 1704], "peng": [1734, 1802], "pentacen": [1692, 1710, 1752], "pentanediol": [1714, 1770, 1842], "pentupli": [697, 1206, 1704], "peopl": 1804, "pep": 1804, "pep0000model": 1804, "pep1": [1777, 1830], "pepxxxx": 1804, "per": [1, 8, 88, 100, 106, 138, 148, 150, 259, 262, 263, 310, 356, 361, 389, 410, 422, 495, 502, 505, 525, 531, 549, 628, 771, 868, 1031, 1065, 1102, 1114, 1123, 1125, 1126, 1127, 1128, 1159, 1160, 1161, 1162, 1164, 1165, 1168, 1177, 1192, 1197, 1198, 1200, 1202, 1203, 1206, 1209, 1210, 1218, 1219, 1221, 1222, 1226, 1231, 1336, 1515, 1517, 1576, 1625, 1640, 1642, 1655, 1704, 1706, 1714, 1730, 1739, 1742, 1754, 1755, 1771, 1776, 1788, 1794, 1801, 1802, 1810, 1832, 1837, 1838, 1841, 1842], "perceiv": [660, 1206, 1704], "percent": [1084, 1130, 1219, 1221, 1704, 1838], "percentag": [729, 1208, 1229, 1231, 1405, 1499, 1704, 1802], "percol": 1757, "perdew": [295, 318, 319, 1695, 1697, 1698, 1699, 1703, 1758, 1766, 1800], "perfectli": 1843, "perfom": 1752, "perform": [0, 10, 84, 97, 117, 139, 154, 155, 156, 157, 158, 159, 277, 284, 295, 300, 301, 302, 318, 319, 342, 356, 390, 399, 412, 516, 581, 586, 596, 613, 616, 629, 630, 631, 640, 644, 653, 670, 672, 676, 679, 707, 708, 742, 749, 753, 837, 841, 921, 922, 952, 1197, 1198, 1200, 1202, 1203, 1206, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1220, 1222, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1236, 1279, 1399, 1409, 1417, 1423, 1453, 1485, 1498, 1550, 1566, 1596, 1645, 1646, 1649, 1668, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1681, 1682, 1684, 1686, 1687, 1688, 1689, 1690, 1704, 1711, 1714, 1722, 1730, 1735, 1737, 1738, 1740, 1743, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1762, 1763, 1766, 1767, 1770, 1772, 1776, 1781, 1782, 1789, 1792, 1798, 1800, 1801, 1802, 1805, 1809, 1810, 1817, 1821, 1823, 1824, 1828, 1829, 1831, 1832, 1833, 1836, 1837, 1838, 1841, 1842, 1843, 1844], "perhap": [387, 1738, 1743, 1757, 1767, 1779], "perkin": 1734, "perl": 1738, "perman": 1748, "permiss": [1743, 1788], "permit": [281, 304, 635, 648, 652, 1206, 1704, 1738, 1743, 1770, 1775, 1799, 1832, 1834], "permitt": 1706, "permut": [0, 330, 355, 358, 1708, 1838], "permutation": 1817, "pernal": [1734, 1759], "perpendicular": [1041, 1218, 1704, 1770, 1828, 1844], "persist": 1817, "person": 1786, "perspect": [1757, 1824], "pert": 1785, "pertain": [226, 1738, 1833], "pertin": [1767, 1823, 1832], "pertub": [295, 1766, 1792, 1793], "perturb": [0, 84, 103, 106, 237, 295, 318, 319, 381, 382, 442, 446, 484, 518, 542, 548, 552, 614, 622, 665, 674, 677, 690, 703, 704, 758, 873, 957, 1024, 1199, 1200, 1202, 1203, 1206, 1208, 1213, 1217, 1225, 1229, 1230, 1231, 1289, 1423, 1587, 1588, 1589, 1673, 1689, 1695, 1696, 1698, 1700, 1704, 1714, 1724, 1734, 1742, 1743, 1744, 1745, 1746, 1753, 1758, 1761, 1766, 1776, 1777, 1785, 1790, 1792, 1793, 1800, 1806, 1826, 1828, 1829, 1833, 1842, 1844], "perturb_cb": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "perturb_cbs_coupl": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "perturb_dipol": [0, 1, 2, 1588, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "perturb_grad": 103, "perturb_h": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "perturb_magnitud": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "perturb_with": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "peter": [1740, 1750], "petit": [103, 1231, 1628, 1704], "petite_list": [103, 132], "petite_list1": 103, "petitelist": [100, 103, 132, 1827], "pf": [615, 1206, 1704], "pfxc": 1738, "ph": 1770, "ph3": [1714, 1842], "phase": [440, 457, 823, 826, 884, 1199, 1210, 1231, 1656, 1704, 1742, 1838, 1841], "phenol": [1714, 1770, 1842], "phenomen": 1757, "phenomenolog": [377, 1841], "phenomenon": 2, "phenyl": [1770, 1833], "phenylacetylen": [1714, 1842], "phenylbenzenesulfonamid": 1833, "phenylenedinitren": 1729, "phenylmethanol": 1833, "phenylpropanenitril": 1833, "phi": [1714, 1802, 1842], "phi_": [574, 1206, 1704, 1742, 1755, 1757, 1829, 1838], "phi_0": [1742, 1755], "phi_a": 1802, "phi_b": 1802, "phi_i": [1742, 1755], "phi_n": [1112, 1221, 1704, 1750], "phi_point": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "philosophi": [1737, 1804, 1823], "phosphinothioylsulfanylethyl": 1833, "phosphoryl": 1833, "photon": [369, 377, 1790], "php": [1738, 1750], "phy": [297, 347, 356, 443, 479, 519, 543, 693, 885, 1199, 1200, 1202, 1203, 1206, 1210, 1230, 1469, 1692, 1704, 1714, 1734, 1740, 1752, 1762, 1781, 1837, 1842], "physconst": 1764, "physic": [106, 377, 400, 620, 1206, 1704, 1714, 1726, 1742, 1743, 1757, 1764, 1767, 1770, 1777, 1781, 1828, 1837, 1838, 1842, 1844], "physicist": 1756, "physreva": 1734, "physrevlett": [295, 318, 319, 1695, 1697, 1698, 1702, 1703, 1758, 1766, 1800], "pi": [81, 295, 308, 368, 369, 377, 576, 1057, 1058, 1206, 1218, 1231, 1556, 1684, 1692, 1704, 1706, 1714, 1738, 1752, 1766, 1768, 1776, 1781, 1798, 1810, 1837, 1838, 1842], "pick": [897, 1125, 1211, 1221, 1704, 1750, 1771, 1788, 1837, 1838, 1844], "pictur": [76, 1770, 1837], "pid": [86, 288, 289, 339, 340, 1767, 1838], "pidspac": 354, "piec": [2, 1714, 1743, 1757, 1824, 1842], "piecuch": [1714, 1734, 1738, 1755, 1842], "pin": 1757, "pinch": 1738, "pinski": [1734, 1763], "pint": 1738, "piotr": [1692, 1734, 1752], "pip": [1747, 1750, 1764, 1805, 1806], "pipek": [117, 664, 1061, 1206, 1218, 1704], "pipek_mezei": [965, 1214, 1704], "pipelin": 1788, "piquem": 1734, "pittner": [1229, 1399, 1704], "pitzer": [13, 150, 643, 1206, 1704], "pitzer_to_ci_order_onel": 13, "pitzer_to_ci_order_twoel": 13, "pivot": 100, "pk": [92, 623, 721, 1166, 1206, 1207, 1221, 1231, 1576, 1592, 1609, 1620, 1704, 1708, 1714, 1729, 1749, 1754, 1803, 1832, 1836, 1838, 1842], "pk_all_nonsym": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "pk_max_bucket": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "pk_ref": [1714, 1842], "pkzb": [295, 318, 319, 1695, 1697, 1698, 1702, 1703, 1758, 1766, 1800], "pl": 1764, "place": [0, 1, 2, 100, 279, 321, 389, 406, 1197, 1704, 1714, 1730, 1738, 1740, 1743, 1748, 1755, 1757, 1764, 1767, 1770, 1775, 1782, 1785, 1788, 1795, 1796, 1801, 1802, 1804, 1808, 1810, 1815, 1828, 1829, 1832, 1833, 1838, 1840, 1842, 1844], "placehold": [185, 186, 1748], "plai": [2, 84, 103, 1838], "plain": [371, 1740, 1764, 1771, 1794, 1798, 1808], "plan": [265, 1736, 1740, 1767, 1768, 1772, 1777, 1781, 1785, 1794, 1804], "planar": 1802, "planck": 1706, "planck_const": 1706, "planck_constant_in_ev_": 1706, "planck_constant_over_2_pi": 1706, "planck_constant_over_2_pi_in_ev_": 1706, "planck_constant_over_2_pi_times_c_in_mev_fm": 1706, "planck_length": 1706, "planck_mass": 1706, "planck_mass_energy_equivalent_in_gev": 1706, "planck_temperatur": 1706, "planck_tim": 1706, "plane": [106, 139, 1226, 1311, 1322, 1360, 1704, 1714, 1730, 1743, 1782, 1833, 1842], "platform": [1734, 1748, 1767, 1780, 1788, 1808], "pleas": [0, 2, 1126, 1221, 1704, 1735, 1736, 1737, 1738, 1748, 1755, 1757, 1759, 1762, 1764, 1767, 1770, 1788, 1802, 1808, 1817, 1832, 1837, 1838], "plesset": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "plot": [0, 76, 106, 324, 377, 1040, 1052, 1218, 1704, 1714, 1750, 1761, 1770, 1788, 1790, 1791, 1842], "plot_fit": 1761, "plot_spectrum": 0, "plu": [8, 295, 298, 348, 934, 1025, 1026, 1027, 1102, 1213, 1217, 1221, 1231, 1578, 1695, 1696, 1698, 1700, 1704, 1733, 1743, 1746, 1748, 1758, 1759, 1766, 1772, 1775, 1776, 1782, 1791, 1792, 1802], "plug": [656, 1206, 1704], "plugin": [223, 224, 225, 226, 1714, 1715, 1736, 1737, 1738, 1747, 1748, 1764, 1767, 1777, 1780, 1785, 1801, 1805, 1806, 1819, 1842], "plugin_": 1764, "plugin_load": 1808, "plump": 367, "pluse": 8, "pm": [1182, 1222, 1704], "pmatrix": [0, 1836, 1841], "pmem": 1767, "pmlocal": 1827, "pna": [295, 318, 319, 1695, 1698, 1702, 1703, 1749, 1758, 1766, 1800], "pna_6w": 1749, "png": [1764, 1770, 1788], "pno": [984, 1214, 1704, 1763], "pno_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "po": [1707, 1731, 1786], "podeszwa": [1734, 1759, 1837], "poelman": 1781, "point": [0, 1, 2, 8, 17, 20, 89, 91, 100, 103, 105, 106, 110, 111, 120, 138, 149, 150, 159, 275, 284, 295, 306, 314, 377, 386, 390, 569, 573, 574, 593, 616, 617, 619, 635, 652, 657, 660, 697, 698, 707, 770, 775, 776, 969, 970, 1031, 1099, 1114, 1134, 1135, 1136, 1143, 1144, 1206, 1209, 1214, 1218, 1220, 1221, 1222, 1226, 1230, 1231, 1232, 1314, 1339, 1347, 1477, 1493, 1494, 1495, 1496, 1515, 1517, 1533, 1535, 1536, 1542, 1544, 1590, 1597, 1625, 1632, 1635, 1659, 1666, 1682, 1690, 1692, 1704, 1710, 1711, 1714, 1722, 1726, 1730, 1733, 1735, 1738, 1739, 1740, 1741, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1767, 1768, 1769, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1790, 1791, 1792, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1828, 1829, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "point_group": 106, "point_valu": 119, "pointer": [100, 148, 150, 1797, 1810, 1817, 1821], "pointfunct": [129, 146, 147, 1827], "pointgroup": [20, 106, 1827], "poisson": 1754, "pol_3a": 1722, "polak": [1225, 1284, 1704], "polak_ribier": [948, 1213, 1225, 1284, 1704], "polar": [1, 2, 286, 298, 337, 348, 1017, 1018, 1020, 1216, 1686, 1704, 1711, 1714, 1757, 1770, 1776, 1777, 1790, 1803, 1838, 1842], "polaris": [1749, 1754, 1803], "polariz": [381, 382, 454, 539, 551, 669, 673, 715, 1152, 1199, 1203, 1206, 1207, 1221, 1227, 1228, 1381, 1384, 1390, 1669, 1686, 1687, 1704, 1706, 1714, 1724, 1725, 1738, 1742, 1776, 1780, 1817, 1826, 1842], "pole": [0, 1, 377, 410, 1197, 1225, 1258, 1261, 1262, 1264, 1685, 1704, 1776, 1798, 1799, 1841], "polici": [265, 321, 1125, 1126, 1221, 1704, 1740, 1771, 1794, 1837], "poll": 1788, "polynomi": 1763, "poor": [584, 1206, 1704, 1757, 1763, 1802, 1841], "poorli": 1802, "pop": [5, 13, 106], "popl": [647, 929, 1206, 1213, 1704, 1707, 1730, 1731, 1734, 1771], "popovici": 1734, "popul": [671, 1128, 1206, 1221, 1704, 1755, 1823], "popular": [1730, 1742, 1752, 1757, 1771, 1828, 1838, 1844], "populateextern": 275, "portabl": 1810, "portfolio": 1788, "portion": [380, 1709, 1711, 1714, 1730, 1743, 1752, 1768, 1776, 1782, 1802, 1808, 1838, 1840, 1842], "posit": [5, 100, 106, 275, 335, 356, 601, 1125, 1206, 1221, 1704, 1714, 1750, 1757, 1759, 1771, 1774, 1782, 1786, 1788, 1794, 1802, 1804, 1817, 1828, 1836, 1837, 1838, 1841, 1842, 1844], "position_camera": 323, "posix": 1738, "possess": [1833, 1835], "possibl": [0, 1, 2, 13, 106, 279, 296, 329, 355, 358, 402, 403, 409, 411, 428, 430, 434, 444, 445, 446, 454, 456, 465, 467, 474, 475, 482, 483, 484, 492, 506, 513, 539, 551, 557, 568, 570, 571, 573, 574, 575, 584, 586, 589, 590, 592, 599, 600, 608, 610, 613, 615, 617, 619, 623, 624, 627, 635, 636, 637, 638, 640, 641, 643, 647, 650, 652, 655, 656, 662, 664, 665, 666, 668, 669, 673, 674, 676, 677, 680, 683, 693, 696, 701, 702, 703, 705, 707, 708, 717, 719, 721, 725, 726, 727, 730, 731, 732, 733, 746, 748, 750, 758, 769, 773, 810, 811, 830, 835, 843, 845, 851, 858, 867, 874, 880, 889, 891, 892, 898, 899, 900, 926, 929, 935, 944, 946, 947, 948, 951, 959, 960, 961, 963, 964, 965, 968, 975, 989, 1000, 1011, 1013, 1015, 1018, 1047, 1048, 1049, 1075, 1098, 1106, 1107, 1119, 1120, 1125, 1129, 1146, 1147, 1158, 1163, 1166, 1167, 1187, 1195, 1197, 1198, 1199, 1200, 1202, 1203, 1204, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1218, 1219, 1220, 1221, 1222, 1223, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1248, 1279, 1281, 1282, 1284, 1291, 1292, 1293, 1296, 1297, 1313, 1324, 1329, 1338, 1339, 1342, 1346, 1352, 1354, 1367, 1368, 1375, 1376, 1383, 1384, 1394, 1398, 1399, 1402, 1403, 1417, 1429, 1437, 1443, 1445, 1446, 1454, 1470, 1472, 1475, 1479, 1484, 1490, 1500, 1501, 1502, 1505, 1507, 1509, 1518, 1527, 1528, 1534, 1537, 1563, 1589, 1599, 1601, 1609, 1615, 1620, 1626, 1628, 1629, 1630, 1631, 1633, 1634, 1649, 1658, 1664, 1704, 1714, 1738, 1742, 1743, 1746, 1749, 1753, 1754, 1755, 1756, 1757, 1762, 1763, 1767, 1769, 1770, 1771, 1775, 1781, 1785, 1789, 1794, 1798, 1799, 1801, 1802, 1803, 1804, 1809, 1810, 1817, 1824, 1829, 1833, 1836, 1837, 1838, 1841, 1842], "possibli": [1748, 1788, 1804, 1809, 1835], "post": [74, 150, 267, 312, 314, 439, 473, 568, 580, 601, 664, 737, 818, 850, 924, 1079, 1199, 1200, 1206, 1208, 1210, 1213, 1219, 1224, 1225, 1229, 1231, 1233, 1257, 1410, 1541, 1704, 1714, 1738, 1742, 1759, 1763, 1769, 1770, 1771, 1787, 1789, 1790, 1791, 1798, 1809, 1814, 1831, 1832, 1842], "post_scf": 393, "postdat": 1788, "posteriori": [106, 1759, 1774], "postreleas": 1787, "pot": [1228, 1393, 1704, 1749], "potassium": [1714, 1842], "potenit": 138, "potenti": [73, 76, 84, 89, 103, 106, 111, 121, 150, 295, 602, 614, 617, 776, 896, 925, 1015, 1206, 1209, 1211, 1213, 1216, 1225, 1227, 1228, 1231, 1262, 1264, 1376, 1392, 1393, 1583, 1590, 1597, 1598, 1611, 1659, 1660, 1669, 1678, 1690, 1704, 1706, 1711, 1714, 1726, 1738, 1749, 1750, 1754, 1757, 1761, 1766, 1770, 1776, 1778, 1781, 1782, 1790, 1791, 1798, 1799, 1802, 1803, 1805, 1824, 1832, 1836, 1837, 1842], "potential_grad": 103, "potential_integr": 110, "potential_vari": 150, "potentialint": [1817, 1827], "potfil": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "pov": 323, "powel": [1226, 1329, 1704], "power": [100, 1056, 1218, 1704, 1740, 1747, 1771, 1781, 1802, 1828, 1829, 1832, 1833, 1838, 1844], "pp": [1225, 1256, 1271, 1704, 1781], "ppl": [951, 1213, 1704], "ppl_type": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "pprint": 1752, "pps5": [1692, 1752], "pq": [13, 1753, 1798, 1817, 1838], "pqpair_idx": 1817, "pqr": 13, "pr": [1753, 1786, 1788, 1838], "practic": [8, 208, 209, 210, 342, 586, 647, 1206, 1704, 1711, 1734, 1737, 1738, 1743, 1748, 1757, 1759, 1763, 1771, 1774, 1777, 1781, 1785, 1786, 1804, 1809, 1829, 1837, 1838], "pragma": 1822, "prakash": 1836, "pre": [14, 128, 130, 145, 150, 267, 434, 982, 1199, 1214, 1704, 1708, 1737, 1738, 1740, 1742, 1746, 1747, 1748, 1749, 1757, 1759, 1760, 1762, 1765, 1773, 1775, 1782, 1783, 1784, 1785, 1787, 1803, 1809, 1814, 1819, 1832, 1833, 1838, 1839], "pre_commit": 1747, "prec": [106, 389], "preced": [284, 609, 1206, 1704, 1735, 1740, 1743, 1748, 1757, 1782, 1783, 1785, 1801], "preceed": 1796, "precis": [2, 100, 1125, 1221, 1704, 1735, 1757, 1771, 1810, 1837], "preclud": 1743, "precompil": 1781, "precomput": 0, "precondit": [0, 329, 335, 725, 811, 946, 949, 950, 1207, 1210, 1213, 1225, 1281, 1285, 1286, 1704, 1753, 1755], "precondition": [0, 1, 2, 329, 335, 483, 831, 832, 1200, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "predefin": [1743, 1747, 1752, 1756, 1809], "predict": [1781, 1786], "prefactor": [100, 329, 368, 369, 1008, 1215, 1704, 1746, 1756], "prefer": [106, 150, 151, 152, 174, 175, 207, 211, 238, 239, 244, 250, 252, 254, 275, 279, 342, 366, 379, 430, 575, 586, 605, 703, 1199, 1206, 1704, 1730, 1738, 1743, 1748, 1753, 1756, 1759, 1767, 1768, 1770, 1774, 1798, 1814, 1819, 1835, 1837, 1838], "preferenti": [1738, 1743, 1759, 1774], "prefix": [0, 86, 100, 148, 205, 288, 289, 339, 340, 388, 934, 1025, 1026, 1027, 1213, 1217, 1231, 1578, 1704, 1738, 1746, 1772, 1775, 1779, 1785, 1786, 1791, 1792, 1810, 1828, 1832], "pregener": 1738, "preiter": [276, 1735], "preliminari": [1231, 1485, 1500, 1704, 1781], "prematur": [883, 1210, 1704], "prep": 1838, "prepar": [2, 76, 84, 100, 114, 148, 267, 367, 372, 394, 1730, 1737, 1738, 1743, 1749, 1759, 1768, 1788, 1804, 1835, 1840, 1844], "prepare_result": 1794, "prepend": [96, 317, 365, 1738, 1743, 1748, 1771, 1799, 1832], "preprint": [1734, 1781], "preprocess": [380, 1767, 1768], "preprocessor": [1738, 1767, 1832], "prereleas": 1788, "prerequisit": [1735, 1781, 1831], "prescrib": 106, "presenc": [284, 670, 1024, 1206, 1217, 1704, 1714, 1724, 1740, 1770, 1838, 1842], "present": [2, 106, 150, 176, 267, 284, 286, 298, 337, 348, 381, 382, 383, 390, 609, 638, 641, 827, 944, 1125, 1206, 1210, 1213, 1221, 1226, 1231, 1339, 1620, 1704, 1714, 1738, 1740, 1743, 1749, 1753, 1754, 1755, 1756, 1757, 1759, 1763, 1764, 1767, 1770, 1771, 1774, 1776, 1782, 1785, 1786, 1788, 1789, 1794, 1798, 1802, 1803, 1804, 1824, 1826, 1829, 1832, 1833, 1837, 1838, 1839, 1840, 1842], "preserv": [106, 279, 393, 1743, 1770, 1801, 1817, 1841], "preset": 1838, "presort": [61, 1708, 1838], "presort_so_tei": 90, "press": [1692, 1734, 1752, 1781, 1828], "pressur": [390, 1232, 1665, 1704, 1706, 1714, 1842, 1843], "presum": 1801, "pretti": [389, 1837], "prevent": [138, 147, 1231, 1649, 1704, 1756, 1767, 1801, 1802, 1810, 1821, 1832, 1833, 1837, 1841], "preview": 1788, "previou": [18, 284, 393, 470, 474, 680, 729, 731, 760, 808, 1125, 1186, 1200, 1206, 1208, 1209, 1210, 1221, 1222, 1224, 1225, 1226, 1229, 1230, 1231, 1241, 1268, 1331, 1332, 1333, 1357, 1358, 1359, 1405, 1445, 1469, 1470, 1499, 1704, 1714, 1738, 1740, 1742, 1743, 1754, 1757, 1767, 1768, 1770, 1771, 1788, 1798, 1802, 1817, 1828, 1832, 1833, 1837, 1838, 1842, 1844], "previous": [243, 279, 830, 1210, 1224, 1241, 1704, 1738, 1743, 1755, 1759, 1767, 1771, 1774, 1792, 1809, 1817, 1838, 1844], "prim": 81, "primari": [8, 21, 75, 150, 265, 372, 898, 1195, 1212, 1223, 1226, 1230, 1231, 1313, 1437, 1484, 1704, 1714, 1730, 1736, 1737, 1738, 1740, 1743, 1748, 1752, 1756, 1757, 1767, 1771, 1788, 1794, 1801, 1802, 1817, 1828, 1836, 1837, 1842, 1844], "primarili": [106, 1757, 1767, 1781, 1788, 1824, 1838], "primit": [8, 81, 1101, 1220, 1704, 1775, 1810, 1824], "primitivetyp": 1827, "princip": [1226, 1339, 1704, 1802, 1838], "principal_ax": [1226, 1339, 1704], "principl": [697, 1206, 1704, 1734, 1743, 1781, 1817, 1828, 1838, 1844], "print": [0, 1, 2, 8, 9, 15, 16, 64, 73, 75, 76, 86, 87, 88, 100, 103, 105, 106, 111, 114, 115, 118, 119, 138, 147, 148, 150, 227, 228, 229, 230, 261, 267, 271, 282, 296, 300, 301, 302, 318, 319, 326, 327, 331, 332, 335, 342, 346, 356, 374, 376, 380, 383, 386, 389, 395, 397, 399, 401, 448, 452, 453, 487, 498, 525, 549, 644, 659, 667, 679, 700, 716, 807, 833, 868, 869, 886, 941, 998, 999, 1098, 1118, 1138, 1154, 1197, 1199, 1200, 1202, 1203, 1206, 1210, 1213, 1215, 1220, 1225, 1226, 1229, 1231, 1277, 1355, 1414, 1483, 1593, 1594, 1608, 1647, 1649, 1650, 1657, 1662, 1704, 1730, 1733, 1735, 1738, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1819, 1820, 1822, 1823, 1825, 1826, 1827, 1828, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "print_atom_vector": 100, "print_basi": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "print_bond_angl": 106, "print_clust": 106, "print_density_threshold": 138, "print_detail": [80, 138], "print_detail_out": 8, "print_dist": 106, "print_dpd_lookup": 90, "print_energi": [68, 84], "print_global_opt": 114, "print_gradi": 68, "print_head": [27, 76, 84, 92, 147, 1768, 1786], "print_hessian": 68, "print_in_input_format": 106, "print_level": [380, 1768], "print_lvl": 84, "print_mat": [1138, 1221, 1704, 1810], "print_mo": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "print_module_opt": 114, "print_noon": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "print_opt_param": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "print_orbit": 84, "print_out": [8, 9, 15, 16, 64, 68, 73, 80, 87, 88, 100, 106, 115, 119, 138, 148, 267, 300, 301, 302, 306, 307, 318, 319, 1772, 1800, 1828, 1832, 1833, 1834, 1844], "print_out_in_angstrom": 106, "print_out_in_bohr": 106, "print_out_of_plan": 106, "print_preiter": 84, "print_rotational_const": 106, "print_stability_analysi": 84, "print_stdout": [1743, 1752], "print_tensor_pqq": 75, "print_trail": 76, "print_trajectory_xyz_fil": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "print_vari": 1832, "print_vector": 13, "print_vib": 1772, "printer": [335, 389], "printf": 1821, "printlvl": 335, "printout": [2, 1841], "prior": [661, 1206, 1224, 1231, 1240, 1560, 1704, 1730, 1837, 1838], "priori": [1817, 1838], "prioriti": [265, 434, 1199, 1704, 1740, 1742, 1743, 1767, 1794], "pritchard": [1734, 1777, 1780, 1781, 1786], "privat": [84, 1781, 1817], "privileg": [1231, 1658, 1704, 1841], "probabl": [2, 367, 697, 881, 1206, 1210, 1704, 1738, 1750, 1757, 1764, 1776, 1785, 1788, 1808, 1828, 1844], "probe": 1781, "problem": [0, 266, 270, 271, 276, 277, 280, 342, 356, 433, 466, 498, 507, 514, 609, 726, 1199, 1200, 1201, 1202, 1206, 1208, 1225, 1231, 1242, 1499, 1704, 1717, 1738, 1742, 1743, 1753, 1755, 1757, 1770, 1771, 1781, 1782, 1786, 1790, 1804, 1808, 1810, 1821, 1828, 1837, 1838, 1839, 1841, 1844], "problemat": [1770, 1790, 1798, 1833], "proc": [1788, 1819], "proc_tabl": 1809, "proce": [106, 300, 301, 302, 318, 319, 640, 1206, 1704, 1737, 1738, 1771, 1772, 1800, 1837], "procedur": [0, 97, 106, 267, 284, 321, 393, 433, 466, 474, 496, 507, 514, 672, 686, 687, 688, 704, 729, 783, 784, 824, 825, 870, 918, 933, 1059, 1070, 1088, 1199, 1200, 1201, 1202, 1206, 1208, 1210, 1213, 1218, 1219, 1225, 1231, 1242, 1249, 1269, 1564, 1565, 1568, 1573, 1574, 1704, 1711, 1714, 1738, 1740, 1742, 1743, 1753, 1755, 1756, 1757, 1759, 1767, 1768, 1770, 1771, 1776, 1777, 1781, 1785, 1787, 1789, 1798, 1799, 1801, 1808, 1809, 1828, 1829, 1832, 1833, 1834, 1837, 1838, 1840, 1842, 1844], "process": [0, 2, 8, 86, 265, 285, 287, 336, 338, 357, 380, 570, 994, 1206, 1215, 1704, 1714, 1734, 1737, 1738, 1740, 1743, 1746, 1755, 1757, 1764, 1767, 1768, 1769, 1770, 1772, 1785, 1786, 1794, 1804, 1817, 1824, 1828, 1831, 1832, 1835, 1838, 1842, 1844], "process_grid": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "process_input": [350, 1768, 1777, 1835], "processor": [1231, 1595, 1704, 1737], "prochnow": [1734, 1781], "procrout": [1743, 1757, 1759, 1764, 1809, 1827, 1841], "procud": 1802, "prodcut": 84, "produc": [76, 314, 644, 667, 835, 1206, 1210, 1226, 1231, 1372, 1564, 1704, 1743, 1748, 1750, 1752, 1757, 1759, 1791, 1802, 1808, 1817, 1836, 1837, 1838, 1840, 1841], "product": [0, 84, 100, 128, 148, 149, 277, 329, 335, 342, 356, 666, 1206, 1704, 1730, 1733, 1742, 1753, 1755, 1756, 1757, 1770, 1771, 1776, 1781, 1783, 1810, 1817, 1835, 1837, 1838, 1841, 1843], "product_count": [277, 342, 356], "profici": 1748, "profil": [322, 325, 1231, 1620, 1704, 1748, 1777], "program": [106, 205, 235, 236, 241, 242, 265, 267, 284, 295, 303, 318, 319, 434, 574, 580, 586, 590, 609, 611, 614, 616, 622, 627, 639, 643, 648, 656, 660, 667, 679, 681, 690, 708, 709, 711, 712, 755, 833, 837, 1125, 1199, 1206, 1208, 1210, 1220, 1221, 1224, 1241, 1681, 1683, 1704, 1714, 1715, 1730, 1734, 1735, 1738, 1740, 1742, 1743, 1744, 1745, 1748, 1750, 1751, 1753, 1755, 1757, 1759, 1763, 1766, 1767, 1770, 1771, 1774, 1775, 1777, 1780, 1781, 1789, 1791, 1792, 1793, 1794, 1798, 1800, 1802, 1816, 1824, 1828, 1832, 1834, 1835, 1837, 1838, 1842, 1843, 1844], "programm": [1767, 1801, 1808, 1817, 1818, 1824], "progress": [106, 1743, 1802], "prohibit": [1738, 1763], "proj": 1738, "project": [75, 115, 150, 267, 295, 386, 399, 573, 617, 707, 1206, 1231, 1485, 1704, 1735, 1738, 1747, 1748, 1755, 1759, 1763, 1764, 1766, 1770, 1771, 1781, 1785, 1786, 1788, 1797, 1808, 1810, 1824, 1825, 1838, 1841], "project_dens": 75, "project_rot": [386, 399], "project_tran": [386, 399], "promin": 1809, "prompt": [106, 1738, 1748, 1768, 1802, 1828, 1833], "proof": 1743, "prop": [0, 70, 268, 382, 1742, 1785, 1799, 1826, 1827, 1833], "prop_al": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "prop_root": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "prop_sym": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "propag": [1, 26, 295, 1197, 1225, 1263, 1668, 1704, 1738, 1766, 1777, 1790], "propan": 1833, "proper": [608, 681, 1206, 1704, 1735, 1738, 1743, 1757, 1789, 1792, 1820, 1838], "properli": [1757, 1767], "properti": [0, 1, 2, 21, 84, 111, 147, 150, 265, 268, 291, 314, 317, 329, 341, 356, 365, 381, 386, 414, 418, 419, 489, 490, 526, 527, 601, 608, 668, 669, 681, 743, 750, 942, 1112, 1156, 1198, 1200, 1201, 1202, 1206, 1208, 1213, 1225, 1231, 1278, 1619, 1704, 1714, 1721, 1730, 1733, 1734, 1735, 1739, 1740, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1790, 1791, 1792, 1794, 1795, 1797, 1798, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1827, 1829, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "properties_al": 1785, "properties_origin": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "propertynam": 111, "proport": [1230, 1231, 1481, 1624, 1704, 1767], "propos": [2, 1759, 1760, 1770, 1777, 1830, 1838], "props1": [1714, 1842], "props2": [1714, 1842], "props3": [1714, 1842], "props4": [1714, 1799, 1842], "prospect": [1743, 1786], "protect": [1786, 1788, 1808], "protein": [11, 1692, 1752, 1763], "protocol": [87, 265, 1740, 1794, 1804], "protointvector": [88, 1827], "protomodel": [2, 1827], "proton": 1706, "proton_charge_to_mass_quoti": 1706, "proton_compton_wavelength": 1706, "proton_compton_wavelength_over_2_pi": 1706, "proton_electron_mass_ratio": 1706, "proton_g_factor": 1706, "proton_gyromag_ratio": 1706, "proton_gyromag_ratio_over_2_pi": 1706, "proton_mag_mom": 1706, "proton_mag_mom_to_bohr_magneton_ratio": 1706, "proton_mag_mom_to_nuclear_magneton_ratio": 1706, "proton_mag_shielding_correct": 1706, "proton_mass": 1706, "proton_mass_energy_equival": 1706, "proton_mass_energy_equivalent_in_mev": 1706, "proton_mass_in_u": 1706, "proton_molar_mass": 1706, "proton_muon_mass_ratio": 1706, "proton_neutron_mag_mom_ratio": 1706, "proton_neutron_mass_ratio": 1706, "proton_rms_charge_radiu": 1706, "proton_tau_mass_ratio": 1706, "prototyp": 1824, "protovector": [148, 1827], "prove": 1747, "proven": [106, 372, 378, 1768], "provid": [0, 1, 2, 8, 20, 106, 112, 139, 150, 268, 303, 314, 329, 335, 394, 584, 625, 679, 1097, 1126, 1206, 1220, 1221, 1704, 1714, 1730, 1733, 1734, 1737, 1738, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1753, 1754, 1755, 1757, 1759, 1761, 1762, 1764, 1765, 1767, 1770, 1771, 1773, 1774, 1775, 1779, 1781, 1782, 1783, 1784, 1785, 1788, 1790, 1791, 1792, 1794, 1798, 1799, 1801, 1802, 1803, 1808, 1810, 1817, 1824, 1828, 1829, 1832, 1833, 1837, 1838, 1839, 1841, 1842, 1843, 1844], "provision": [150, 1738], "proxim": [1228, 1231, 1378, 1532, 1704, 1749], "prudent": 1743, "prune": [321, 968, 1133, 1142, 1214, 1221, 1231, 1492, 1531, 1532, 1631, 1704, 1714, 1743, 1757, 1842], "psa": [662, 1206, 1704], "pseudo": [662, 1206, 1704, 1764], "pseudocanon": [989, 1215, 1704, 1746], "pseudoinvers": [100, 1135, 1221, 1704], "pseudopotenti": [602, 1206, 1704], "pseudospectr": 1838, "pshell": 1817, "psi": [0, 1, 2, 22, 23, 24, 25, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 85, 100, 150, 158, 198, 250, 284, 288, 289, 295, 318, 319, 339, 340, 354, 390, 601, 609, 611, 632, 633, 634, 652, 656, 660, 1170, 1206, 1221, 1225, 1293, 1704, 1708, 1711, 1714, 1725, 1730, 1738, 1740, 1742, 1743, 1746, 1749, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1763, 1764, 1766, 1767, 1770, 1771, 1772, 1775, 1777, 1781, 1782, 1788, 1789, 1790, 1791, 1792, 1798, 1800, 1803, 1808, 1810, 1823, 1829, 1833, 1834, 1835, 1837, 1838, 1841, 1842, 1843], "psi3": [1694, 1707, 1714, 1731, 1732, 1737, 1781, 1808, 1842], "psi4": [2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1747, 1750, 1751, 1752, 1753, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1763, 1764, 1766, 1767, 1768, 1769, 1770, 1771, 1774, 1776, 1777, 1778, 1779, 1780, 1781, 1787, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1804, 1805, 1806, 1807, 1808, 1809, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1825, 1826, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1840, 1841, 1842, 1843, 1844], "psi4_descript": 1738, "psi4_email": 1738, "psi4_io": [1738, 1767], "psi4_licens": 1738, "psi4_python": 1806, "psi4_release_firework": 1788, "psi4_skip_enable_fortran": 1738, "psi4_url": 1738, "psi4aiqc": 1738, "psi4conda": [1736, 1738, 1759, 1767, 1774, 1787, 1806, 1807, 1808], "psi4config": 1738, "psi4configvers": 1738, "psi4doc": 1788, "psi4fockci": [1738, 1777, 1780], "psi4manu": [1738, 1764, 1788, 1828], "psi4media": 1738, "psi4meta": [1785, 1788], "psi4numpi": [400, 1734, 1751, 1777, 1797, 1819, 1842], "psi4pastur": [272, 561, 1204, 1704, 1738], "psi4plugincach": 1808, "psi4rc": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "psi_": [1750, 1763, 1771, 1832], "psi_0": [1771, 1838], "psi_1": 1838, "psi_2": 1838, "psi_a_5_1": 1750, "psi_a_6_4": 1750, "psi_a_n": [1112, 1221, 1704, 1750], "psi_a_n_homo": [1112, 1221, 1704, 1750], "psi_a_n_lumo": [1112, 1221, 1704, 1750], "psi_b_n": [1112, 1221, 1704, 1750], "psi_bohr2angstrom": [1833, 1838], "psi_h": 1832, "psi_hartree2kcalmol": [1743, 1832, 1844], "psi_i": [1757, 1771, 1838], "psi_n": 1838, "psi_q": 1750, "psi_scratch": [1738, 1748, 1767], "psiaddit": 1767, "psiapi": [283, 333, 1726, 1736, 1767, 1777, 1778, 1786, 1788, 1790, 1814, 1832, 1844], "psiclean": 87, "psicod": [1717, 1736, 1737, 1738, 1748, 1764, 1781, 1787, 1828], "psidatadir": [194, 245, 1730, 1736, 1743, 1767, 1785, 1786, 1788, 1808, 1834, 1835], "psiexcept": 1827, "psif_3b_sapt_aa_df_int": 1708, "psif_3b_sapt_amp": 1708, "psif_3b_sapt_bb_df_int": 1708, "psif_3b_sapt_cc_df_int": 1708, "psif_3b_sapt_dimer_ab": 1708, "psif_3b_sapt_dimer_ac": 1708, "psif_3b_sapt_dimer_bc": 1708, "psif_3b_sapt_monomer_a": 1708, "psif_3b_sapt_monomer_b": 1708, "psif_3b_sapt_monomer_c": 1708, "psif_3b_sapt_trim": 1708, "psif_3index": 1708, "psif_aa_presort": 1708, "psif_ab_presort": 1708, "psif_ao_dgdbi": 1708, "psif_ao_dgdbx": 1708, "psif_ao_dgdbz": 1708, "psif_ao_opdm": 1708, "psif_ao_tpdm": 1708, "psif_bb_presort": 1708, "psif_cc2_het1": 1708, "psif_cc3_hc1": 1708, "psif_cc3_hc1et1": 1708, "psif_cc3_het1": 1708, "psif_cc3_misc": 1708, "psif_cc_aint": 1708, "psif_cc_aints_new": 1708, "psif_cc_bint": 1708, "psif_cc_bints_new": 1708, "psif_cc_cint": 1708, "psif_cc_cints_new": 1708, "psif_cc_denom": 1708, "psif_cc_diis_amp": 1708, "psif_cc_diis_err": 1708, "psif_cc_dint": 1708, "psif_cc_dints_new": 1708, "psif_cc_eint": 1708, "psif_cc_eints_new": 1708, "psif_cc_fint": 1708, "psif_cc_fints_new": 1708, "psif_cc_gamma": 1708, "psif_cc_gamma_new": 1708, "psif_cc_gl": 1708, "psif_cc_glg": 1708, "psif_cc_gr": 1708, "psif_cc_hbar": 1708, "psif_cc_info": 1708, "psif_cc_lambda": 1708, "psif_cc_lamp": 1708, "psif_cc_lr": 1708, "psif_cc_misc": 1708, "psif_cc_oei": 1708, "psif_cc_oei_new": 1708, "psif_cc_ramp": 1708, "psif_cc_tamp": 1708, "psif_cc_tmp": 1708, "psif_cc_tmp0": 1708, "psif_cc_tmp1": 1708, "psif_cc_tmp10": 1708, "psif_cc_tmp11": 1708, "psif_cc_tmp2": 1708, "psif_cc_tmp3": 1708, "psif_cc_tmp4": 1708, "psif_cc_tmp5": 1708, "psif_cc_tmp6": 1708, "psif_cc_tmp8": 1708, "psif_cc_tmp9": 1708, "psif_ci_c_fil": 1708, "psif_ci_d_fil": 1708, "psif_ci_hd_fil": 1708, "psif_ci_s_fil": 1708, "psif_civect": 1708, "psif_dcc_abcd1": 1708, "psif_dcc_abcd2": 1708, "psif_dcc_abci": 1708, "psif_dcc_abci2": 1708, "psif_dcc_abci3": 1708, "psif_dcc_abci4": 1708, "psif_dcc_abci5": 1708, "psif_dcc_evec": 1708, "psif_dcc_iajb": 1708, "psif_dcc_ijab": 1708, "psif_dcc_ijak": 1708, "psif_dcc_ijak2": 1708, "psif_dcc_ijkl": 1708, "psif_dcc_ovec": 1708, "psif_dcc_qso": 1708, "psif_dcc_r2": 1708, "psif_dcc_sort_start": 1708, "psif_dcc_t2": 1708, "psif_dcc_temp": 1708, "psif_dct_dens": 1708, "psif_dct_dpd": 1708, "psif_derinfo": 1708, "psif_detca": 1708, "psif_dfmp2_aia": 1708, "psif_dfmp2_qia": 1708, "psif_dfocc_ab": 1708, "psif_dfocc_amp": 1708, "psif_dfocc_den": 1708, "psif_dfocc_iabc": 1708, "psif_dfocc_iabc_aaaa": 1708, "psif_dfocc_iabc_abab": 1708, "psif_dfocc_iabc_baba": 1708, "psif_dfocc_iabc_bbbb": 1708, "psif_dfocc_ijab_aaaa": 1708, "psif_dfocc_ijab_abab": 1708, "psif_dfocc_ijab_bbbb": 1708, "psif_dfocc_int": 1708, "psif_dfocc_miabc": 1708, "psif_dfocc_miabc_aaaa": 1708, "psif_dfocc_miabc_aabb": 1708, "psif_dfocc_miabc_bbaa": 1708, "psif_dfocc_miabc_bbbb": 1708, "psif_dfocc_temp": 1708, "psif_dfscf_bj": 1708, "psif_eom_cm": 1708, "psif_eom_cmnef": 1708, "psif_eom_d": 1708, "psif_eom_r": 1708, "psif_eom_sia": 1708, "psif_eom_sijab": 1708, "psif_eom_tmp": 1708, "psif_eom_tmp0": 1708, "psif_eom_tmp1": 1708, "psif_eom_tmp_xi": 1708, "psif_eom_xi": 1708, "psif_grad": 1708, "psif_halft0": 1708, "psif_halft1": 1708, "psif_hess": 1708, "psif_intco": [1708, 1767], "psif_libdii": 1708, "psif_libtrans_a_ht": 1708, "psif_libtrans_b_ht": 1708, "psif_libtrans_dpd": 1708, "psif_mcscf": 1708, "psif_mo_aa_tei": 1708, "psif_mo_aa_tpdm": 1708, "psif_mo_ab_tei": 1708, "psif_mo_ab_tpdm": 1708, "psif_mo_bb_tei": 1708, "psif_mo_bb_tpdm": 1708, "psif_mo_lag": 1708, "psif_mo_opdm": 1708, "psif_mo_r12": 1708, "psif_mo_r12t2": 1708, "psif_mo_tei": 1708, "psif_mo_tpdm": 1708, "psif_occ_dens": 1708, "psif_occ_dpd": 1708, "psif_occ_iabc": 1708, "psif_oei": 1708, "psif_optk": 1708, "psif_psimrcc_integr": 1708, "psif_psimrcc_restart": 1708, "psif_sad": 1708, "psif_sapt_aa_df_int": 1708, "psif_sapt_ab_df_int": 1708, "psif_sapt_amp": 1708, "psif_sapt_bb_df_int": 1708, "psif_sapt_ccd": 1708, "psif_sapt_dim": 1708, "psif_sapt_lrint": 1708, "psif_sapt_monomera": 1708, "psif_sapt_monomerb": 1708, "psif_sapt_temp": 1708, "psif_scf_mo": 1708, "psif_so_erf_tei": 1708, "psif_so_erfc_tei": 1708, "psif_so_pk": 1708, "psif_so_pksuper1": 1708, "psif_so_pksuper2": 1708, "psif_so_presort": 1708, "psif_so_r12": 1708, "psif_so_r12t1": 1708, "psif_so_tei": 1708, "psif_tpdm_halftran": 1708, "psif_tpdm_presort": 1708, "psif_wk_pk": 1708, "psifil": [150, 1764, 1788], "psimrcc": [295, 400, 1704, 1705, 1709, 1714, 1766, 1777, 1790, 1842], "psimrcc_scf": [295, 1766], "psinet": 1788, "psio": [86, 87, 100, 148, 157, 1714, 1842], "psio_entri": [86, 1827], "psio_open_new": 86, "psio_open_old": 86, "psioh": [400, 1767, 1777], "psiomanag": 87, "psipath": [106, 1730, 1743, 1767, 1774, 1782, 1808, 1835], "psipep": 1777, "psireturntyp": [216, 217, 1827], "psithon": [283, 333, 366, 379, 380, 891, 1210, 1704, 1738, 1767, 1768, 1777, 1778, 1781, 1786, 1788, 1790, 1796, 1802, 1814, 1828, 1840, 1843], "psithon1": [1714, 1842], "psithon2": [1714, 1715, 1842], "psivar": [317, 365, 1714, 1799, 1837, 1842, 1843], "psixa": 1738, "psize": 1817, "psutil": 1738, "pt": [1230, 1443, 1704, 1707, 1731, 1798, 1837], "pt2": [1229, 1402, 1704, 1714, 1829, 1842], "pt_energi": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "pte": [1227, 1375, 1704, 1724, 1742, 1749, 1754, 1803], "pthread": 1738, "ptpss": [295, 1695, 1696, 1697, 1698, 1700, 1702, 1758, 1766], "ptype": 1794, "ptype_s": 1794, "pubchem": [1714, 1726, 1734, 1832, 1842], "pubchem1": [1714, 1842], "pubchem2": [1714, 1842], "public": [106, 574, 701, 706, 1206, 1704, 1734, 1737, 1738, 1753, 1770, 1774, 1781, 1788, 1798, 1817, 1836, 1837], "publish": [0, 1787, 1792, 1837], "pulai": [443, 445, 479, 519, 543, 584, 647, 1199, 1200, 1202, 1203, 1206, 1692, 1704, 1734, 1752, 1763, 1789, 1838], "pull": [265, 399, 1737, 1738, 1740, 1768, 1786, 1788, 1794, 1803, 1833], "pull_gha_instal": 1788, "pure": [0, 81, 82, 363, 835, 1157, 1210, 1221, 1704, 1738, 1743, 1757, 1782, 1808, 1810, 1817, 1828, 1831, 1838, 1844], "puream": [0, 1, 2, 8, 691, 1206, 1704, 1707, 1711, 1714, 1722, 1730, 1731, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "purpl": 1750, "purpos": [2, 111, 267, 390, 665, 671, 1096, 1206, 1219, 1704, 1714, 1756, 1757, 1759, 1781, 1801, 1810, 1829, 1834, 1841, 1842], "purvi": [584, 1206, 1704, 1734, 1742, 1771], "purview": 1785, "push": [1737, 1786, 1788, 1823], "push_back": 1817, "push_back_external_potenti": 84, "put": [0, 313, 364, 1755, 1785, 1815, 1821, 1833], "pv": [284, 295, 318, 319, 1694, 1714, 1730, 1732, 1733, 1740, 1741, 1743, 1766, 1768, 1779, 1800, 1832, 1842], "pv1": 346, "pv5z": [284, 1694, 1707, 1731, 1732, 1738, 1740, 1838], "pv6z": [1694, 1707, 1731, 1732], "pv_5pd_z": [1694, 1707, 1731, 1732], "pv_6pd_z": [1694, 1707, 1731, 1732], "pv_dpd_z": [1694, 1707, 1730, 1731, 1732], "pv_qpd_z": [1694, 1707, 1731, 1732], "pv_tpd_z": [1694, 1707, 1731, 1732], "pvdef": 346, "pvdz": [11, 106, 150, 262, 265, 284, 295, 318, 319, 1694, 1707, 1710, 1711, 1714, 1715, 1716, 1720, 1723, 1727, 1729, 1730, 1731, 1732, 1735, 1738, 1740, 1743, 1750, 1753, 1756, 1757, 1759, 1762, 1763, 1766, 1767, 1768, 1770, 1771, 1774, 1792, 1794, 1800, 1802, 1805, 1828, 1832, 1833, 1836, 1837, 1838, 1841, 1842, 1844], "pvdzp": [1707, 1731], "pvp": 103, "pvqz": [284, 1694, 1707, 1710, 1714, 1731, 1732, 1738, 1740, 1741, 1743, 1832, 1842], "pvtz": [2, 284, 318, 319, 376, 397, 1063, 1218, 1694, 1704, 1707, 1711, 1714, 1719, 1727, 1730, 1731, 1732, 1738, 1740, 1743, 1757, 1800, 1829, 1832, 1836, 1837, 1838, 1842], "pvxz": [1733, 1836], "pw6b95": [295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "pw86b95": [295, 318, 319, 1695, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "pw86pbe": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "pw91": [295, 318, 319, 1695, 1697, 1698, 1699, 1703, 1758, 1766, 1800], "pwb6k": [295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "pwcv": [1694, 1732, 1733], "pwcv5z": [1694, 1707, 1731, 1732], "pwcv_5pd_z": [1694, 1707, 1731, 1732], "pwcv_dpd_z": [1694, 1707, 1731, 1732], "pwcv_qpd_z": [1694, 1707, 1731, 1732], "pwcv_tpd_z": [1694, 1707, 1731, 1732], "pwcvdz": [1694, 1707, 1731, 1732], "pwcvqz": [1694, 1707, 1731, 1732], "pwcvtz": [1694, 1707, 1731, 1732], "pwcvxz": [1733, 1836], "pwpb95": [295, 1695, 1696, 1697, 1698, 1700, 1702, 1758, 1766], "px": 1817, "py": [106, 265, 372, 1227, 1377, 1704, 1714, 1718, 1730, 1738, 1740, 1747, 1748, 1750, 1752, 1757, 1764, 1770, 1772, 1774, 1786, 1788, 1794, 1797, 1801, 1808, 1817, 1819, 1822, 1833, 1834, 1835, 1842, 1843], "py2": [1738, 1748], "py3": [1738, 1748, 1786], "py310": 1748, "py35": 1748, "py36_sse41_0": 1748, "py38": 1748, "py39": 1748, "py39_4": 1748, "pybind11": [1738, 1808, 1823, 1833], "pybind11_builtin": 1827, "pybind11_object": [3, 5, 6, 7, 8, 9, 12, 15, 16, 17, 19, 20, 21, 27, 30, 61, 62, 63, 64, 68, 73, 74, 75, 76, 78, 79, 80, 81, 82, 83, 86, 87, 89, 90, 91, 92, 94, 95, 97, 98, 99, 100, 101, 103, 104, 105, 106, 108, 110, 111, 112, 113, 114, 115, 118, 120, 122, 123, 124, 125, 126, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 143, 147, 149, 150, 183, 184, 233, 1827], "pyc": 1738, "pydant": [265, 1738, 1740, 1768, 1772, 1794, 1827], "pyddx": 1754, "pylibefp": 1738, "pymod_install_libdir": [2, 1738], "pymod_lib_dir": 1786, "pymodul": 1808, "pymol": 1790, "pypi": [1, 1754, 1764], "pypy_s2": [1692, 1752], "pypy_t3": [1692, 1752], "pyridin": [1692, 1752], "pyrrol": [1714, 1842], "pytest": [1738, 1748, 1767, 1772, 1777, 1788, 1814, 1843], "pytest_collection_modifyitem": 1788, "pytest_output": 1788, "pytestmark": 2, "python": [0, 1, 2, 64, 73, 106, 111, 235, 236, 247, 249, 267, 300, 301, 302, 318, 319, 363, 380, 400, 1070, 1219, 1231, 1553, 1704, 1711, 1714, 1715, 1716, 1736, 1737, 1740, 1743, 1747, 1748, 1750, 1752, 1755, 1757, 1759, 1764, 1767, 1768, 1771, 1772, 1774, 1777, 1778, 1779, 1781, 1782, 1785, 1786, 1788, 1795, 1796, 1799, 1800, 1801, 1802, 1804, 1805, 1808, 1818, 1819, 1824, 1831, 1834, 1835, 1838, 1840, 1842, 1844], "python3": 1738, "python_execut": 1738, "python_include_dir": 1738, "python_librari": 1738, "pythond": [1088, 1219, 1704, 1771], "pythonhom": 1808, "pythonpath": [2, 1738, 1752, 1759, 1767, 1786, 1806, 1807, 1808], "pythonx": 1738, "pywrap": [1711, 1714, 1740, 1743, 1779, 1833, 1842], "pz": 1817, "q": [3, 13, 103, 143, 144, 275, 284, 295, 386, 389, 810, 1210, 1683, 1694, 1704, 1707, 1722, 1723, 1731, 1732, 1733, 1734, 1740, 1753, 1756, 1766, 1772, 1775, 1776, 1781, 1792, 1793, 1798, 1838], "q00": 1776, "q10": 1776, "q11": 1776, "q11c": 1776, "q20": 1776, "q21": 1776, "q21c": 1776, "q22": 1776, "q22c": 1776, "q5": [284, 1733, 1740], "q56": [1733, 1740], "qam": 1817, "qc": [150, 266, 268, 270, 276, 726, 745, 746, 1208, 1704, 1714, 1740, 1743, 1748, 1753, 1767, 1768, 1772, 1783, 1794, 1842], "qc2p": 1711, "qc_coupl": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "qc_modul": [0, 1, 2, 268, 295, 1704, 1730, 1733, 1735, 1740, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1793, 1794, 1795, 1797, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "qc_molecul": 1735, "qc_type": [0, 1, 2, 745, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "qcarchiv": 1794, "qcdb": [2, 106, 150, 383, 384, 385, 386, 387, 388, 389, 390, 399, 1714, 1726, 1730, 1759, 1764, 1768, 1774, 1831, 1842, 1843], "qcelement": [2, 106, 265, 1738, 1740, 1754, 1772, 1794, 1827, 1833], "qcengin": [2, 106, 265, 267, 1738, 1740, 1759, 1767, 1770, 1774, 1794], "qcfractal": 1794, "qchem": [1226, 1324, 1704, 1714, 1722, 1802, 1842], "qchf": [0, 1, 2, 295, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "qci": 1771, "qcisd": [190, 284, 295, 665, 1083, 1084, 1085, 1087, 1206, 1219, 1680, 1704, 1714, 1739, 1740, 1766, 1776, 1777, 1781, 1790, 1842], "qcportal": [265, 1740, 1772, 1794], "qcschema": [265, 367, 372, 378, 1721, 1740, 1767, 1772, 1794], "qcvar": 367, "qcvariabl": [150, 151, 152, 171, 174, 175, 176, 207, 211, 212, 230, 238, 239, 244, 254, 255, 262, 263, 267, 346, 367, 1740, 1770, 1772, 1776, 1777, 1794, 1809], "qlm": 1776, "qm": [106, 1019, 1020, 1022, 1216, 1228, 1378, 1382, 1704, 1714, 1722, 1749, 1776, 1781, 1782, 1790, 1842], "qmc": [297, 347], "qmefp": [0, 1, 2, 1704, 1722, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "qmefp_elst": [1019, 1216, 1704], "qmefp_pol": [1020, 1216, 1704], "qmmm": [1827, 1838], "qmmmbohr": [274, 1827, 1838], "qmo": 30, "qnr": [944, 1213, 1704, 1798], "qoo": 30, "qov": 30, "qp": 1798, "qpq": 27, "qr": 1838, "qrhf": [658, 670, 671, 672, 1206, 1704], "qrhf_orbit": [671, 1206, 1704], "qshell": 1817, "qsize": 1817, "qso": 30, "qt": 1810, "qtp0": [386, 1772], "qua": 1734, "quad": 1730, "quadrat": [295, 746, 1208, 1229, 1403, 1704, 1753, 1756, 1763, 1766, 1776, 1781, 1790, 1838], "quadratur": [147, 637, 1206, 1231, 1535, 1704, 1757, 1767, 1776, 1799, 1838], "quadrature_valu": 147, "quadrupl": [284, 295, 1714, 1740, 1741, 1742, 1743, 1756, 1763, 1766, 1771, 1776, 1792, 1793, 1842], "quadrupli": [697, 1206, 1704], "quadrupol": [89, 103, 111, 127, 142, 317, 365, 381, 382, 669, 1206, 1669, 1673, 1685, 1704, 1706, 1714, 1776, 1799, 1817, 1826, 1842], "quadrupoleint": [1817, 1827], "qualit": [1757, 1770], "qualiti": [2, 1692, 1742, 1752, 1753, 1755, 1757, 1770, 1781], "quan": 1734, "quantifi": [1754, 1828, 1844], "quantit": [1230, 1689], "quantiti": [138, 329, 377, 433, 466, 507, 514, 641, 728, 1199, 1200, 1201, 1202, 1206, 1208, 1225, 1230, 1242, 1463, 1704, 1708, 1714, 1742, 1750, 1754, 1767, 1776, 1785, 1794, 1799, 1802, 1810, 1817, 1823, 1824, 1832, 1833, 1834, 1837, 1842], "quantum": [1, 2, 265, 574, 608, 692, 884, 1206, 1210, 1232, 1666, 1704, 1706, 1734, 1738, 1740, 1742, 1743, 1746, 1749, 1756, 1757, 1762, 1765, 1771, 1775, 1776, 1781, 1782, 1794, 1797, 1803, 1824, 1827, 1828, 1834, 1838, 1841, 1843], "quantum_of_circul": 1706, "quantum_of_circulation_times_2": 1706, "quantumlib": 1738, "quartet": [92, 1817, 1838], "quartic": [573, 574, 1206, 1704], "quasi": [944, 1213, 1704, 1798], "quasiparticl": [794, 1210, 1704, 1757], "quench": 1838, "queri": [96, 138, 370, 1801, 1817, 1822], "query_libxc": 96, "question": [1743, 1752, 1786, 1804, 1816, 1835], "queu": 1767, "queue": [1736, 1767], "quick": [2, 138, 1714, 1738, 1746, 1749, 1759, 1762, 1764, 1765, 1767, 1770, 1773, 1774, 1775, 1782, 1783, 1784, 1797, 1803, 1806, 1807, 1817, 1839, 1840, 1842], "quickli": [1764, 1770, 1833], "quicktest": [2, 1738], "quiet": [2, 8, 96, 150, 250, 251, 374, 395, 1794], "quintupl": [295, 1766, 1792, 1793], "quit": [388, 1692, 1714, 1738, 1743, 1752, 1756, 1757, 1781, 1785, 1797, 1828, 1833, 1838, 1842, 1844], "quiz": [1736, 1738, 1767], "quot": [1764, 1796, 1828, 1832], "quotient": 1706, "qvv": 30, "qx": 1817, "qy": 1817, "qz": [1733, 1738, 1817], "qz2p": [1707, 1711, 1731, 1743], "qzvp": [1694, 1707, 1731, 1732, 1733], "qzvpd": [1694, 1707, 1731, 1732, 1733], "qzvpp": [1694, 1707, 1731, 1732, 1733], "qzvppd": [1694, 1707, 1731, 1732, 1733], "r": [2, 3, 13, 75, 110, 143, 144, 335, 346, 356, 384, 394, 426, 1198, 1226, 1230, 1337, 1366, 1470, 1679, 1689, 1704, 1706, 1714, 1734, 1738, 1743, 1750, 1753, 1757, 1759, 1763, 1764, 1776, 1777, 1780, 1781, 1786, 1788, 1792, 1798, 1799, 1806, 1817, 1828, 1832, 1833, 1836, 1837, 1838, 1841, 1842, 1844], "r0": 1761, "r1": [1100, 1220, 1704, 1775], "r2": [1100, 1220, 1704, 1775], "r2scan": [295, 318, 319, 1695, 1698, 1702, 1703, 1716, 1718, 1758, 1766, 1774, 1781, 1800], "r2scan0": [295, 318, 319, 1695, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "r2scan3c": [295, 1718, 1766, 1774], "r2scan50": [295, 318, 319, 1695, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "r2scanh": [295, 318, 319, 1695, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "r3": [1100, 1220, 1704, 1775], "r4": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "r_": [1692, 1752, 1757, 1759, 1763, 1837, 1838], "r_0": 1759, "r_1": [1757, 1838], "r_2": [1757, 1838], "r_a": 75, "r_b": 75, "r_converg": [2, 342, 356, 949, 1079, 1704, 1730, 1733, 1735, 1739, 1740, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "r_e": [1714, 1842], "r_k": 329, "r_point": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ra": [782, 785, 786, 789, 790, 792, 794, 795, 796, 797, 798, 837, 859, 860, 875, 877, 878, 879, 882, 890, 1102, 1210, 1221, 1673, 1704, 1714, 1755, 1805, 1810, 1842], "rab": 1802, "radial": [775, 969, 1134, 1139, 1143, 1209, 1214, 1221, 1231, 1493, 1494, 1519, 1533, 1534, 1542, 1597, 1632, 1633, 1704, 1754, 1757, 1776, 1799, 1838], "radial_scal": 323, "radian": [1226, 1340, 1343, 1704], "radianc": 1706, "radiat": [550, 1203, 1704, 1706, 1742], "radic": [1692, 1714, 1752, 1757, 1842], "radii": [106, 323, 771, 772, 773, 1100, 1209, 1220, 1226, 1303, 1341, 1704, 1714, 1715, 1724, 1754, 1757, 1759, 1775, 1802, 1842], "radiiset": 1803, "radiu": [0, 1, 2, 106, 323, 773, 1209, 1226, 1228, 1344, 1345, 1382, 1503, 1504, 1516, 1519, 1704, 1706, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "raghavachari": [1734, 1742, 1771], "rai": [323, 1781], "rais": [2, 84, 150, 255, 262, 279, 297, 318, 319, 347, 374, 395, 1125, 1221, 1225, 1229, 1245, 1246, 1247, 1253, 1254, 1255, 1265, 1272, 1273, 1274, 1275, 1421, 1422, 1704, 1771, 1798, 1800, 1802, 1809, 1837], "ram": [1817, 1832], "raman": [454, 539, 551, 673, 674, 679, 1199, 1203, 1206, 1704, 1742], "ran": 1738, "rand": [100, 148, 331, 1797], "random": [100, 106, 148, 331, 994, 1215, 1231, 1656, 1704, 1746, 1797, 1841], "rang": [0, 1, 92, 106, 138, 295, 318, 319, 400, 761, 774, 1209, 1226, 1231, 1357, 1358, 1359, 1360, 1511, 1529, 1530, 1695, 1698, 1699, 1703, 1704, 1710, 1714, 1730, 1750, 1754, 1757, 1759, 1766, 1767, 1768, 1781, 1794, 1800, 1802, 1817, 1824, 1832, 1833, 1837, 1838, 1842], "ranged_bend": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ranged_coord": 1802, "ranged_dihedr": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ranged_dist": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ranged_oofp": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "rangl": [411, 430, 433, 466, 507, 513, 514, 557, 568, 575, 641, 727, 787, 884, 917, 1198, 1199, 1200, 1201, 1202, 1204, 1206, 1208, 1210, 1213, 1225, 1242, 1704, 1714, 1742, 1755, 1756, 1757, 1763, 1771, 1798, 1829, 1836, 1838, 1841, 1842], "rank": [1810, 1838], "ranlib": 1746, "raphson": [635, 652, 746, 944, 1206, 1208, 1213, 1225, 1226, 1279, 1368, 1704, 1753, 1789, 1798, 1802], "rapid": [1734, 1781, 1819], "rapp": [1734, 1754], "rare": [1692, 1752, 1754, 1757, 1794, 1809, 1810, 1837, 1838], "ras1": [0, 1, 2, 13, 1704, 1714, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "ras2": [0, 1, 2, 13, 1704, 1714, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "ras3": [0, 1, 2, 13, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ras34_max": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ras3_max": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ras4": [0, 1, 2, 13, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ras4_max": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "rasci": [1714, 1755, 1781, 1842], "rasscf": [295, 381, 382, 843, 891, 1210, 1704, 1714, 1734, 1755, 1766, 1781, 1789, 1826, 1842], "rate": [1757, 1759, 1776, 1817, 1824], "rather": [2, 8, 106, 150, 192, 193, 203, 204, 388, 609, 863, 867, 1065, 1087, 1206, 1210, 1219, 1704, 1726, 1737, 1738, 1740, 1742, 1743, 1748, 1755, 1759, 1764, 1767, 1768, 1771, 1774, 1801, 1809, 1817, 1821, 1829, 1838, 1841], "ratio": [352, 1042, 1045, 1218, 1230, 1231, 1470, 1658, 1669, 1685, 1690, 1704, 1706, 1757, 1776, 1798, 1799, 1837, 1841], "ration": [635, 652, 1206, 1226, 1368, 1704, 1759, 1802], "rational": 1834, "ravel": 11, "raw": [268, 370, 380, 1735, 1768, 1799], "raw_compute_properti": 21, "raw_geom": [1692, 1752], "raw_input": [380, 1768], "raw_plot": 76, "rb": [1707, 1731], "rb1": 1783, "rc": [1738, 1748, 1767], "rc04": [295, 318, 319, 1695, 1698, 1700, 1703, 1758, 1766, 1800], "rcc": 1833, "rch1": 1833, "rch2": 1833, "rch3": 1833, "rcond": 335, "rcphf": [719, 1207, 1704], "rdm": [62, 1807], "re": [2, 64, 106, 300, 301, 302, 457, 1199, 1226, 1231, 1327, 1649, 1704, 1707, 1708, 1714, 1730, 1731, 1734, 1737, 1738, 1742, 1748, 1755, 1761, 1764, 1772, 1785, 1786, 1788, 1798, 1801, 1804, 1808, 1809, 1817, 1821, 1828, 1832, 1833, 1835, 1838, 1841, 1842, 1844], "reach": [106, 318, 319, 842, 1210, 1231, 1490, 1554, 1704, 1743, 1755, 1800, 1838, 1841], "reactant": [1835, 1843], "reaction": [1692, 1743, 1752, 1755, 1776, 1781, 1790, 1835, 1843], "reactiv": 1838, "read": [2, 12, 100, 148, 150, 217, 298, 303, 348, 474, 575, 638, 731, 837, 838, 954, 1186, 1200, 1206, 1208, 1210, 1213, 1222, 1225, 1226, 1231, 1268, 1270, 1300, 1563, 1583, 1592, 1704, 1711, 1714, 1738, 1739, 1742, 1743, 1747, 1748, 1749, 1755, 1757, 1764, 1767, 1768, 1769, 1775, 1782, 1785, 1786, 1788, 1802, 1812, 1828, 1832, 1833, 1837, 1838, 1842, 1844], "read1": [1714, 1842], "read2": [1714, 1842], "read3": [1714, 1842], "read_glob": [114, 1801], "read_opt": [326, 1764, 1787, 1801, 1814], "read_scf_3index": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "readabl": [266, 268, 269, 270, 276, 277, 278, 280, 1752, 1809, 1821], "reader": [697, 1206, 1704, 1755, 1837], "readi": [84, 377, 1738, 1748, 1752, 1768, 1782, 1788], "readili": [1782, 1785, 1798], "readm": [1738, 1788, 1839], "readthedoc": 1738, "reagent": [1743, 1752, 1779, 1835], "real": [79, 100, 106, 356, 385, 386, 1714, 1743, 1768, 1772, 1795, 1810, 1828, 1833, 1838, 1841, 1842], "realign": 1746, "realiz": [1757, 1824], "realli": [2, 1737, 1767, 1785], "realloc": [88, 148], "reanalyz": 1770, "reap": [350, 351, 1752, 1779, 1840], "rearrang": [575, 1206, 1704, 1788], "reason": [680, 1206, 1704, 1738, 1742, 1753, 1755, 1757, 1763, 1770, 1781, 1786, 1801, 1802, 1817, 1824, 1833, 1837, 1838], "reassign": 1770, "rebas": [1737, 1786], "rebuild": [106, 359, 1231, 1568, 1704, 1736, 1737, 1746, 1749, 1762, 1765, 1767, 1773, 1775, 1782, 1783, 1784, 1788, 1803, 1839], "recal": [1730, 1782], "recalc": [300, 301, 302, 1772], "recc": [2, 383], "recent": [434, 1199, 1704, 1738, 1742, 1757, 1759, 1776, 1781, 1802, 1817, 1823, 1833, 1837, 1838], "recip": [1785, 1788, 1837], "reciproc": 1838, "recogn": [195, 197, 200, 318, 319, 1738, 1742, 1743, 1755, 1757, 1768, 1781, 1800, 1832], "recomennd": 1832, "recommend": [430, 568, 570, 577, 584, 586, 664, 666, 685, 726, 727, 764, 1044, 1199, 1206, 1208, 1209, 1218, 1230, 1231, 1441, 1454, 1459, 1460, 1461, 1463, 1498, 1532, 1704, 1730, 1738, 1742, 1747, 1748, 1754, 1770, 1776, 1790, 1798, 1805, 1810, 1817, 1824, 1836, 1837, 1841], "recompil": [1730, 1738, 1751, 1808, 1824, 1834, 1835], "recomput": [147, 1226, 1231, 1323, 1558, 1704, 1802, 1837], "reconcil": [1743, 1788], "reconfigur": 1738, "recontract": 1836, "record": [87, 370, 580, 620, 1206, 1704, 1767, 1786, 1788, 1804], "recov": [1763, 1837], "recoveri": 1810, "rectif": [669, 1206, 1704], "recurs": [2, 1738, 1817], "red": [1738, 1748, 1750], "redefin": [315, 316, 1828], "redhat": 1738, "redirect": [153, 1767, 1788], "redist": [1228, 1384, 1704, 1749], "redistribut": [1228, 1231, 1379, 1380, 1381, 1382, 1384, 1655, 1704, 1749, 1835, 1841], "reduc": [0, 20, 386, 389, 568, 572, 575, 641, 681, 727, 875, 1009, 1206, 1208, 1210, 1215, 1226, 1231, 1306, 1491, 1704, 1730, 1740, 1746, 1753, 1755, 1756, 1757, 1771, 1772, 1776, 1798, 1802, 1817, 1821, 1833, 1838], "reduct": [0, 1231, 1232, 1634, 1666, 1704, 1756, 1833, 1838, 1843], "redund": [884, 1106, 1107, 1146, 1147, 1210, 1221, 1226, 1313, 1352, 1704, 1738, 1759, 1776, 1798, 1802, 1810, 1817, 1838], "reev": [1225, 1284, 1704], "reevalu": 106, "ref": [106, 265, 1226, 1336, 1704, 1714, 1724, 1740, 1743, 1752, 1764, 1772, 1776, 1787, 1794, 1801, 1802, 1809, 1814, 1842], "ref_dft_2": [1714, 1842], "ref_gradi": [300, 301, 302, 1772], "ref_mol": 106, "ref_wfn": [160, 161, 162, 163, 164, 165, 166, 167, 173, 177, 178, 179, 181, 185, 186, 190, 218, 241, 242, 295, 394, 1766, 1809], "refactor": 2, "refenc": 1755, "refenergi": 2, "refer": [2, 11, 61, 68, 150, 267, 268, 284, 285, 286, 287, 295, 327, 329, 336, 337, 338, 352, 356, 377, 381, 382, 383, 394, 448, 453, 475, 494, 508, 570, 586, 597, 616, 658, 660, 662, 672, 676, 835, 851, 861, 881, 1150, 1201, 1206, 1211, 1212, 1214, 1221, 1224, 1226, 1229, 1235, 1238, 1314, 1335, 1339, 1401, 1404, 1411, 1434, 1615, 1629, 1658, 1670, 1673, 1674, 1675, 1676, 1682, 1684, 1692, 1704, 1711, 1714, 1715, 1725, 1726, 1727, 1730, 1733, 1734, 1735, 1736, 1739, 1740, 1741, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1756, 1757, 1759, 1760, 1761, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1828, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "referenc": [1764, 1775, 1776, 1833], "reference_sym": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "reference_wavefunct": 150, "refin": 1759, "refit": 1837, "reflect": [106, 139, 235, 236, 1736, 1737, 1738, 1748, 1801], "refmat": 2, "reform": 1834, "reformul": 1838, "refract": [368, 369], "refresh": 9, "reg_param": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "regain": 1784, "regard": [96, 265, 1740, 1794, 1837], "regardless": [1743, 1781, 1803, 1829], "regex": [1738, 1743, 1764], "region": [635, 652, 1206, 1228, 1231, 1379, 1532, 1704, 1749, 1757, 1763, 1838], "regist": [2, 283, 333, 1740, 1808], "register_composite_funct": 1740, "register_xtpl_funct": 1740, "registerpython": 1748, "registr": 2, "regress": [2, 1760], "reguess": 1768, "regul": [1743, 1837], "regula": 1757, "regular": [0, 1, 2, 87, 153, 295, 380, 761, 955, 1209, 1229, 1231, 1426, 1428, 1522, 1523, 1524, 1525, 1526, 1704, 1714, 1730, 1733, 1735, 1738, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "regularli": [1754, 1785], "rehash": 86, "rehn": [1734, 1781], "reiher": [1777, 1780, 1836], "reiniti": [170, 1832], "reinterpret": 106, "reinterpret_coordentri": 106, "reinvok": 1738, "reissu": 1738, "reiter": 1837, "reject": [1226, 1335, 1704], "rel": [2, 603, 608, 1054, 1206, 1218, 1704, 1714, 1738, 1747, 1753, 1757, 1763, 1767, 1802, 1808, 1817, 1824, 1838, 1842, 1843], "relat": [0, 322, 669, 833, 865, 1206, 1210, 1704, 1708, 1740, 1757, 1763, 1771, 1776, 1802, 1817, 1838], "relationship": [1706, 1817, 1828], "relative_geom": 2, "relativisitc": 1836, "relativist": [0, 1, 2, 284, 677, 1206, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1779, 1780, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1790, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "relax": [0, 1, 2, 76, 417, 418, 600, 608, 665, 674, 675, 678, 743, 749, 910, 1198, 1206, 1208, 1212, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "relax_guess_orbit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "releas": [279, 467, 574, 669, 1200, 1206, 1704, 1737, 1738, 1748, 1750, 1755, 1757, 1767, 1777, 1781, 1783, 1786, 1787, 1819, 1828], "relev": [21, 267, 394, 616, 1206, 1704, 1738, 1742, 1743, 1755, 1757, 1759, 1767, 1788, 1829, 1837, 1838], "reli": [0, 106, 1738, 1756, 1757, 1773, 1783, 1784, 1823, 1824, 1837, 1838], "reliabl": [1738, 1742, 1757, 1781, 1833, 1838], "relink": 1738, "reload": 371, "relocat": 1738, "relpotentialint": 1817, "remain": [457, 570, 1199, 1206, 1704, 1714, 1737, 1742, 1781, 1788, 1789, 1804, 1809, 1810, 1817, 1824, 1828, 1833, 1837, 1842, 1844], "remaind": 1835, "remak": [1738, 1786], "remap": 1833, "remark": 1757, "rememb": [786, 1210, 1704, 1737, 1738, 1801, 1817], "remigio": [1734, 1777, 1780, 1781, 1786, 1841], "remind": [1756, 1837], "remot": [1737, 1787, 1788, 1814], "remov": [1, 2, 5, 86, 100, 150, 168, 174, 175, 176, 321, 384, 386, 671, 823, 977, 984, 1206, 1210, 1214, 1225, 1228, 1229, 1231, 1245, 1246, 1247, 1253, 1254, 1255, 1265, 1272, 1273, 1274, 1275, 1380, 1381, 1382, 1384, 1421, 1422, 1535, 1548, 1589, 1602, 1704, 1738, 1743, 1746, 1748, 1749, 1754, 1759, 1762, 1764, 1765, 1767, 1773, 1774, 1775, 1782, 1783, 1784, 1787, 1788, 1794, 1798, 1803, 1806, 1807, 1808, 1810, 1814, 1817, 1832, 1833, 1834, 1837, 1838, 1839], "removal_polici": 321, "remove_symmetri": 100, "remp": [957, 1106, 1213, 1221, 1225, 1289, 1297, 1704, 1714, 1734, 1798, 1842], "remp2": [295, 318, 319, 1675, 1684, 1739, 1766, 1776, 1781, 1798, 1800], "remp_a": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "renam": [2, 295, 1714, 1737, 1766, 1767, 1837, 1842], "rendel": [1225, 1271, 1704, 1734], "render": [1750, 1764, 1770, 1771, 1788], "renorm": [295, 1009, 1215, 1231, 1560, 1704, 1766, 1836], "reopen": 234, "reopen_outfil": 153, "reoptim": 1838, "reorder": [106, 166, 1231, 1576, 1704], "reorder_out_of_cor": [1231, 1620, 1704], "reorient": [1782, 1833], "reparameter": 1759, "repeat": [1231, 1565, 1704, 1714, 1753, 1788, 1809, 1837, 1842], "repeatedli": [1800, 1832], "repl_otf": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "replac": [8, 279, 373, 380, 391, 669, 882, 1206, 1210, 1704, 1730, 1733, 1737, 1738, 1743, 1748, 1753, 1763, 1768, 1771, 1788, 1808, 1817, 1828, 1833, 1835, 1836, 1837, 1844], "replic": [284, 351, 1231, 1628, 1704, 1740, 1768], "repo": [1737, 1738, 1748, 1786, 1788], "report": [2, 488, 1200, 1692, 1704, 1734, 1738, 1743, 1750, 1752, 1759, 1774, 1781, 1782, 1792, 1802, 1818, 1828, 1836, 1837, 1838, 1841, 1843, 1844], "repositori": [2, 1736, 1747, 1748, 1757, 1767, 1781, 1785, 1788, 1805, 1806, 1814, 1824, 1834], "repr": [268, 1714, 1842], "repres": [8, 110, 149, 284, 300, 301, 302, 335, 388, 1126, 1221, 1704, 1709, 1730, 1740, 1748, 1757, 1764, 1771, 1772, 1776, 1781, 1790, 1802, 1805, 1810, 1832, 1837], "represent": [0, 15, 91, 106, 120, 139, 150, 268, 318, 319, 363, 386, 402, 422, 495, 531, 539, 569, 593, 609, 616, 660, 679, 697, 704, 1125, 1197, 1198, 1200, 1202, 1203, 1206, 1221, 1231, 1657, 1704, 1742, 1750, 1753, 1754, 1763, 1767, 1768, 1771, 1772, 1781, 1797, 1798, 1800, 1802, 1810, 1817, 1827, 1837, 1838, 1841], "representa": 106, "reproduc": [413, 1198, 1704, 1714, 1738, 1828, 1837, 1842], "repuls": [2, 69, 73, 106, 144, 294, 298, 345, 348, 1016, 1216, 1228, 1392, 1670, 1690, 1704, 1743, 1756, 1770, 1771, 1776, 1828, 1836, 1837, 1838, 1839, 1844], "request": [13, 84, 145, 147, 150, 244, 262, 267, 268, 269, 295, 300, 301, 302, 303, 489, 490, 574, 576, 577, 586, 604, 616, 635, 650, 655, 664, 665, 669, 673, 676, 693, 694, 1125, 1200, 1202, 1206, 1221, 1224, 1230, 1231, 1236, 1241, 1464, 1465, 1466, 1589, 1704, 1730, 1737, 1738, 1739, 1740, 1742, 1743, 1752, 1753, 1755, 1757, 1759, 1766, 1767, 1769, 1771, 1772, 1775, 1776, 1781, 1788, 1794, 1795, 1799, 1803, 1804, 1817, 1828, 1829, 1832, 1833, 1837, 1838, 1841, 1844], "requir": [0, 1, 2, 84, 138, 265, 272, 284, 314, 329, 342, 356, 383, 426, 463, 503, 561, 573, 608, 614, 621, 623, 647, 664, 669, 679, 690, 699, 708, 727, 811, 823, 826, 837, 872, 875, 888, 930, 949, 958, 1095, 1198, 1199, 1200, 1201, 1204, 1206, 1208, 1210, 1213, 1217, 1219, 1223, 1225, 1231, 1266, 1290, 1629, 1634, 1704, 1713, 1730, 1735, 1736, 1740, 1743, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1763, 1764, 1767, 1769, 1770, 1771, 1772, 1773, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1801, 1802, 1803, 1808, 1810, 1817, 1819, 1821, 1823, 1824, 1828, 1829, 1832, 1833, 1836, 1837, 1838, 1839, 1844], "rerend": 1788, "rerun": [640, 1206, 1704], "res_norm": [277, 342, 356], "rescu": 1838, "research": [1750, 1806, 1839], "reserv": 1785, "reset": [2, 73, 84, 169, 370, 374, 395, 1759, 1788, 1801, 1802], "reset_ci_h0block": 13, "reset_occ_": 84, "reset_occup": 84, "reset_point_group": [106, 1838], "reset_so_int": 90, "reshap": [150, 255, 367, 386, 1740, 1772, 1794], "resid": [1740, 1834], "residu": [0, 84, 277, 321, 329, 335, 342, 356, 377, 491, 500, 594, 606, 645, 736, 747, 752, 876, 949, 953, 976, 1005, 1029, 1200, 1206, 1208, 1210, 1213, 1214, 1215, 1218, 1225, 1229, 1230, 1231, 1285, 1287, 1424, 1442, 1654, 1704, 1708, 1746, 1753, 1755, 1757, 1763, 1785, 1798, 1837, 1838, 1841], "resolut": [1756, 1757, 1771, 1785, 1838], "resolv": [267, 1743, 1746, 1759, 1838], "reson": [574, 679, 1206, 1704], "resort": [106, 430, 1199, 1704, 1838], "resourc": [194, 245, 1095, 1219, 1704, 1738, 1764, 1767, 1771, 1785, 1821], "resp": [1029, 1218, 1230, 1442, 1704, 1738, 1748, 1837], "respect": [0, 106, 150, 363, 621, 651, 671, 674, 681, 742, 1206, 1208, 1217, 1704, 1714, 1735, 1738, 1743, 1747, 1752, 1753, 1760, 1771, 1776, 1779, 1785, 1789, 1798, 1799, 1802, 1817, 1828, 1833, 1836, 1838, 1841, 1842, 1844], "respons": [0, 165, 271, 377, 445, 454, 551, 608, 639, 736, 741, 747, 750, 946, 1044, 1119, 1199, 1203, 1206, 1208, 1213, 1218, 1221, 1225, 1230, 1281, 1288, 1478, 1704, 1708, 1714, 1721, 1734, 1737, 1743, 1749, 1753, 1754, 1776, 1790, 1798, 1799, 1803, 1817, 1824, 1835, 1837, 1841, 1842, 1844], "response1": [1714, 1842], "response2": [1714, 1842], "response3": [1714, 1842], "response_algorithm": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "rest": [616, 1206, 1224, 1241, 1704, 1706, 1756, 1764, 1767, 1804, 1817, 1828, 1838, 1844], "restart": [0, 1, 2, 295, 393, 440, 493, 672, 680, 991, 1010, 1200, 1206, 1215, 1224, 1226, 1241, 1353, 1367, 1704, 1730, 1733, 1735, 1739, 1740, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1790, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1839, 1840, 1841, 1843, 1844], "restart_eom_cc3": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "restart_fil": [295, 1766, 1767, 1838], "restor": [326, 327, 328, 357, 1801, 1809], "restrict": [0, 2, 13, 106, 187, 215, 286, 295, 298, 314, 337, 348, 392, 592, 662, 676, 794, 875, 1164, 1165, 1206, 1210, 1221, 1229, 1231, 1429, 1615, 1658, 1673, 1704, 1711, 1713, 1714, 1739, 1742, 1753, 1755, 1756, 1757, 1766, 1771, 1776, 1781, 1785, 1788, 1789, 1791, 1798, 1799, 1802, 1817, 1828, 1838, 1841, 1842, 1844], "restricted_docc": [0, 1, 2, 1704, 1714, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "restricted_uocc": [0, 1, 2, 1704, 1714, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "restructur": 1804, "restructuredtext": [1777, 1808], "result": [0, 2, 76, 100, 150, 222, 265, 295, 300, 301, 302, 318, 319, 329, 350, 370, 377, 384, 388, 389, 470, 539, 568, 584, 601, 623, 671, 729, 835, 1098, 1200, 1203, 1206, 1208, 1210, 1220, 1225, 1229, 1230, 1231, 1283, 1294, 1405, 1463, 1499, 1704, 1714, 1726, 1735, 1738, 1740, 1742, 1743, 1752, 1753, 1755, 1756, 1757, 1759, 1763, 1766, 1767, 1768, 1770, 1771, 1775, 1776, 1777, 1781, 1788, 1790, 1794, 1798, 1800, 1802, 1804, 1810, 1817, 1823, 1824, 1828, 1829, 1833, 1834, 1835, 1836, 1838, 1840, 1841, 1842, 1844], "result_id": [265, 1740, 1794], "results_list": [1740, 1794], "resum": 1822, "ret": [321, 335, 1740, 1772, 1794], "ret_energi": 1794, "ret_gradi": 1794, "ret_hessian": 1794, "ret_ptyp": 1794, "retag": 1788, "retain": [87, 295, 433, 466, 467, 507, 514, 617, 808, 1009, 1065, 1199, 1200, 1201, 1202, 1206, 1210, 1215, 1219, 1225, 1242, 1704, 1736, 1742, 1746, 1757, 1766, 1767, 1771, 1776, 1798, 1843], "retent": [87, 1714, 1842], "retir": 1748, "retriev": [1801, 1817, 1824, 1833], "retrigg": 1788, "return": [0, 2, 3, 5, 8, 9, 11, 12, 13, 14, 15, 16, 17, 18, 20, 21, 64, 75, 76, 81, 84, 86, 87, 88, 89, 91, 92, 94, 95, 100, 101, 102, 103, 105, 106, 110, 115, 118, 120, 126, 128, 130, 132, 138, 139, 140, 145, 147, 148, 149, 150, 151, 152, 176, 182, 183, 184, 191, 194, 195, 196, 197, 198, 199, 200, 202, 205, 208, 209, 210, 212, 221, 222, 225, 226, 231, 238, 239, 255, 259, 262, 263, 265, 267, 282, 284, 290, 291, 292, 294, 295, 296, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 313, 314, 317, 318, 319, 321, 322, 324, 325, 327, 328, 329, 330, 331, 332, 334, 335, 341, 342, 343, 344, 345, 348, 349, 350, 351, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 395, 396, 397, 399, 640, 1206, 1704, 1714, 1737, 1738, 1740, 1743, 1750, 1752, 1755, 1759, 1761, 1766, 1768, 1769, 1772, 1774, 1775, 1776, 1777, 1785, 1786, 1791, 1794, 1797, 1799, 1800, 1801, 1808, 1809, 1810, 1817, 1823, 1826, 1833, 1834, 1838, 1841, 1842, 1843], "return_arrai": 106, "return_atomlist": 8, "return_dict": 106, "return_handl": 2, "return_histori": [318, 319, 1800], "return_messag": 2, "return_molecul": 106, "return_result": [265, 1740, 1794], "return_total_data": 1794, "return_wfn": [11, 150, 291, 295, 296, 297, 300, 301, 302, 303, 306, 307, 314, 317, 318, 319, 341, 347, 365, 1740, 1749, 1750, 1766, 1767, 1769, 1772, 1775, 1791, 1794, 1799, 1800, 1828, 1832, 1837, 1838, 1841, 1844], "reus": [300, 301, 302, 457, 1199, 1704, 1714, 1740, 1742, 1757, 1772, 1828, 1842, 1843], "rev": [1714, 1734, 1781, 1786, 1788, 1842], "revamp": 106, "revb3lyp": [295, 318, 319, 1695, 1698, 1700, 1703, 1758, 1766, 1800], "revers": [350, 833, 1210, 1704], "review": [1749, 1770, 1781, 1787, 1788, 1814, 1828, 1837, 1844], "revis": [295, 318, 319, 1692, 1695, 1697, 1698, 1700, 1702, 1703, 1752, 1758, 1766, 1788, 1800, 1837], "revm06": [295, 318, 319, 1695, 1698, 1702, 1703, 1758, 1766, 1800], "revok": [370, 1757, 1802], "revoke_chang": 1801, "revoke_global_option_chang": [1757, 1801], "revoke_local_option_chang": 1801, "revpb": [295, 318, 319, 1695, 1697, 1698, 1699, 1703, 1758, 1766, 1800], "revpbe0": [295, 318, 319, 1695, 1697, 1698, 1700, 1703, 1758, 1766, 1800], "revscan": [295, 318, 319, 1695, 1698, 1702, 1703, 1758, 1766, 1800], "revscan0": [295, 318, 319, 1695, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "revtpss": [295, 318, 319, 1695, 1697, 1698, 1702, 1703, 1758, 1766, 1800], "revtpssh": [295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "reward": 1837, "reweight": 1776, "rewrit": 1786, "rewritten": [356, 1781, 1838], "rezac": [1692, 1752], "rf": [1738, 1767, 1802], "rfa": [635, 652, 656, 1206, 1704], "rfo": [1226, 1361, 1362, 1363, 1366, 1368, 1704, 1802], "rfo_follow_root": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "rfo_normalization_max": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "rfo_root": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "rgc1": 1752, "rgen": 1743, "rgensen": 1734, "rgi": 1734, "rh": [100, 335, 1707, 1731], "rhf": [0, 1, 11, 297, 300, 301, 302, 347, 381, 382, 409, 421, 448, 453, 456, 475, 492, 494, 508, 553, 560, 565, 597, 640, 664, 676, 681, 748, 851, 880, 1187, 1197, 1198, 1199, 1200, 1201, 1203, 1204, 1205, 1206, 1208, 1210, 1211, 1212, 1214, 1222, 1231, 1599, 1674, 1676, 1682, 1704, 1711, 1714, 1719, 1725, 1739, 1742, 1743, 1746, 1749, 1753, 1754, 1755, 1756, 1757, 1763, 1771, 1772, 1781, 1792, 1798, 1801, 1803, 1809, 1826, 1827, 1828, 1829, 1832, 1833, 1836, 1838, 1841, 1842, 1844], "rhf_energi": 133, "rhf_triplet": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "rho": [110, 323, 1230, 1231, 1478, 1543, 1704, 1750], "rho_": [1750, 1757], "rhs_vec": 335, "ri": [2, 733, 892, 899, 963, 1208, 1211, 1212, 1214, 1230, 1231, 1446, 1506, 1694, 1704, 1707, 1714, 1730, 1731, 1732, 1733, 1756, 1770, 1771, 1785, 1828, 1837, 1838, 1842, 1844], "ri_spac": 115, "ribier": [1225, 1284, 1704], "rich": [1824, 1828, 1844], "richard": [1781, 1786], "rifit": [8, 1837], "right": [100, 284, 296, 323, 356, 411, 430, 466, 513, 514, 557, 1198, 1199, 1200, 1202, 1204, 1669, 1704, 1708, 1714, 1722, 1726, 1739, 1740, 1741, 1742, 1753, 1755, 1756, 1757, 1769, 1771, 1776, 1781, 1785, 1788, 1798, 1801, 1821, 1829, 1837, 1838, 1841, 1842], "rightarrow": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "rigid": [106, 1226, 1317, 1704, 1782], "rigor": [1757, 1837], "ring": 1802, "ripling": 1734, "risc": [575, 1206, 1704], "rise": 1743, "risk": 1738, "rizzo": [377, 1734, 1841], "rizzo2011": [1734, 1841], "rk": [1231, 1599, 1704, 1714, 1739, 1756, 1757, 1781, 1798, 1801, 1842], "rksfunction": 1827, "rl": 1788, "rle": [584, 1206, 1704], "rlxd": [1692, 1752], "rm": [100, 276, 321, 386, 606, 632, 736, 747, 752, 854, 857, 876, 958, 1002, 1206, 1208, 1210, 1213, 1215, 1225, 1226, 1231, 1290, 1364, 1365, 1497, 1549, 1562, 1648, 1704, 1706, 1738, 1742, 1743, 1746, 1752, 1753, 1755, 1767, 1772, 1776, 1789, 1798, 1802, 1828, 1832, 1836, 1837, 1838, 1844], "rmp2": 1756, "rmroutfil": 100, "rms_": [1226, 1324, 1704, 1802], "rms_disp_g_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "rms_force_g_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "rms_mograd_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "rmsd": 106, "rn": [1707, 1731, 1788], "ro": [394, 1734], "roa": [381, 382, 454, 551, 1199, 1203, 1704, 1742, 1826], "roa_tensor": [381, 382, 551, 1203, 1704, 1742, 1826], "rob": [1692, 1752, 1837], "robert": [1750, 1756, 1757, 1770, 1799, 1838], "roberto": [1803, 1841], "robust": [2, 811, 968, 1133, 1142, 1210, 1214, 1221, 1231, 1492, 1532, 1549, 1631, 1704, 1748, 1755, 1756, 1757, 1792, 1802, 1841], "rocket": [1714, 1842], "roh": 1832, "rohf": [11, 84, 295, 381, 382, 456, 461, 475, 492, 497, 562, 566, 586, 640, 658, 662, 664, 672, 676, 748, 861, 880, 1187, 1199, 1200, 1204, 1205, 1206, 1208, 1210, 1212, 1222, 1230, 1231, 1441, 1599, 1674, 1682, 1704, 1710, 1711, 1713, 1714, 1723, 1739, 1742, 1746, 1755, 1756, 1757, 1766, 1771, 1776, 1781, 1792, 1798, 1803, 1809, 1826, 1827, 1828, 1829, 1837, 1838, 1842, 1844], "rohf_ccsdt_q_": 1723, "rok": 1757, "role": [1, 2, 8, 1738, 1743, 1746, 1749, 1754, 1756, 1762, 1765, 1773, 1775, 1782, 1783, 1784, 1785, 1788, 1801, 1803, 1835, 1837, 1839], "roll": [2, 1804], "rollin": [1782, 1802, 1843], "roo": [1707, 1731, 1734, 1755, 1789, 1836], "root": [11, 13, 150, 277, 314, 342, 356, 419, 468, 470, 471, 489, 496, 502, 505, 527, 609, 681, 783, 787, 811, 828, 829, 842, 870, 871, 887, 992, 1004, 1198, 1200, 1202, 1206, 1215, 1224, 1226, 1229, 1231, 1236, 1237, 1238, 1239, 1363, 1412, 1415, 1640, 1641, 1642, 1655, 1668, 1669, 1673, 1690, 1704, 1714, 1738, 1740, 1742, 1746, 1747, 1748, 1752, 1762, 1764, 1765, 1773, 1775, 1776, 1782, 1783, 1784, 1785, 1788, 1790, 1791, 1795, 1802, 1829, 1838, 1839, 1841, 1842], "roots_per_irrep": [0, 2, 407, 1704, 1730, 1733, 1735, 1739, 1740, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "rot": [1713, 1843], "rot_const": 390, "rotat": [97, 100, 106, 139, 381, 382, 384, 386, 390, 399, 454, 539, 551, 574, 617, 640, 681, 695, 701, 704, 845, 852, 855, 1000, 1024, 1183, 1188, 1189, 1190, 1191, 1199, 1203, 1206, 1210, 1215, 1217, 1222, 1225, 1232, 1279, 1666, 1669, 1704, 1713, 1714, 1729, 1742, 1743, 1746, 1750, 1757, 1772, 1776, 1789, 1798, 1802, 1810, 1826, 1828, 1838, 1842, 1843, 1844], "rotate_column": 100, "rotate_mcscf_integr": 13, "rotate_mo_angl": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "rotate_mo_irrep": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "rotate_mo_p": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "rotate_mo_q": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "rotate_n": 139, "rotate_orbit": 84, "rotate_theta": 139, "rotation": [617, 707, 1206, 1704], "rotational_const": 106, "rotational_strength": [381, 382, 1826], "rotational_symmetry_numb": [0, 1, 2, 106, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1844], "rotatori": [377, 1668, 1669, 1690, 1776, 1841], "rotor": [106, 390], "rotor_typ": [106, 390], "rough": [1714, 1757, 1833, 1838, 1842], "roughli": [1, 2, 404, 1197, 1704, 1748, 1756, 1770], "round": [1692, 1743, 1752, 1776, 1821], "roundoff": [1755, 1828, 1844], "roundtrip": [1714, 1842], "rout": [247, 1158, 1221, 1704, 1714, 1730, 1738, 1743, 1753, 1759, 1774, 1792, 1809, 1835, 1842], "routin": [70, 154, 155, 156, 157, 159, 266, 270, 276, 277, 352, 372, 786, 823, 1210, 1704, 1742, 1767, 1775, 1781, 1801, 1812, 1817, 1824, 1828, 1838, 1841, 1844], "row": [2, 100, 183, 184, 292, 343, 389, 629, 630, 631, 1206, 1704, 1733, 1770, 1774, 1775, 1776, 1810, 1817, 1832, 1837, 1838], "rowdim": [100, 148, 183, 184, 331, 1797], "rpa": [1231, 1656, 1704, 1714, 1841, 1842], "rpbe": [295, 318, 319, 1695, 1697, 1698, 1699, 1703, 1758, 1766, 1800], "rqd": 1740, "rs6000": [575, 1206, 1704], "rs_i_rfo": [1226, 1368, 1704, 1802], "rse30": [1692, 1752], "rshell": 1817, "rsize": 1817, "rsp": [811, 1210, 1704, 1755], "rsrfo_alpha_max": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "rst": [1764, 1785, 1786, 1788, 1804, 1808, 1823], "rstr_docc": 1810, "rstr_uocc": 1810, "rt": [1748, 1788, 1806, 1807], "rt_atom": [106, 390], "rt_linear": 390, "rt_symmetric_top": 106, "rtd": 1794, "rtol": 2, "rtype": [351, 375, 396, 1740], "ru": [388, 1707, 1731], "rudimentari": 1838, "ruhe": 1841, "rule": [346, 1743, 1755, 1757, 1788, 1835, 1838], "run": [106, 150, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 173, 177, 178, 179, 180, 181, 185, 186, 190, 215, 218, 232, 237, 241, 242, 265, 277, 279, 284, 295, 303, 308, 342, 356, 393, 562, 570, 590, 611, 614, 616, 632, 633, 634, 637, 652, 656, 660, 681, 698, 700, 715, 844, 849, 964, 1204, 1206, 1207, 1210, 1214, 1231, 1490, 1500, 1585, 1649, 1656, 1704, 1714, 1730, 1737, 1740, 1748, 1752, 1754, 1755, 1763, 1766, 1767, 1768, 1770, 1772, 1775, 1777, 1778, 1780, 1785, 1787, 1790, 1794, 1795, 1799, 1801, 1805, 1806, 1808, 1809, 1813, 1814, 1823, 1829, 1831, 1832, 1833, 1834, 1835, 1837, 1838, 1839, 1840, 1841, 1842], "run_": 393, "run_ccsd": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "run_cctransort": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "run_cepa": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "run_cfour": 1743, "run_dct": 1809, "run_detci": 1809, "run_dfocc": 1809, "run_dftd3": [106, 1759], "run_dftd4": [106, 1759], "run_fnocc": 1809, "run_gcp": [106, 1774], "run_methodnam": 1809, "run_methodname_gradi": 1809, "run_mirror": 106, "run_mp2": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "run_mp2_5": 1834, "run_mp3": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "run_mp4": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "run_myplugin": 1808, "run_occ": 1809, "run_psi4": 1738, "run_resort": 106, "run_scf": 1809, "run_to_complet": 106, "runabl": 2, "rung": [138, 267, 1759], "runner": [2, 323, 1828], "runtest": 1788, "runtim": [1735, 1748, 1763, 1764, 1777, 1785, 1838], "russ": 1781, "ruud": [377, 1734], "rval": [1743, 1761, 1828, 1832, 1844], "rw": 2, "rx": [1750, 1817], "rxn": 1776, "rxnm": 1835, "ry": [1750, 1817], "rydberg": 1706, "rydberg_const": 1706, "rydberg_constant_times_c_in_hz": 1706, "rydberg_constant_times_hc_in_ev": 1706, "rydberg_constant_times_hc_in_j": 1706, "ryno": [1734, 1781], "rz": [1750, 1817], "s0009": 1740, "s00214": [295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1740, 1758, 1766, 1781, 1800], "s0065": 1781, "s1": [90, 1817], "s11": [1692, 1752], "s2": [90, 1817], "s22": [1714, 1715, 1718, 1757, 1828, 1832, 1842, 1844], "s220": [1692, 1752], "s22_dd": [1692, 1752], "s22_hb": [1692, 1752], "s22_mx": [1692, 1752], "s22a": [1692, 1752], "s22b": [1692, 1752, 1832], "s22by5": 1832, "s3": [90, 1735], "s4": 90, "s6": [68, 1759], "s66": 1832, "s66by8": 1832, "s66x10": [1714, 1842], "s8": [68, 106, 1759], "s_": [1759, 1763, 1838], "s_6": 1759, "s_8": 1759, "s_9": 1759, "s_cholesky_toler": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "s_cut": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "s_n": 1759, "s_orthogon": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "s_toler": [0, 1, 2, 1506, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "s_vib": 1843, "sa": [783, 1210, 1704, 1714, 1842], "sackur": 1706, "sackur_tetrode_constant_1_k_100_kpa": 1706, "sackur_tetrode_constant_1_k_101325_kpa": 1706, "sacrif": [2, 1838], "sad": [8, 1501, 1563, 1603, 1604, 1605, 1607, 1608, 1609, 1610, 1704, 1707, 1708, 1714, 1731, 1757, 1770, 1781, 1837, 1838, 1842], "sad1": [1714, 1842], "sad_": 84, "sad_chol_toler": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "sad_d_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "sad_e_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "sad_frac_occ": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "sad_maxit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "sad_print": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "sad_scf_typ": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "sad_spin_averag": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "saddl": 1838, "sadguess": 1827, "sadlej": [1694, 1707, 1731, 1732, 1733], "sadno": [1231, 1563, 1704, 1838], "saeb": 1734, "safe": [329, 586, 1206, 1704, 1738, 1743, 1757, 1767], "safer": 1785, "safeti": [714, 1051, 1207, 1218, 1230, 1231, 1482, 1618, 1704, 1821, 1837], "sai": [609, 1206, 1704, 1748, 1767, 1786, 1809], "said": 0, "saika": [1817, 1839], "saitow": [1781, 1786], "salc": [15, 16, 134, 386], "salc_nam": 16, "salccompon": 1827, "salvag": 1770, "sam": 1817, "same": [2, 13, 100, 106, 115, 148, 150, 259, 267, 284, 329, 331, 352, 370, 437, 446, 450, 457, 471, 484, 523, 547, 616, 629, 630, 631, 736, 764, 887, 939, 993, 1068, 1082, 1097, 1158, 1199, 1200, 1202, 1203, 1206, 1208, 1209, 1210, 1213, 1215, 1219, 1220, 1221, 1224, 1225, 1231, 1241, 1294, 1555, 1669, 1670, 1674, 1675, 1676, 1680, 1684, 1689, 1692, 1704, 1711, 1714, 1730, 1735, 1738, 1740, 1742, 1743, 1746, 1748, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1764, 1767, 1770, 1771, 1774, 1775, 1776, 1779, 1781, 1785, 1794, 1797, 1799, 1801, 1802, 1810, 1817, 1821, 1828, 1832, 1833, 1837, 1838, 1840, 1842, 1843, 1844], "same_a_b_den": 150, "same_a_b_orb": 150, "samp": 1776, "sampl": [0, 2, 295, 318, 319, 400, 1714, 1716, 1718, 1730, 1735, 1738, 1742, 1743, 1746, 1748, 1755, 1759, 1762, 1764, 1766, 1767, 1774, 1777, 1778, 1779, 1780, 1781, 1787, 1792, 1800, 1803, 1808, 1828, 1832, 1833], "sample_hf_and_dft": 1735, "san": 1738, "sandbox": [1748, 1785], "sandwich": [611, 632, 633, 634, 652, 656, 1206, 1692, 1704, 1743, 1752], "sanit": [359, 392], "saniti": [84, 1832], "sao0": [1047, 1218, 1704, 1770], "sao1": [1047, 1218, 1704, 1770], "sao2": [1047, 1218, 1704, 1770], "saox": [1048, 1218, 1704, 1770], "sap": [1231, 1563, 1704, 1781, 1838], "sap_grasp_larg": [1707, 1731], "sap_grasp_smal": [1707, 1731], "sap_helfem_larg": [1231, 1611, 1704, 1707, 1731, 1838], "sap_helfem_smal": [1707, 1731], "sapfit": 1838, "sapgau": [1231, 1563, 1611, 1704, 1838], "sapgau_basi": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "sapt": [0, 1, 2, 76, 295, 346, 393, 400, 1029, 1038, 1039, 1042, 1043, 1044, 1045, 1046, 1064, 1218, 1442, 1445, 1446, 1448, 1450, 1453, 1454, 1455, 1459, 1460, 1461, 1463, 1470, 1471, 1475, 1479, 1679, 1704, 1705, 1708, 1709, 1711, 1714, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1779, 1780, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1790, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1828, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "sapt0": [76, 295, 346, 1230, 1448, 1450, 1464, 1465, 1466, 1479, 1679, 1689, 1704, 1708, 1711, 1714, 1752, 1766, 1770, 1776, 1781, 1790, 1828, 1833, 1842, 1844], "sapt0_e10": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "sapt0_e20disp": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "sapt0_e20ind": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "sapt1": [1714, 1748, 1842], "sapt10": [1714, 1842], "sapt11": [1714, 1842], "sapt2": [295, 1230, 1447, 1449, 1451, 1479, 1480, 1689, 1704, 1708, 1714, 1766, 1776, 1781, 1837, 1842], "sapt3": [1714, 1842], "sapt4": [1714, 1842], "sapt5": [1714, 1842], "sapt6": [1714, 1842], "sapt7": [1714, 1842], "sapt8": [1714, 1842], "sapt9": [1714, 1842], "sapt_basi": 1837, "sapt_dft_do_dhf": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "sapt_dft_do_hybrid": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "sapt_dft_exch_disp_fixed_scal": [0, 1, 2, 1470, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "sapt_dft_exch_disp_scale_schem": [0, 1, 2, 1469, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "sapt_dft_funct": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "sapt_dft_grac_determin": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "sapt_dft_grac_shift_a": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "sapt_dft_grac_shift_b": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "sapt_dft_mp2_disp_alg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "sapt_fdds_disp_leg_lambda": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "sapt_fdds_disp_num_point": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "sapt_fdds_v2_rho_cutoff": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "sapt_level": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "sapt_mem_check": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "sapt_mem_factor": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "sapt_mem_safeti": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "sapt_os_scal": 1785, "sapt_quiet": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1843, 1844], "satisfi": [284, 372, 658, 755, 1079, 1086, 1206, 1208, 1219, 1704, 1736, 1740, 1753, 1755, 1767, 1771, 1804], "saue": 1734, "save": [100, 106, 111, 135, 148, 295, 297, 326, 327, 329, 347, 370, 575, 682, 842, 862, 882, 900, 1206, 1210, 1212, 1226, 1231, 1367, 1507, 1614, 1704, 1708, 1721, 1736, 1747, 1753, 1755, 1761, 1766, 1772, 1777, 1785, 1788, 1790, 1792, 1801, 1817, 1837, 1838], "save_dens": 323, "save_density_and_energi": 84, "save_fock": [14, 128, 130, 145], "save_info": 1801, "save_jk": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "save_molecul": 323, "save_optim": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "save_pairwise_disp": [267, 1759], "save_string_xyz": 106, "save_string_xyz_fil": 106, "save_uhf_no": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "save_xyz_fil": 106, "savelowertriangl": 100, "savesubblock": 100, "savetyp": [100, 1827], "savez": [100, 148], "saw": [1828, 1844], "sb": [1707, 1731], "sb98": [295, 318, 319, 1695, 1698, 1700, 1703, 1758, 1766, 1800], "sbeck": [1231, 1528, 1704, 1757], "sc": [138, 148, 295, 400, 459, 460, 921, 923, 959, 1067, 1068, 1081, 1082, 1092, 1093, 1094, 1199, 1213, 1219, 1225, 1254, 1255, 1283, 1291, 1293, 1294, 1669, 1674, 1675, 1676, 1684, 1695, 1696, 1697, 1698, 1700, 1702, 1704, 1707, 1711, 1714, 1731, 1756, 1757, 1766, 1771, 1776, 1785, 1798, 1832, 1837, 1842], "sca": [314, 1791], "scalabl": [1810, 1837], "scalar": [2, 76, 110, 150, 176, 212, 255, 262, 263, 367, 677, 1040, 1052, 1206, 1218, 1704, 1740, 1743, 1750, 1762, 1777, 1790, 1839], "scalar_vari": 150, "scale": [0, 12, 100, 106, 148, 295, 329, 436, 437, 449, 450, 458, 459, 568, 683, 694, 703, 772, 852, 907, 908, 921, 922, 923, 936, 937, 938, 939, 943, 1042, 1045, 1046, 1064, 1067, 1068, 1081, 1082, 1093, 1196, 1199, 1206, 1209, 1210, 1212, 1213, 1218, 1219, 1223, 1225, 1230, 1231, 1256, 1283, 1293, 1294, 1453, 1469, 1470, 1556, 1704, 1734, 1738, 1739, 1742, 1750, 1754, 1756, 1757, 1759, 1763, 1766, 1770, 1771, 1776, 1777, 1780, 1781, 1785, 1789, 1790, 1802, 1803, 1832, 1833, 1838], "scale_column": 100, "scale_row": 100, "scalmani": 1734, "scan": [295, 318, 319, 1695, 1697, 1698, 1702, 1703, 1711, 1714, 1726, 1738, 1758, 1766, 1768, 1778, 1800, 1802, 1808, 1832, 1842], "scan0": [295, 318, 319, 1695, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "scarc": 1738, "scenario": 1738, "scene": [1743, 1770, 1772, 1800, 1832], "scf": [2, 8, 18, 74, 76, 84, 150, 226, 241, 242, 266, 267, 276, 284, 286, 291, 294, 295, 296, 297, 300, 301, 302, 312, 314, 317, 318, 319, 326, 327, 337, 341, 345, 347, 365, 381, 382, 393, 400, 423, 439, 473, 511, 533, 556, 567, 576, 580, 581, 589, 597, 601, 623, 638, 640, 648, 660, 664, 667, 670, 672, 676, 681, 684, 685, 688, 689, 697, 717, 721, 736, 737, 747, 818, 833, 835, 850, 851, 924, 954, 995, 1000, 1004, 1079, 1166, 1169, 1175, 1179, 1181, 1194, 1198, 1199, 1200, 1201, 1202, 1203, 1205, 1206, 1207, 1208, 1210, 1213, 1215, 1219, 1221, 1222, 1223, 1224, 1225, 1227, 1229, 1233, 1257, 1376, 1410, 1485, 1490, 1497, 1500, 1502, 1510, 1541, 1552, 1555, 1568, 1604, 1605, 1607, 1609, 1615, 1616, 1617, 1619, 1643, 1648, 1664, 1669, 1670, 1671, 1674, 1675, 1676, 1677, 1680, 1682, 1704, 1705, 1708, 1709, 1711, 1712, 1713, 1714, 1724, 1725, 1727, 1730, 1733, 1735, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1749, 1750, 1752, 1753, 1754, 1756, 1759, 1762, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1774, 1776, 1777, 1781, 1782, 1786, 1789, 1791, 1794, 1795, 1798, 1799, 1800, 1801, 1802, 1803, 1808, 1809, 1817, 1824, 1826, 1828, 1832, 1833, 1834, 1837, 1840, 1841, 1842, 1844], "scf1": [1714, 1842], "scf2": [1714, 1842], "scf3": [1714, 1842], "scf4": [1711, 1714, 1743, 1832, 1842], "scf5": [1714, 1727, 1842], "scf6": [1714, 1842], "scf7": [1714, 1838, 1842], "scf__e_converg": 1828, "scf__refer": [376, 397], "scf_alpha": [284, 1740], "scf_basi": [284, 1740, 1741], "scf_conv": 1743, "scf_dtot": 74, "scf_e": [295, 1754, 1766, 1828, 1844], "scf_energi": 1749, "scf_helper": 1809, "scf_initial_acceler": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "scf_initial_finish_diis_transit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "scf_initial_start_diis_transit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "scf_mem_safety_factor": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "scf_method": 312, "scf_properti": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "scf_respons": 1841, "scf_scheme": [284, 1740, 1741], "scf_subtyp": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "scf_type": [0, 1, 2, 84, 92, 327, 1231, 1507, 1510, 1620, 1704, 1714, 1729, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1828, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "scf_wfn": [284, 295, 1740, 1766, 1828, 1838, 1844], "scf_xtpl_helgaker_2": [284, 1740], "scf_xtpl_helgaker_3": [284, 1740], "scf_xtpl_karton_2": [284, 1740], "scf_xtpl_truhlar_2": [284, 1740], "scfconvergenceerror": 1827, "sch": [1229, 1433, 1704, 1734, 1781, 1833], "schaefer": [1714, 1734, 1781, 1786, 1798, 1842], "schaffer": [1734, 1837], "schaftenaar": 1791, "schema": [106, 265, 1721, 1740, 1767, 1768, 1772, 1794], "scheme": [0, 97, 284, 434, 444, 482, 521, 545, 590, 635, 652, 662, 665, 786, 833, 968, 1133, 1142, 1199, 1200, 1202, 1203, 1206, 1210, 1214, 1221, 1226, 1228, 1230, 1231, 1329, 1394, 1469, 1470, 1492, 1518, 1528, 1532, 1534, 1537, 1631, 1633, 1704, 1714, 1741, 1742, 1743, 1750, 1757, 1759, 1767, 1770, 1776, 1782, 1802, 1804, 1817, 1831, 1837, 1838, 1842], "scheme1": [1231, 1629, 1704], "scheurer": [1734, 1777, 1780, 1781], "schieber": [1734, 1781], "schirmer": [0, 1734, 1781], "schlegel": [1226, 1342, 1704, 1734, 1802, 1810], "schmidt": [100, 752, 1208, 1704, 1734], "schmidt_add_residual_toler": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "schoenfli": [106, 120, 1150, 1221, 1704], "schoenflies_symbol": 106, "schriber": [1734, 1781, 1837, 1841], "schwarz": [415, 740, 905, 1053, 1167, 1198, 1208, 1212, 1218, 1221, 1224, 1230, 1231, 1234, 1455, 1569, 1704, 1837, 1838], "schwarz_cutoff": 1785, "sch\u00fc\u00fcrmann": 1734, "sci": [1734, 1781], "scientif": [1748, 1779, 1781], "scientist": 1740, "scipi": [334, 1738], "scipt": 1786, "scope": [195, 197, 208, 209, 235, 236, 248, 249, 326, 1230, 1454, 1704, 1743, 1774, 1801, 1832, 1837], "scrambl": [106, 1795], "scrape": 1764, "scraper": 1764, "scratch": [87, 150, 168, 288, 289, 339, 340, 354, 380, 867, 1210, 1704, 1736, 1743, 1748, 1757, 1764, 1768, 1777, 1781, 1833, 1837], "scratch_dir": 1767, "scratch_messi": 1788, "screen": [0, 1, 2, 92, 143, 295, 300, 301, 302, 415, 740, 905, 967, 982, 1015, 1053, 1131, 1198, 1208, 1212, 1214, 1216, 1218, 1224, 1230, 1231, 1234, 1455, 1487, 1488, 1489, 1569, 1572, 1621, 1622, 1627, 1695, 1697, 1698, 1700, 1701, 1702, 1704, 1714, 1730, 1733, 1735, 1738, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1828, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "screenshot": 1788, "screw": [440, 1199, 1704], "script": [1725, 1738, 1747, 1752, 1759, 1764, 1770, 1786, 1787, 1808, 1828, 1831, 1835, 1844], "scrpot": 1838, "scs_ccsd": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "scs_cepa": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "scs_mp2": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "scs_type": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "scsmi": [959, 1213, 1225, 1291, 1704], "scsmp2": 1711, "scsn": [959, 1213, 1225, 1291, 1293, 1704, 1776], "scsn_mp2": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "scsvdw": [959, 1213, 1225, 1291, 1293, 1704], "scuseria": [356, 444, 482, 1199, 1200, 1231, 1616, 1617, 1704, 1734, 1757], "sd": [0, 690, 1206, 1226, 1368, 1704, 1802], "sdk": 1735, "sdq": [284, 295, 318, 319, 1147, 1221, 1670, 1680, 1689, 1704, 1739, 1740, 1743, 1744, 1745, 1766, 1771, 1776, 1781, 1800, 1837], "sdtq": [1670, 1680, 1776], "se": [1707, 1731], "sear": [885, 1210, 1704], "search": [2, 106, 603, 609, 635, 640, 652, 656, 1206, 1226, 1354, 1704, 1738, 1750, 1767, 1777, 1782, 1786, 1802, 1833], "searchabl": 2, "sebastian": 1746, "sebwout": [993, 1215, 1704, 1746], "sec": [1738, 1764, 1772, 1781, 1796, 1800, 1831, 1832, 1844], "second": [2, 26, 84, 90, 106, 115, 259, 267, 284, 295, 300, 301, 302, 309, 318, 319, 360, 381, 382, 390, 446, 484, 568, 570, 571, 599, 609, 615, 629, 648, 669, 671, 677, 704, 707, 804, 825, 856, 857, 1119, 1125, 1191, 1199, 1200, 1206, 1210, 1221, 1222, 1230, 1231, 1448, 1450, 1459, 1465, 1466, 1538, 1643, 1644, 1645, 1646, 1648, 1692, 1704, 1706, 1713, 1714, 1733, 1734, 1738, 1740, 1750, 1752, 1753, 1755, 1756, 1757, 1761, 1763, 1766, 1767, 1770, 1771, 1772, 1775, 1776, 1781, 1782, 1790, 1794, 1795, 1796, 1798, 1800, 1802, 1817, 1826, 1828, 1832, 1833, 1835, 1837, 1842, 1844], "second_ord": [669, 1206, 1229, 1423, 1704], "second_radiation_const": 1706, "secondari": [1714, 1842], "secondli": [1752, 1797], "section": [0, 1, 381, 382, 622, 626, 637, 661, 1206, 1224, 1240, 1704, 1706, 1711, 1714, 1730, 1735, 1738, 1740, 1742, 1743, 1746, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1762, 1763, 1764, 1765, 1767, 1769, 1770, 1771, 1773, 1774, 1775, 1781, 1782, 1783, 1784, 1788, 1789, 1790, 1791, 1792, 1795, 1796, 1797, 1798, 1799, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1815, 1823, 1824, 1826, 1828, 1829, 1832, 1835, 1836, 1837, 1838, 1839, 1841, 1842, 1843, 1844], "sed": [1788, 1806], "see": [0, 1, 2, 86, 100, 106, 130, 148, 150, 267, 277, 283, 284, 295, 300, 301, 302, 303, 314, 317, 318, 319, 333, 342, 350, 356, 365, 399, 439, 443, 473, 479, 519, 543, 561, 569, 574, 575, 577, 581, 593, 637, 640, 737, 786, 808, 818, 824, 825, 829, 850, 885, 924, 1079, 1106, 1107, 1146, 1147, 1166, 1199, 1200, 1202, 1203, 1204, 1206, 1208, 1210, 1213, 1219, 1220, 1221, 1224, 1225, 1226, 1229, 1230, 1231, 1233, 1236, 1239, 1257, 1324, 1410, 1442, 1445, 1497, 1521, 1552, 1563, 1681, 1704, 1709, 1714, 1730, 1734, 1735, 1736, 1740, 1742, 1743, 1748, 1752, 1753, 1754, 1755, 1757, 1759, 1760, 1761, 1763, 1766, 1767, 1768, 1770, 1771, 1772, 1774, 1775, 1776, 1781, 1783, 1788, 1789, 1791, 1794, 1796, 1798, 1799, 1800, 1801, 1802, 1803, 1806, 1808, 1809, 1810, 1817, 1823, 1824, 1828, 1829, 1832, 1833, 1835, 1836, 1837, 1838, 1839, 1842, 1843, 1844], "seed": [476, 1200, 1704], "seed_atom": [106, 1768], "seek": [86, 355, 1231, 1655, 1658, 1704, 1738, 1755, 1756, 1841], "seem": [697, 786, 1206, 1210, 1704, 1738, 1810, 1837, 1838, 1839], "seen": [1738, 1742, 1756, 1809, 1817, 1828, 1832, 1844], "segment": [590, 1206, 1704], "seidl": 1781, "sekino": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "seldom": 1763, "select": [0, 2, 13, 150, 259, 314, 434, 444, 482, 521, 545, 577, 608, 774, 794, 833, 874, 1199, 1200, 1202, 1203, 1206, 1209, 1210, 1231, 1505, 1507, 1532, 1620, 1704, 1730, 1737, 1738, 1739, 1742, 1748, 1754, 1755, 1756, 1759, 1771, 1774, 1781, 1785, 1788, 1790, 1791, 1798, 1802, 1809, 1828, 1837, 1838], "select_mp3": 1809, "selector": 1809, "self": [1, 3, 5, 6, 7, 8, 9, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 26, 27, 30, 61, 64, 66, 68, 70, 73, 74, 75, 76, 77, 78, 80, 81, 84, 86, 87, 88, 89, 90, 91, 92, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 108, 110, 111, 112, 114, 115, 118, 119, 120, 128, 130, 131, 132, 133, 137, 138, 139, 140, 141, 143, 144, 145, 147, 148, 149, 150, 183, 184, 262, 267, 295, 315, 316, 318, 319, 331, 381, 382, 574, 698, 1206, 1210, 1231, 1673, 1690, 1704, 1740, 1748, 1753, 1755, 1757, 1759, 1760, 1766, 1770, 1772, 1774, 1776, 1777, 1781, 1790, 1794, 1797, 1800, 1810, 1822, 1826, 1829, 1838], "sem": [0, 811, 833, 837, 1210, 1704, 1755], "semi": [1714, 1838, 1842], "semicanon": [0, 1, 2, 664, 1206, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "semicanonic": [84, 1714, 1756, 1842], "semicanonical_orb": 13, "semicolon_separ": 2, "semidefinit": 100, "semiloc": 1759, "seminumer": [1734, 1790], "send": 1767, "sens": [0, 265, 881, 1210, 1704, 1740, 1743, 1770, 1779, 1794, 1801, 1808], "sensibl": [359, 1743, 1757], "sensibli": [106, 1774], "sensit": [778, 1170, 1209, 1221, 1231, 1584, 1704, 1752, 1754, 1772, 1791, 1801, 1832, 1834], "sent": [1708, 1738, 1743, 1767], "separ": [0, 8, 92, 106, 295, 376, 397, 561, 601, 616, 660, 671, 701, 836, 867, 1041, 1104, 1204, 1206, 1210, 1218, 1221, 1227, 1231, 1376, 1511, 1529, 1530, 1704, 1714, 1738, 1743, 1753, 1754, 1757, 1763, 1764, 1766, 1767, 1770, 1779, 1782, 1783, 1785, 1794, 1798, 1799, 1801, 1802, 1803, 1806, 1817, 1828, 1832, 1833, 1837, 1838, 1842, 1843, 1844], "seper": [138, 1714, 1802, 1842], "seperman": 1738, "septemb": [1095, 1219, 1704, 1738, 1771], "seq": 344, "seq1": [299, 309, 349, 360], "seq2": [309, 360], "sequenc": [284, 1714, 1730, 1740, 1748, 1808, 1824, 1842], "sequenti": [284, 570, 703, 1206, 1704, 1740, 1788], "seri": [100, 300, 301, 302, 318, 319, 380, 570, 861, 864, 1206, 1210, 1704, 1752, 1755, 1756, 1757, 1759, 1768, 1771, 1772, 1800, 1828, 1838, 1844], "serial": [2, 64, 100, 106, 148, 150, 295, 367, 1231, 1584, 1704, 1738, 1766, 1771, 1838], "serif": 1738, "serv": [1, 393, 1714, 1764, 1788, 1817, 1832, 1842], "server": 1788, "serverdata": [308, 1768], "servic": 1786, "session": [1714, 1748, 1788, 1832, 1842], "set": [0, 2, 8, 11, 18, 19, 21, 68, 73, 74, 84, 86, 87, 88, 92, 96, 100, 103, 106, 111, 112, 113, 114, 115, 138, 139, 147, 148, 150, 171, 195, 197, 200, 207, 211, 212, 214, 226, 227, 228, 230, 235, 236, 244, 245, 246, 248, 249, 250, 251, 252, 254, 255, 262, 263, 265, 267, 281, 283, 284, 285, 287, 291, 295, 296, 297, 300, 301, 302, 303, 306, 307, 314, 317, 318, 319, 321, 329, 333, 336, 338, 341, 346, 347, 352, 365, 367, 370, 371, 374, 375, 376, 378, 380, 386, 393, 394, 395, 396, 397, 399, 457, 474, 573, 577, 581, 586, 587, 590, 592, 599, 603, 605, 609, 614, 616, 628, 644, 648, 650, 651, 654, 658, 660, 661, 664, 665, 672, 676, 679, 684, 685, 689, 691, 696, 705, 713, 733, 743, 746, 772, 773, 778, 810, 827, 835, 861, 891, 892, 898, 899, 921, 922, 930, 934, 949, 958, 963, 964, 978, 979, 1025, 1026, 1027, 1101, 1103, 1126, 1156, 1157, 1168, 1195, 1199, 1200, 1206, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1217, 1220, 1221, 1223, 1224, 1225, 1226, 1228, 1229, 1230, 1231, 1232, 1235, 1240, 1266, 1290, 1293, 1302, 1304, 1312, 1324, 1335, 1380, 1426, 1437, 1445, 1446, 1453, 1484, 1485, 1500, 1502, 1507, 1578, 1593, 1611, 1666, 1695, 1698, 1699, 1700, 1701, 1703, 1704, 1710, 1711, 1714, 1715, 1726, 1727, 1735, 1736, 1737, 1739, 1742, 1743, 1746, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1779, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1789, 1790, 1791, 1792, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1803, 1805, 1806, 1809, 1810, 1814, 1817, 1818, 1823, 1824, 1828, 1829, 1831, 1833, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "set_aa_int_nam": 90, "set_ab_int_nam": 90, "set_active_frag": 106, "set_alpha": 80, "set_ansatz": 119, "set_ao_cor": 27, "set_arrai": [114, 150], "set_array_vari": [150, 1764], "set_atomic_fit_bas": 131, "set_basi": 265, "set_basis_all_atom": 106, "set_basis_by_label": 106, "set_basis_by_numb": 106, "set_basis_by_symbol": 106, "set_basisset": [103, 150, 1837], "set_bb_int_nam": 90, "set_bibtex": 68, "set_block": [88, 100, 148], "set_bool": 114, "set_bsse_typ": 1794, "set_c_alpha": 138, "set_c_omega": 138, "set_c_os_alpha": 138, "set_c_ss_alpha": 138, "set_camera": 323, "set_charge_field": 1817, "set_ci_guess": 13, "set_cit": [68, 80, 138], "set_color": 323, "set_com": 106, "set_connect": 106, "set_cosx_grid": 18, "set_current_modul": 114, "set_cutoff": 92, "set_d": 147, "set_da_ao": 111, "set_da_mo": 111, "set_da_so": 111, "set_db_ao": 111, "set_db_mo": 111, "set_db_so": 111, "set_debug": [131, 147], "set_default_namespac": [86, 1837], "set_default_path": [87, 1767], "set_defin": 323, "set_delta": 6, "set_density_cutoff": [80, 96], "set_density_toler": 138, "set_deriv": [7, 138], "set_deriv_density_backtransform": 61, "set_descript": [68, 80, 138], "set_do_j": 92, "set_do_k": 92, "set_do_vv10": 138, "set_do_wk": 92, "set_doubl": 114, "set_dpd_id": 90, "set_dpd_int_fil": 90, "set_driv": 1772, "set_embedding_charg": 1794, "set_energi": [84, 150], "set_external_cpscf_perturb": 84, "set_external_potenti": 150, "set_full_geometri": 106, "set_geometri": [106, 1833], "set_gga": 80, "set_ghost_frag": 106, "set_global_opt": [1801, 1809], "set_global_option_python": 1838, "set_grac_alpha": 138, "set_grac_beta": 138, "set_grac_shift": 138, "set_gradi": 150, "set_hessian": 150, "set_ignore_refer": 61, "set_input_units_to_au": 106, "set_int": 114, "set_jk": 84, "set_keep_dpd_so_int": 90, "set_keep_ht_int": 90, "set_keep_iwl_so_int": 90, "set_keyword": 265, "set_lagrangian": 150, "set_local_opt": [1801, 1809], "set_lock": 138, "set_lsda_cutoff": 80, "set_mass": 106, "set_max_nbodi": 1794, "set_max_point": 138, "set_memori": [27, 90, 92, 250, 1828, 1832], "set_memory_byt": 1832, "set_meta": 80, "set_meta_cutoff": 80, "set_method": [27, 265], "set_mo_cor": 27, "set_modul": 150, "set_molecul": [1740, 1772, 1794], "set_molecular_charg": [106, 1838], "set_multipl": [106, 295, 1766, 1838], "set_nam": [68, 80, 106, 111, 138, 150], "set_nfrag": 1794, "set_nthread": 27, "set_nuclear_charg": 106, "set_num_thread": [1767, 1788], "set_nvec": 12, "set_omega": [80, 92, 96], "set_omega_alpha": 92, "set_omega_beta": 92, "set_omp_nthread": 92, "set_opt": [283, 333, 366, 371, 375, 379, 396, 1754, 1828, 1832, 1841], "set_orbit": [13, 90], "set_output_fil": [1738, 1768, 1777, 1788, 1828, 1841], "set_param": 19, "set_paramet": 80, "set_pid": 86, "set_point": 119, "set_point_group": 106, "set_postscf_density_label": 74, "set_potential_vari": 150, "set_print": [90, 92, 103, 131, 147, 150], "set_proven": 106, "set_psio": 90, "set_radiu": 323, "set_read_glob": 114, "set_reference_wavefunct": 150, "set_return_total_data": 1794, "set_sad_basisset": 84, "set_sad_fitting_basisset": 84, "set_scalar_vari": 150, "set_schwarz_cutoff": 27, "set_siz": 323, "set_so_tei_fil": 90, "set_specific_path": [87, 1767], "set_specific_retent": [87, 1767], "set_str": 114, "set_str_i": 114, "set_subalgo": 27, "set_tei_already_presort": 90, "set_tests_properti": 2, "set_titl": 111, "set_tpdm_already_presort": 90, "set_tpdm_presort": 61, "set_tweak": 96, "set_unit": 106, "set_up": 1788, "set_up_overal": 1788, "set_vari": [106, 150, 244, 254, 1764, 1809, 1823, 1834], "set_view": 323, "set_vv10_b": 138, "set_vv10_c": 138, "set_wcombin": 92, "set_write_dpd_so_tpdm": 90, "set_x_alpha": 138, "set_x_beta": 138, "set_x_omega": 138, "set_xclib_descript": 138, "setabl": [1714, 1842], "setenv": [1738, 1767], "setnam": 73, "settl": [1786, 1838], "setup": [1738, 1746, 1754, 1767, 1788], "sever": [0, 2, 106, 284, 327, 944, 1158, 1213, 1221, 1692, 1704, 1714, 1730, 1733, 1735, 1740, 1743, 1748, 1750, 1751, 1752, 1753, 1755, 1756, 1757, 1759, 1767, 1770, 1771, 1774, 1779, 1781, 1786, 1789, 1790, 1794, 1798, 1802, 1809, 1815, 1828, 1835, 1837, 1838, 1842, 1844], "sextupl": [295, 1766, 1792, 1793], "sf": [295, 677, 1206, 1704, 1714, 1766, 1781, 1805, 1836, 1837, 1842], "sf1": [1714, 1842], "sf4": [1714, 1842], "sf_restrict": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "sfree": [677, 1206, 1704], "sfx2c": [1714, 1842], "sg0": [1231, 1527, 1704], "sg1": [1231, 1527, 1704, 1710, 1757], "sgi": [575, 1206, 1704], "sh": [1738, 1748, 1767, 1788], "sha": 1788, "sha256": 1788, "shadow": 323, "shallow_copi": 150, "sham": [84, 150, 314, 1734, 1757, 1791, 1810, 1837, 1838], "shannon": [1805, 1806], "shannonhouck": [1738, 1805], "shape": [100, 110, 148, 331, 367, 1692, 1752, 1797, 1838], "share": [86, 194, 245, 1730, 1733, 1735, 1738, 1743, 1746, 1748, 1749, 1750, 1752, 1759, 1762, 1764, 1767, 1770, 1773, 1775, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1803, 1808, 1809, 1834, 1835, 1839], "shared_object": [86, 87], "shared_ptr": [1810, 1817, 1821], "sharedmatrix": [11, 70, 1817], "shaw": [1734, 1777, 1780, 1781], "shebang": [1738, 1788], "shell": [0, 1, 2, 8, 81, 92, 103, 112, 143, 144, 158, 586, 625, 628, 660, 676, 681, 695, 861, 865, 1125, 1210, 1221, 1224, 1231, 1237, 1238, 1488, 1606, 1622, 1692, 1704, 1714, 1730, 1733, 1734, 1735, 1737, 1738, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1828, 1829, 1832, 1833, 1834, 1835, 1836, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "shell_block_signific": 1817, "shell_ext": 6, "shell_on_cent": 8, "shell_pair": 1817, "shell_signific": [143, 144, 1817], "shell_to_ao_funct": 8, "shell_to_basis_funct": 8, "shell_to_cent": 8, "shellbatch": [1231, 1626, 1704], "shellinfo": [5, 1827], "shellpair": 1817, "shells_iter": 89, "shells_local_to_glob": 9, "sherril": [1230, 1469, 1692, 1704, 1714, 1734, 1740, 1752, 1755, 1781, 1786, 1789, 1791, 1798, 1835, 1837, 1842], "sherrill_gold_standard": 1740, "shg": [669, 1206, 1704], "shield": [669, 1206, 1704, 1706], "shielded_helion_gyromag_ratio": 1706, "shielded_helion_gyromag_ratio_over_2_pi": 1706, "shielded_helion_mag_mom": 1706, "shielded_helion_mag_mom_to_bohr_magneton_ratio": 1706, "shielded_helion_mag_mom_to_nuclear_magneton_ratio": 1706, "shielded_helion_to_proton_mag_mom_ratio": 1706, "shielded_helion_to_shielded_proton_mag_mom_ratio": 1706, "shielded_proton_gyromag_ratio": 1706, "shielded_proton_gyromag_ratio_over_2_pi": 1706, "shielded_proton_mag_mom": 1706, "shielded_proton_mag_mom_to_bohr_magneton_ratio": 1706, "shielded_proton_mag_mom_to_nuclear_magneton_ratio": 1706, "shift": [0, 12, 84, 106, 138, 669, 695, 703, 738, 744, 759, 774, 920, 928, 987, 988, 1184, 1206, 1208, 1209, 1213, 1215, 1222, 1229, 1230, 1231, 1427, 1473, 1474, 1476, 1525, 1570, 1571, 1704, 1714, 1743, 1746, 1754, 1771, 1785, 1788, 1798, 1828, 1837, 1838, 1842], "ship": 1743, "short": [2, 138, 295, 318, 319, 389, 1695, 1698, 1699, 1703, 1738, 1752, 1757, 1758, 1766, 1767, 1785, 1800, 1837], "shortcod": 1788, "shortcut": [1755, 1802], "shorter": [1714, 1842], "shortest": [1714, 1842], "shorthand": [1102, 1221, 1704, 1740], "shortli": 1810, "shortlong": 389, "should": [0, 2, 13, 84, 86, 87, 100, 106, 138, 148, 150, 265, 279, 284, 285, 329, 336, 342, 359, 363, 381, 382, 389, 393, 399, 430, 586, 589, 603, 609, 610, 617, 620, 632, 641, 647, 660, 804, 833, 861, 891, 897, 1097, 1126, 1168, 1199, 1206, 1210, 1211, 1220, 1221, 1225, 1226, 1229, 1231, 1244, 1356, 1655, 1688, 1704, 1714, 1730, 1738, 1740, 1742, 1743, 1748, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1761, 1763, 1764, 1767, 1768, 1769, 1770, 1774, 1775, 1777, 1779, 1781, 1782, 1785, 1786, 1788, 1794, 1797, 1798, 1801, 1802, 1803, 1804, 1806, 1808, 1809, 1810, 1816, 1817, 1818, 1821, 1824, 1826, 1828, 1829, 1832, 1833, 1835, 1836, 1837, 1838, 1841, 1842, 1844], "shouldn": [1785, 1801], "shove": 1809, "show": [2, 106, 265, 1714, 1738, 1740, 1743, 1748, 1750, 1752, 1755, 1757, 1764, 1768, 1770, 1772, 1779, 1788, 1794, 1802, 1817, 1828, 1833, 1837, 1842, 1844], "showcas": [1714, 1842], "shown": [2, 1730, 1743, 1753, 1781, 1782, 1799, 1802, 1805, 1806, 1810, 1817, 1829, 1832, 1833, 1837, 1838, 1841, 1843], "shuffl": 106, "shy": 0, "si": [8, 368, 369, 1098, 1220, 1704, 1738, 1775, 1832], "siao0": [1047, 1218, 1704, 1770], "siao1": [1047, 1218, 1704, 1714, 1770, 1842], "siao2": [1047, 1218, 1704, 1770], "siaox": [1048, 1218, 1704, 1770], "side": [103, 106, 111, 247, 666, 1206, 1704, 1738, 1757, 1764, 1774, 1801, 1804, 1809, 1821, 1831, 1841], "sidebar": 1764, "sidechain": [1692, 1752], "siev": 1838, "sigma": [13, 390, 786, 823, 842, 883, 886, 1047, 1210, 1218, 1704, 1708, 1714, 1757, 1770, 1838, 1842], "sigma_": 1757, "sigma_overlap": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "sigma_xi": 139, "sigma_xz": 139, "sigma_yz": 139, "sign": [1730, 1743, 1752, 1764, 1776, 1810, 1832], "signal": [2, 1821], "signatur": [2, 285, 287, 336, 338, 1821], "signifi": [589, 1206, 1704], "signific": [143, 144, 1753, 1756, 1757, 1810, 1817, 1838], "significantli": [106, 430, 568, 575, 590, 641, 727, 1199, 1206, 1208, 1704, 1730, 1753, 1755, 1759, 1767, 1774, 1798, 1817, 1838], "silent": 2, "silicon": [1706, 1737, 1781], "silver_schem": 1750, "similar": [2, 163, 284, 342, 399, 474, 1200, 1704, 1714, 1738, 1740, 1742, 1748, 1753, 1755, 1760, 1763, 1782, 1785, 1792, 1798, 1802, 1817, 1823, 1832, 1837, 1838, 1842], "similarli": [1748, 1753, 1801, 1828, 1844], "simint": [400, 1129, 1221, 1704, 1738, 1777, 1780, 1785, 1842], "simint_dir": 1839, "simint_vector": 1839, "simintconfig": 1839, "simmonett": [1734, 1753, 1761, 1765, 1768, 1769, 1775, 1781, 1782, 1786, 1792, 1799, 1803, 1829, 1838], "simpl": [2, 8, 267, 279, 284, 1226, 1341, 1342, 1692, 1704, 1725, 1738, 1740, 1743, 1752, 1753, 1755, 1756, 1757, 1759, 1768, 1770, 1771, 1772, 1774, 1777, 1781, 1789, 1790, 1797, 1802, 1804, 1810, 1817, 1824, 1828, 1832, 1833, 1836, 1837, 1838, 1844], "simpler": [1824, 1828, 1832], "simplest": [1743, 1755, 1757, 1775, 1837, 1838], "simpli": [0, 84, 100, 148, 570, 672, 1206, 1704, 1730, 1743, 1755, 1757, 1759, 1769, 1771, 1774, 1775, 1782, 1792, 1797, 1798, 1817, 1824, 1832, 1833, 1835, 1836, 1837, 1838, 1840], "simplif": 1756, "simplifi": [1753, 1771, 1801, 1824, 1833, 1844], "simul": [0, 441, 444, 478, 482, 517, 521, 541, 545, 1199, 1200, 1202, 1203, 1704, 1734], "simultan": [0, 335, 703, 726, 727, 739, 742, 745, 746, 750, 751, 811, 929, 946, 1206, 1208, 1210, 1213, 1225, 1281, 1704, 1714, 1753, 1755, 1767, 1789, 1838, 1842], "sinc": [0, 2, 100, 150, 192, 193, 203, 204, 206, 253, 264, 375, 396, 599, 608, 658, 1147, 1206, 1221, 1704, 1738, 1740, 1743, 1753, 1754, 1757, 1759, 1763, 1767, 1776, 1779, 1782, 1785, 1786, 1788, 1792, 1801, 1808, 1824, 1828, 1833, 1834, 1837, 1838, 1841, 1843, 1844], "sincer": 1757, "sinf_disp": 76, "sing": 1785, "singl": [0, 2, 8, 13, 88, 100, 106, 148, 249, 265, 295, 306, 318, 319, 326, 329, 331, 334, 381, 382, 474, 476, 481, 498, 520, 544, 575, 628, 635, 652, 657, 660, 666, 707, 746, 1099, 1200, 1202, 1203, 1206, 1208, 1220, 1224, 1226, 1229, 1235, 1313, 1419, 1669, 1670, 1674, 1675, 1676, 1680, 1684, 1704, 1708, 1710, 1711, 1714, 1722, 1735, 1740, 1743, 1744, 1745, 1750, 1752, 1753, 1755, 1759, 1762, 1764, 1768, 1774, 1775, 1776, 1777, 1779, 1781, 1782, 1785, 1790, 1794, 1797, 1800, 1802, 1804, 1805, 1809, 1810, 1817, 1822, 1823, 1826, 1828, 1829, 1831, 1832, 1835, 1838, 1842, 1844], "single_point": [635, 652, 1206, 1704], "singlepass": [575, 1206, 1704], "singles_print": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "singlet": [0, 1, 138, 277, 295, 329, 403, 662, 1197, 1206, 1224, 1229, 1231, 1238, 1415, 1658, 1669, 1680, 1704, 1714, 1727, 1743, 1755, 1757, 1766, 1770, 1776, 1785, 1810, 1829, 1833, 1837, 1838, 1841, 1842], "singleton": 213, "singli": [150, 1071, 1168, 1192, 1219, 1221, 1222, 1704, 1742, 1750, 1755, 1771, 1810, 1829, 1833], "singular": [1798, 1810], "sirianni": [1734, 1781, 1828], "site": [103, 1097, 1099, 1220, 1228, 1378, 1379, 1382, 1692, 1704, 1736, 1738, 1749, 1752, 1767, 1775, 1776, 1788, 1817], "sitkoff": 1734, "situat": [1730, 1764, 1770, 1798, 1810, 1817], "siva": 1734, "six": [2, 140, 286, 337, 1692, 1752], "sixth": [677, 1206, 1704, 1771], "size": [76, 100, 105, 284, 532, 540, 555, 755, 832, 833, 834, 933, 1023, 1202, 1203, 1208, 1210, 1213, 1217, 1225, 1226, 1231, 1269, 1306, 1340, 1343, 1348, 1551, 1588, 1595, 1661, 1704, 1714, 1726, 1734, 1738, 1740, 1750, 1753, 1755, 1756, 1757, 1763, 1767, 1771, 1776, 1794, 1821, 1837, 1842], "size_t": 1817, "size_typ": 1821, "skeleton": [573, 904, 1206, 1212, 1704], "skew": 1798, "skiff": 1734, "skip": [283, 300, 301, 302, 333, 399, 501, 701, 1200, 1206, 1704, 1730, 1738, 1747, 1767, 1772, 1788, 1794], "sky": 323, "sl": [1788, 1836], "slack": [1788, 1818, 1825], "slash": [616, 660, 1206, 1704, 1774], "slater": [103, 295, 318, 319, 1695, 1698, 1703, 1714, 1730, 1755, 1757, 1758, 1766, 1800, 1829, 1838, 1842], "slice": [88, 100, 148, 1827], "slide": 1788, "slightli": [608, 1206, 1230, 1435, 1436, 1443, 1704, 1755, 1757, 1767, 1770, 1771, 1784, 1803, 1808, 1810, 1832, 1837, 1838, 1844], "slim": 1788, "slipchenko": 1782, "sloppi": 1740, "slow": [430, 510, 882, 1199, 1201, 1210, 1704, 1767, 1838], "slower": [786, 1210, 1704, 1810, 1838], "slowli": [1748, 1753, 1837], "small": [2, 84, 106, 295, 318, 319, 342, 374, 395, 726, 833, 1208, 1210, 1231, 1485, 1500, 1673, 1692, 1695, 1698, 1700, 1701, 1703, 1704, 1712, 1714, 1734, 1735, 1738, 1739, 1742, 1752, 1753, 1755, 1756, 1757, 1758, 1763, 1766, 1767, 1770, 1771, 1794, 1798, 1800, 1802, 1810, 1817, 1824, 1833, 1836, 1837, 1838, 1842], "small_basi": 1838, "small_cutoff": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "smaller": [284, 1001, 1215, 1226, 1362, 1692, 1704, 1740, 1746, 1752, 1753, 1754, 1755, 1756, 1757, 1763, 1785, 1810, 1828, 1837, 1838, 1844], "smallest": [356, 645, 1206, 1704, 1752, 1788, 1838], "smart": [1738, 1752, 1828, 1844], "smith": [1230, 1469, 1704, 1734, 1740, 1755, 1757, 1759, 1760, 1777, 1780, 1781, 1786, 1789, 1794, 1797, 1824, 1837, 1841], "smoke": [2, 1714, 1738, 1785, 1788, 1842], "smoketest": 2, "smooth": 1770, "smoother": 1757, "smp": [199, 251, 1767], "sn": [106, 1231, 1626, 1636, 1704, 1707, 1728, 1731, 1738, 1777, 1780, 1838], "snapshot": [2, 1767, 1786, 1787], "snarki": 1786, "snippet": [1730, 1740, 1752, 1817, 1832, 1838], "snlink": [721, 1166, 1207, 1221, 1621, 1622, 1623, 1624, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1704, 1838], "snlink_basis_toler": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "snlink_density_toler": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "snlink_force_cartesian": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "snlink_gpu_mem": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "snlink_grid_batch_s": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "snlink_integrator_kernel": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "snlink_ints_toler": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "snlink_load_balancer_kernel": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "snlink_lwd_kernel": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "snlink_mol_weights_kernel": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "snlink_pruning_schem": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "snlink_radial_point": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "snlink_radial_schem": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "snlink_reduction_kernel": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "snlink_spherical_point": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "snlink_use_debug_grid": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "snlink_use_gpu": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "snsmp2": [400, 1738, 1748, 1806, 1842], "so": [0, 2, 89, 100, 103, 106, 115, 118, 130, 132, 148, 150, 235, 236, 243, 283, 285, 287, 295, 297, 314, 318, 319, 329, 333, 335, 336, 338, 347, 373, 386, 391, 559, 576, 599, 611, 632, 633, 634, 652, 656, 662, 664, 697, 922, 934, 937, 938, 960, 1025, 1026, 1027, 1065, 1084, 1124, 1126, 1204, 1206, 1213, 1217, 1219, 1221, 1225, 1230, 1231, 1232, 1292, 1293, 1464, 1465, 1466, 1578, 1601, 1612, 1666, 1675, 1684, 1690, 1695, 1696, 1697, 1698, 1700, 1702, 1703, 1704, 1711, 1714, 1730, 1733, 1737, 1738, 1739, 1742, 1743, 1748, 1755, 1756, 1757, 1758, 1759, 1763, 1764, 1766, 1767, 1769, 1770, 1772, 1774, 1776, 1779, 1782, 1785, 1786, 1788, 1791, 1794, 1796, 1798, 1800, 1801, 1802, 1808, 1809, 1812, 1814, 1815, 1817, 1821, 1822, 1828, 1832, 1833, 1834, 1837, 1838, 1839, 1842, 1843, 1844], "so2": [1714, 1842], "so_angular_momentum": [89, 103], "so_dipol": [89, 103], "so_dkh": 103, "so_kinet": [89, 103], "so_multipol": 89, "so_nabla": [89, 103], "so_overlap": [89, 103], "so_potenti": [89, 103], "so_prop_int": 329, "so_quadrupol": [89, 103], "so_traceless_quadrupol": [89, 103], "sobasi": 132, "sobasisset": [103, 150, 1827], "soc": 1734, "socc": [0, 1, 2, 1704, 1714, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "soccpi": 150, "societi": 1734, "socket": 1767, "sodium": [1754, 1833], "sofeff": 130, "soft": 1750, "softwar": [2, 106, 1232, 1666, 1704, 1734, 1738, 1748, 1759, 1774, 1780, 1781, 1782, 1792, 1828, 1843, 1844], "softwarex": 1781, "softx": 1781, "sogga": [295, 318, 319, 1695, 1698, 1699, 1703, 1757, 1758, 1766, 1800], "sogga11": [295, 318, 319, 1695, 1697, 1698, 1699, 1700, 1703, 1758, 1766, 1800], "sointegr": 1808, "sokolov": [1734, 1753, 1781, 1786], "sol": [295, 318, 319, 1695, 1697, 1698, 1699, 1700, 1701, 1703, 1758, 1766, 1800], "sole": [1232, 1666, 1704, 1743, 1759, 1837, 1843], "solid": [214, 295, 318, 319, 1695, 1697, 1698, 1699, 1703, 1758, 1766, 1800], "solo": 1838, "solut": [342, 356, 389, 457, 470, 471, 498, 583, 594, 595, 607, 640, 660, 672, 681, 697, 736, 747, 750, 776, 839, 1181, 1182, 1199, 1200, 1206, 1208, 1209, 1210, 1222, 1230, 1231, 1435, 1555, 1564, 1649, 1704, 1714, 1738, 1742, 1749, 1753, 1754, 1755, 1757, 1770, 1771, 1803, 1810, 1829, 1836, 1837, 1838, 1842], "solv": [0, 76, 84, 133, 277, 335, 342, 447, 471, 584, 585, 609, 639, 647, 746, 777, 833, 913, 946, 1103, 1199, 1200, 1202, 1206, 1208, 1209, 1210, 1213, 1221, 1225, 1230, 1231, 1281, 1441, 1499, 1704, 1714, 1736, 1742, 1753, 1754, 1755, 1763, 1767, 1771, 1786, 1798, 1810, 1836, 1837, 1838, 1842], "solvat": [769, 780, 1209, 1672, 1704, 1738, 1749, 1776, 1780, 1803], "solvent": [778, 779, 780, 781, 1209, 1704, 1742, 1749, 1780, 1781, 1782, 1803], "solvent_epsilon": [778, 1209, 1704, 1754], "solvent_kappa": 1754, "solver": [0, 329, 335, 342, 356, 722, 723, 724, 725, 762, 767, 929, 1207, 1209, 1213, 1231, 1638, 1639, 1652, 1704, 1725, 1780, 1810, 1827, 1838, 1841], "solver_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "solver_maxit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "solver_n_guess": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "solver_n_root": [0, 1, 2, 1642, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "solver_precondit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "solver_roots_per_irrep": [0, 1, 2, 1641, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "solverengin": [342, 356, 1827], "solvertyp": 1803, "somcscf": [13, 28, 67, 1827], "some": [0, 2, 76, 84, 272, 284, 329, 342, 351, 356, 370, 381, 382, 614, 616, 647, 667, 692, 786, 823, 837, 1104, 1206, 1210, 1221, 1230, 1463, 1704, 1714, 1738, 1739, 1740, 1742, 1743, 1748, 1750, 1752, 1753, 1755, 1756, 1757, 1759, 1763, 1764, 1767, 1770, 1771, 1781, 1785, 1788, 1789, 1790, 1797, 1799, 1801, 1802, 1804, 1805, 1810, 1817, 1821, 1824, 1826, 1828, 1829, 1832, 1833, 1837, 1838, 1839, 1840, 1842, 1844], "somedai": 1828, "someon": 1804, "someth": [1738, 1756, 1757, 1785, 1786, 1801, 1804, 1817, 1828, 1844], "sometim": [0, 2, 609, 829, 1206, 1210, 1704, 1738, 1739, 1743, 1757, 1759, 1802, 1810, 1833, 1838, 1841], "somewhat": [623, 882, 1206, 1210, 1704], "somewher": 1802, "somo": [1713, 1750], "son": 1734, "sonam": 1738, "song": [1734, 1802], "soon": [635, 641, 1206, 1704, 1743], "sopert": [576, 1206, 1704], "sophist": [603, 1206, 1704], "sorri": 1743, "sort": [11, 1204, 1708, 1750, 1767, 1768, 1794, 1810], "sos_typ": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "sosa": [1734, 1771], "soscf": [0, 1, 2, 1647, 1704, 1714, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "soscf_conv": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "soscf_max_it": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "soscf_min_it": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "soscf_print": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "soscf_start_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "soscf_upd": 84, "sospi": [960, 1213, 1225, 1292, 1293, 1704], "sotoao": [100, 118], "sought": [1738, 1755, 1795], "sound": [2, 1764], "sourc": [1, 2, 106, 231, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 1730, 1733, 1734, 1735, 1737, 1740, 1743, 1746, 1748, 1749, 1750, 1752, 1754, 1759, 1761, 1762, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1772, 1773, 1774, 1775, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1791, 1792, 1794, 1797, 1799, 1800, 1803, 1804, 1806, 1807, 1808, 1823, 1824, 1825, 1826, 1827, 1828, 1832, 1839, 1842, 1844], "source_dir": 1738, "sourceforg": 1737, "sow": [350, 351, 1752, 1779, 1840], "soyda": [1692, 1734, 1752, 1781], "sp": [1692, 1711, 1714, 1722, 1730, 1743, 1752, 1770, 1842], "sp1": [1714, 1842], "space": [0, 2, 13, 75, 90, 98, 100, 115, 150, 215, 279, 295, 329, 356, 476, 568, 601, 609, 623, 647, 660, 662, 676, 683, 699, 703, 819, 842, 859, 860, 863, 867, 994, 1000, 1033, 1083, 1084, 1116, 1200, 1206, 1210, 1215, 1218, 1219, 1221, 1230, 1460, 1476, 1673, 1704, 1706, 1714, 1729, 1730, 1733, 1746, 1750, 1752, 1757, 1761, 1763, 1766, 1770, 1771, 1776, 1777, 1780, 1790, 1798, 1799, 1809, 1812, 1814, 1817, 1837, 1842, 1844], "spacestr": 11, "span": [115, 1738, 1755, 1757, 1801, 1832], "sparingli": [2, 1767, 1801], "spars": [0, 575, 1206, 1704, 1763], "sparse_ao": [575, 1206, 1704], "sparsiti": [1231, 1572, 1704, 1763, 1817, 1838], "sparta": 1734, "spatial": [0, 664, 1032, 1115, 1206, 1218, 1221, 1231, 1535, 1564, 1704, 1750, 1756, 1757, 1763, 1805, 1810, 1837, 1838], "spawn": [1230, 1435, 1436, 1704, 1837], "spdfghijkl": 1730, "spdfghiklm": 1730, "speak": [2, 1224, 1238, 1239, 1704, 1743, 1837], "spec": [8, 283, 333, 388, 1231, 1636, 1704, 1738, 1748, 1768, 1788, 1833], "speci": [609, 1206, 1704, 1750, 1754], "special": [0, 2, 11, 84, 150, 241, 242, 284, 295, 577, 641, 1206, 1692, 1704, 1738, 1740, 1743, 1748, 1752, 1757, 1764, 1766, 1767, 1768, 1780, 1788, 1798, 1801, 1802, 1809, 1810, 1813, 1824, 1836, 1837, 1838], "specialist": 1776, "specialti": 1788, "specif": [0, 2, 21, 87, 106, 248, 265, 280, 283, 295, 317, 333, 365, 375, 383, 396, 399, 454, 551, 603, 708, 822, 828, 1049, 1050, 1199, 1203, 1206, 1210, 1218, 1226, 1231, 1324, 1527, 1669, 1704, 1714, 1726, 1730, 1735, 1736, 1740, 1742, 1746, 1748, 1750, 1755, 1766, 1767, 1770, 1774, 1776, 1777, 1780, 1788, 1792, 1794, 1801, 1802, 1808, 1809, 1810, 1822, 1824, 1828, 1829, 1831, 1838, 1842, 1843, 1844], "specifi": [0, 2, 8, 70, 103, 106, 111, 209, 210, 265, 272, 283, 284, 295, 300, 301, 302, 303, 306, 307, 318, 319, 327, 333, 366, 377, 379, 384, 388, 399, 402, 474, 539, 550, 568, 569, 570, 571, 572, 573, 574, 577, 579, 582, 583, 584, 585, 586, 587, 588, 589, 590, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 606, 608, 609, 610, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 625, 626, 628, 632, 633, 634, 635, 636, 642, 648, 650, 651, 652, 653, 654, 656, 658, 659, 660, 662, 664, 665, 666, 669, 670, 671, 672, 674, 675, 676, 677, 678, 680, 681, 684, 685, 686, 687, 688, 689, 690, 691, 694, 695, 696, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 709, 711, 712, 811, 819, 824, 825, 826, 827, 829, 832, 833, 837, 860, 874, 957, 1065, 1100, 1102, 1125, 1126, 1197, 1200, 1203, 1206, 1210, 1213, 1219, 1220, 1221, 1225, 1226, 1229, 1231, 1289, 1307, 1309, 1310, 1311, 1314, 1318, 1319, 1320, 1321, 1322, 1354, 1357, 1358, 1359, 1360, 1401, 1433, 1500, 1521, 1562, 1565, 1704, 1711, 1714, 1726, 1730, 1735, 1738, 1740, 1742, 1743, 1746, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1762, 1764, 1765, 1766, 1767, 1770, 1771, 1772, 1773, 1775, 1782, 1783, 1784, 1788, 1789, 1794, 1795, 1796, 1799, 1800, 1801, 1802, 1803, 1808, 1809, 1817, 1828, 1829, 1832, 1833, 1836, 1837, 1838, 1839, 1842, 1844], "specifii": [1714, 1842], "spectacular": 1757, "spectra": [377, 1781, 1790], "spectral": [324, 874, 1210, 1704, 1706], "spectroscop": [1714, 1777, 1831, 1841, 1842], "spectroscopi": [377, 1734], "spectrum": [0, 1827, 1841], "specul": 1786, "speed": [699, 1206, 1230, 1435, 1436, 1460, 1704, 1706, 1735, 1738, 1755, 1756, 1757, 1798, 1828, 1837, 1838, 1844], "speed_of_light_in_vacuum": 1706, "speedup": [1735, 1837, 1838], "speher": 1754, "spell": [1743, 1776], "spent": 1817, "sphere": [761, 772, 773, 774, 1209, 1231, 1505, 1589, 1598, 1660, 1704, 1754, 1838], "spheric": [8, 81, 103, 657, 691, 763, 764, 766, 776, 970, 1136, 1144, 1206, 1209, 1214, 1221, 1231, 1495, 1496, 1536, 1537, 1544, 1590, 1597, 1635, 1659, 1704, 1711, 1714, 1730, 1743, 1754, 1757, 1810, 1817, 1838, 1842], "sphinx": [373, 391, 1738, 1748, 1777, 1786, 1788, 1808], "sphinx_root": 1738, "sphinxman": [323, 1764, 1785, 1786, 1788, 1804, 1823], "sphinxmini": 1764, "sphinxpdf": 1764, "spicher": 1734, "spin": [0, 2, 13, 90, 103, 150, 286, 291, 295, 298, 314, 329, 337, 341, 348, 390, 436, 437, 449, 450, 458, 459, 601, 614, 654, 658, 659, 662, 664, 669, 677, 681, 690, 692, 693, 694, 695, 835, 884, 885, 921, 922, 923, 936, 937, 938, 939, 1041, 1067, 1068, 1081, 1082, 1199, 1206, 1210, 1213, 1218, 1219, 1225, 1229, 1231, 1283, 1293, 1294, 1432, 1538, 1610, 1669, 1670, 1674, 1675, 1676, 1680, 1684, 1689, 1692, 1704, 1714, 1743, 1750, 1752, 1756, 1766, 1770, 1771, 1776, 1777, 1780, 1781, 1790, 1791, 1828, 1829, 1832, 1833, 1836, 1842, 1844], "spin_adapt": [1229, 1429, 1704], "spin_flip": [0, 1, 403, 1197, 1704], "spin_scale_typ": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "spintyp": 90, "split": [329, 621, 860, 875, 1037, 1047, 1206, 1210, 1218, 1704, 1714, 1756, 1770, 1785, 1837, 1842], "spontan": 1776, "spread": [1231, 1531, 1704], "spring": [1740, 1838], "sprintf": 229, "spuriou": [1757, 1798, 1841], "spurious": 1838, "spw92": [295, 318, 319, 1695, 1698, 1703, 1758, 1766, 1800], "sqrt": [11, 322, 1182, 1222, 1704, 1740, 1759, 1763, 1776, 1829, 1838], "squar": [89, 100, 103, 334, 839, 840, 841, 1210, 1704, 1743, 1752, 1756, 1761, 1776, 1802, 1810, 1838, 1844], "squash": 1786, "sr": [295, 662, 1206, 1229, 1231, 1398, 1511, 1695, 1697, 1698, 1700, 1701, 1704, 1706, 1707, 1731, 1753, 1758, 1766], "sr6": [68, 1759], "srb": [295, 1766], "src": [1738, 1764, 1787, 1801, 1810, 1814, 1823], "ss": [0, 138, 501, 502, 908, 1200, 1212, 1695, 1696, 1697, 1699, 1700, 1701, 1702, 1704, 1756, 1757, 1758, 1771, 1836], "ss_e_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ss_r_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ss_scale": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ss_skip_diag": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ss_vecs_per_root": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ssapt0": [295, 1046, 1064, 1218, 1689, 1704, 1766, 1776, 1837], "ssapt0_scal": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "ssd": 1838, "sse": 1839, "ssh": [1714, 1737, 1767, 1842], "sshell": 1817, "ssize": 1817, "st": 1781, "stab": [1714, 1842], "stabil": [84, 145, 640, 681, 751, 752, 753, 754, 755, 756, 757, 1206, 1208, 1649, 1690, 1692, 1704, 1714, 1738, 1752, 1757, 1776, 1790, 1837, 1842], "stability1": [1714, 1842], "stability2": [1714, 1842], "stability3": [1714, 1842], "stability_add_vector": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "stability_analysi": [0, 1, 2, 84, 145, 1555, 1556, 1575, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "stability_augment_space_tol": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "stability_check": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "stability_converg": [0, 1, 2, 755, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "stability_max_space_s": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "stability_n_eigenvalu": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "stability_n_guess_vector": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "stabl": [601, 1206, 1231, 1575, 1649, 1704, 1737, 1748, 1757, 1767, 1781, 1788, 1810, 1828, 1838, 1841], "stack": [1692, 1748, 1752, 1787, 1810], "stackoverflow": 1822, "stage": [2, 284, 1736, 1740, 1743, 1747, 1752, 1767, 1776, 1786, 1814, 1828, 1840], "stage_basi": [284, 1740], "stage_schem": [284, 1740], "stage_wfn": [284, 1740], "stai": 1785, "stall": [729, 1208, 1229, 1231, 1405, 1499, 1704], "stamm": [1734, 1754], "stamp": 1804, "stand": 1730, "standalon": [388, 1808, 1838], "standard": [89, 103, 130, 271, 278, 280, 296, 297, 342, 347, 393, 568, 570, 577, 624, 658, 662, 664, 665, 704, 746, 819, 1101, 1206, 1208, 1210, 1220, 1226, 1229, 1299, 1399, 1704, 1706, 1714, 1738, 1740, 1742, 1743, 1748, 1753, 1754, 1755, 1757, 1763, 1767, 1769, 1770, 1775, 1785, 1790, 1795, 1799, 1810, 1824, 1828, 1829, 1831, 1832, 1833, 1837, 1838, 1841, 1842, 1843, 1844], "standard_acceleration_of_grav": 1706, "standard_atmospher": 1706, "standard_state_pressur": 1706, "stanton": [295, 318, 319, 655, 1206, 1704, 1714, 1734, 1744, 1745, 1766, 1777, 1780, 1800, 1842], "star": [8, 1059, 1218, 1704, 1706, 1733], "start": [0, 2, 81, 258, 260, 279, 300, 301, 302, 335, 448, 616, 635, 652, 672, 736, 783, 804, 816, 833, 851, 856, 857, 881, 895, 896, 994, 1001, 1095, 1182, 1199, 1206, 1208, 1210, 1211, 1215, 1219, 1222, 1226, 1229, 1231, 1305, 1418, 1550, 1561, 1580, 1617, 1648, 1682, 1690, 1704, 1708, 1714, 1735, 1736, 1738, 1742, 1743, 1746, 1748, 1753, 1757, 1759, 1764, 1767, 1768, 1770, 1771, 1772, 1774, 1776, 1781, 1783, 1785, 1786, 1788, 1795, 1798, 1802, 1805, 1808, 1809, 1810, 1817, 1832, 1833, 1838, 1842, 1844], "startswith": 1788, "stat": [268, 277, 342, 356, 390], "stat_pol": [669, 1206, 1704], "state": [0, 1, 2, 13, 84, 86, 106, 162, 169, 286, 298, 314, 321, 326, 327, 328, 337, 348, 351, 352, 357, 370, 371, 378, 403, 410, 418, 420, 422, 476, 488, 490, 494, 495, 526, 528, 531, 576, 603, 608, 609, 610, 613, 635, 652, 662, 672, 679, 783, 784, 823, 827, 828, 865, 887, 992, 1004, 1009, 1181, 1197, 1198, 1200, 1202, 1206, 1210, 1215, 1222, 1224, 1226, 1229, 1231, 1236, 1354, 1373, 1400, 1401, 1412, 1610, 1650, 1655, 1658, 1668, 1673, 1704, 1706, 1713, 1714, 1730, 1733, 1739, 1743, 1746, 1755, 1757, 1770, 1776, 1785, 1786, 1790, 1791, 1792, 1795, 1801, 1805, 1809, 1828, 1829, 1833, 1835, 1837, 1838, 1841, 1842, 1843, 1844], "stateinsteadmedi": 370, "statement": [328, 357, 1730, 1767, 1796, 1801, 1804, 1809], "states_per_irrep": 1840, "static": [8, 29, 68, 80, 86, 87, 88, 92, 97, 98, 100, 106, 115, 131, 138, 147, 150, 329, 539, 669, 673, 1203, 1206, 1704, 1714, 1738, 1742, 1749, 1754, 1757, 1785, 1788, 1803, 1822, 1838, 1842], "static_alpha_hf_h2o_eq_pcmsolv": 1724, "staticdoc": [1764, 1804], "stationari": [617, 1024, 1206, 1217, 1704, 1753, 1771, 1838], "statist": [277, 342, 356, 1752], "statu": [79, 86, 87, 126, 235, 236, 268, 326, 327, 328, 346, 370, 1738, 1786, 1788, 1801], "std": [1767, 1814, 1817, 1819], "stderr": 1788, "stdlib": 1738, "stdout": [2, 202, 265, 1740, 1767, 1788, 1794], "stdsuit": [1738, 1788], "steadi": 1838, "steep": 1763, "steepest": [1225, 1279, 1704, 1798, 1802], "stefan": 1706, "stefan_boltzmann_const": 1706, "steigemann": 1781, "stem": [202, 1757], "stencil": [1768, 1824], "step": [0, 106, 284, 295, 318, 319, 618, 634, 637, 648, 683, 726, 746, 843, 933, 1206, 1208, 1210, 1213, 1225, 1226, 1227, 1231, 1269, 1279, 1301, 1302, 1306, 1323, 1325, 1327, 1333, 1340, 1343, 1348, 1361, 1368, 1376, 1556, 1616, 1617, 1704, 1714, 1738, 1740, 1743, 1748, 1753, 1754, 1756, 1757, 1766, 1767, 1768, 1769, 1771, 1781, 1783, 1785, 1788, 1789, 1798, 1800, 1802, 1803, 1817, 1819, 1828, 1834, 1835, 1837, 1838, 1840, 1842, 1844], "step_typ": [0, 1, 2, 652, 1206, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "stepsiz": [572, 1206, 1704], "stick": [377, 1809], "still": [2, 342, 370, 574, 1206, 1704, 1730, 1737, 1743, 1757, 1767, 1776, 1786, 1789, 1808, 1809, 1810, 1817, 1824, 1828, 1829, 1834, 1837, 1838], "stimul": 1776, "sto": [284, 386, 1694, 1707, 1710, 1713, 1714, 1724, 1729, 1730, 1731, 1732, 1733, 1740, 1749, 1752, 1754, 1757, 1803, 1832, 1838, 1842], "stock": 1738, "stockhold": [1734, 1776, 1790], "stoichiometr": 1752, "stone": [303, 1220, 1681, 1734, 1738, 1777, 1780, 1837], "stop": [106, 257, 261, 570, 680, 838, 1002, 1006, 1007, 1206, 1210, 1215, 1226, 1229, 1231, 1334, 1347, 1426, 1567, 1571, 1704, 1746, 1838], "stopgap": 1782, "storag": [0, 150, 176, 212, 255, 262, 367, 433, 466, 507, 514, 568, 627, 668, 1199, 1200, 1201, 1202, 1206, 1225, 1242, 1704, 1708, 1742, 1743, 1756, 1767, 1771, 1776, 1824, 1841], "store": [0, 2, 11, 73, 87, 106, 112, 150, 255, 326, 327, 329, 342, 352, 356, 430, 433, 466, 488, 502, 504, 505, 507, 514, 627, 710, 734, 735, 814, 815, 822, 863, 991, 1010, 1176, 1199, 1200, 1201, 1202, 1206, 1208, 1210, 1215, 1222, 1225, 1226, 1229, 1231, 1242, 1250, 1251, 1296, 1327, 1408, 1547, 1548, 1550, 1558, 1704, 1714, 1730, 1737, 1738, 1742, 1743, 1746, 1750, 1752, 1767, 1768, 1769, 1772, 1776, 1786, 1788, 1798, 1801, 1808, 1809, 1817, 1828, 1838, 1842, 1844], "stow": 1743, "stp": [300, 301, 302, 390, 1232, 1665, 1667, 1704, 1772, 1843], "str": [2, 7, 8, 9, 11, 13, 15, 16, 18, 21, 27, 29, 31, 32, 33, 34, 38, 40, 41, 42, 44, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 64, 68, 73, 74, 75, 76, 78, 80, 84, 86, 87, 90, 91, 92, 96, 97, 98, 100, 101, 103, 104, 105, 106, 108, 111, 114, 115, 118, 119, 120, 128, 138, 147, 148, 150, 151, 152, 174, 175, 176, 187, 194, 195, 196, 197, 200, 202, 205, 207, 208, 209, 210, 211, 212, 214, 219, 220, 221, 222, 223, 225, 226, 229, 231, 235, 236, 238, 239, 244, 245, 246, 248, 249, 252, 254, 255, 257, 258, 262, 263, 265, 266, 267, 268, 269, 270, 276, 277, 278, 279, 280, 282, 283, 284, 285, 286, 287, 288, 289, 290, 292, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 308, 309, 310, 312, 313, 314, 317, 318, 319, 321, 326, 327, 330, 331, 332, 333, 336, 337, 338, 339, 340, 342, 343, 345, 346, 347, 348, 349, 350, 351, 354, 355, 358, 359, 360, 361, 364, 365, 366, 367, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 386, 388, 389, 390, 391, 392, 395, 396, 397, 399, 1740, 1743, 1752, 1759, 1761, 1764, 1766, 1768, 1769, 1772, 1774, 1775, 1791, 1794, 1797, 1799, 1800, 1826], "straight": 1810, "straightforward": [616, 635, 652, 697, 1206, 1704, 1743, 1782, 1798, 1802, 1834], "strain": [1714, 1755, 1842], "strand": [1692, 1752], "strang": [660, 1206, 1704], "strategi": [377, 575, 652, 1206, 1704, 1734, 1801, 1823, 1824], "stratmann": [356, 1231, 1528, 1704, 1734, 1757, 1841], "stream": [271, 278, 280, 1743], "streamnov": 1735, "strenght": 1841, "strength": [0, 150, 377, 608, 614, 622, 690, 709, 711, 712, 1206, 1668, 1669, 1690, 1704, 1776, 1824, 1837, 1841], "stretch": [1226, 1299, 1337, 1704, 1711, 1714, 1798, 1802, 1842], "strict": [1125, 1221, 1704, 1738, 1771, 1837], "strict_label": [296, 1769], "strictli": [1224, 1238, 1239, 1704, 1736, 1767, 1810], "stride": [1810, 1817], "string": [0, 1, 2, 8, 86, 87, 106, 111, 114, 138, 150, 229, 246, 248, 265, 266, 267, 268, 269, 270, 276, 277, 278, 280, 282, 284, 285, 286, 299, 304, 309, 313, 330, 332, 336, 337, 349, 350, 351, 360, 364, 367, 370, 373, 374, 380, 388, 389, 391, 395, 402, 403, 409, 411, 414, 421, 423, 428, 430, 434, 444, 445, 446, 454, 456, 464, 465, 467, 474, 475, 482, 483, 484, 492, 506, 508, 511, 512, 513, 516, 521, 522, 523, 533, 535, 539, 545, 546, 547, 551, 553, 556, 557, 560, 563, 565, 567, 568, 570, 571, 573, 574, 575, 577, 581, 584, 586, 589, 590, 592, 599, 600, 601, 608, 609, 610, 613, 615, 617, 619, 621, 623, 624, 627, 628, 629, 630, 631, 635, 636, 637, 638, 640, 641, 643, 647, 650, 652, 655, 656, 660, 662, 664, 665, 666, 668, 669, 673, 674, 676, 677, 683, 693, 696, 701, 702, 703, 705, 707, 708, 717, 719, 721, 725, 726, 727, 730, 731, 732, 733, 746, 748, 750, 758, 767, 769, 773, 778, 810, 811, 822, 823, 824, 825, 827, 829, 830, 835, 838, 843, 845, 851, 858, 874, 875, 880, 882, 889, 891, 892, 898, 899, 900, 926, 929, 935, 944, 946, 947, 948, 951, 959, 960, 961, 962, 963, 964, 965, 968, 975, 989, 1000, 1011, 1013, 1015, 1018, 1043, 1046, 1047, 1048, 1049, 1052, 1063, 1070, 1075, 1098, 1100, 1103, 1106, 1107, 1109, 1119, 1120, 1125, 1129, 1130, 1133, 1142, 1146, 1147, 1150, 1154, 1156, 1158, 1163, 1166, 1167, 1169, 1170, 1187, 1194, 1195, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1218, 1219, 1220, 1221, 1222, 1223, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1248, 1279, 1281, 1282, 1284, 1291, 1292, 1293, 1296, 1297, 1304, 1307, 1308, 1309, 1310, 1311, 1313, 1318, 1319, 1320, 1321, 1322, 1324, 1329, 1336, 1338, 1339, 1342, 1346, 1352, 1354, 1357, 1358, 1359, 1360, 1368, 1371, 1375, 1376, 1377, 1383, 1384, 1393, 1394, 1398, 1399, 1402, 1403, 1417, 1423, 1429, 1433, 1437, 1443, 1445, 1446, 1453, 1454, 1470, 1471, 1472, 1475, 1479, 1484, 1485, 1492, 1500, 1501, 1502, 1505, 1507, 1509, 1518, 1524, 1526, 1527, 1528, 1532, 1534, 1537, 1563, 1584, 1589, 1599, 1601, 1609, 1611, 1612, 1615, 1620, 1626, 1628, 1629, 1630, 1631, 1633, 1634, 1649, 1651, 1658, 1662, 1664, 1704, 1708, 1711, 1714, 1738, 1740, 1742, 1743, 1746, 1748, 1749, 1750, 1752, 1754, 1755, 1757, 1759, 1761, 1762, 1764, 1768, 1770, 1771, 1772, 1774, 1775, 1786, 1788, 1789, 1791, 1794, 1796, 1798, 1801, 1802, 1803, 1828, 1832, 1833, 1834, 1836, 1837, 1841, 1842, 1844], "strip": [392, 1757], "strnotoutfil": [282, 332], "strong": [446, 484, 523, 547, 1199, 1200, 1202, 1203, 1704, 1789, 1838], "strongli": [342, 568, 656, 664, 666, 1206, 1230, 1441, 1704, 1738, 1770, 1795, 1805, 1833, 1837], "structur": [0, 2, 106, 318, 319, 329, 342, 356, 619, 635, 652, 1206, 1692, 1704, 1706, 1714, 1734, 1738, 1743, 1752, 1755, 1757, 1759, 1767, 1772, 1777, 1778, 1781, 1786, 1787, 1788, 1790, 1791, 1795, 1796, 1800, 1804, 1808, 1814, 1824, 1831, 1833, 1835, 1836, 1840, 1841, 1842], "stub": 1733, "studi": [1767, 1781, 1828, 1833, 1837, 1838, 1844], "stuff": [1757, 1788, 1833], "style": [2, 282, 285, 287, 295, 318, 319, 332, 336, 338, 1730, 1738, 1740, 1766, 1788, 1800, 1828], "sub": [794, 1210, 1231, 1620, 1704, 1738, 1750, 1810], "subblock": [100, 135, 837, 1210, 1704, 1755], "subchannel": 1748, "subdegen": 20, "subdictionari": 370, "subdir": 1785, "subdirectori": [1743, 1785, 1832, 1842], "subdivis": [1231, 1516, 1704], "subfold": [0, 2], "subgroup": [20, 573, 609, 616, 619, 696, 698, 1206, 1704, 1781, 1833, 1843], "subject": [676, 684, 685, 689, 691, 1125, 1126, 1206, 1221, 1704, 1757, 1771, 1833, 1837], "submatrix": [830, 833, 1210, 1704, 1810], "submit": [1230, 1469, 1704, 1786, 1788, 1828, 1837, 1844], "submitt": 1786, "submodul": 1764, "subn": 20, "subscrib": 1748, "subscript": [1750, 1764, 1798, 1801, 1837], "subsequ": [609, 706, 1206, 1225, 1270, 1704, 1714, 1767, 1776, 1835, 1842], "subset": [150, 284, 626, 628, 1206, 1226, 1371, 1692, 1704, 1711, 1714, 1736, 1740, 1743, 1752, 1767, 1785, 1794, 1796, 1802, 1824, 1833, 1837, 1838, 1842], "subsidiari": 1837, "subspac": [0, 1, 13, 150, 277, 342, 356, 404, 470, 583, 725, 751, 752, 755, 808, 811, 837, 842, 1197, 1200, 1206, 1207, 1208, 1210, 1704, 1714, 1755, 1795, 1841, 1842], "substanti": [0, 575, 1206, 1704, 1760], "substitu": 1770, "substitut": [106, 1232, 1666, 1704, 1738, 1748, 1755, 1756, 1757, 1764, 1770, 1786, 1788, 1810, 1832, 1843], "substract": 100, "subsum": [284, 1692, 1740, 1752], "subsystem": [1748, 1770, 1776, 1781, 1794], "subtaskcomput": [1768, 1777], "subtl": 1797, "subtli": 1810, "subtract": [100, 539, 835, 1203, 1210, 1704, 1742, 1752, 1828, 1844], "succe": 1838, "success": [0, 86, 126, 273, 647, 1002, 1006, 1007, 1008, 1009, 1206, 1215, 1231, 1490, 1704, 1738, 1743, 1746, 1757, 1788, 1794, 1802], "successfulli": [1781, 1788, 1802, 1837], "successor": 1838, "suddenli": 1767, "sudo": 1748, "suffer": [1756, 1798, 1838], "suffic": [1730, 1802, 1833], "suffici": [0, 2, 574, 1206, 1704, 1714, 1738, 1742, 1743, 1753, 1760, 1767, 1771, 1817, 1828, 1837, 1838, 1842, 1844], "suffix": [202, 1738, 1775, 1788, 1838], "suggest": [2, 279, 1230, 1469, 1704, 1736, 1748, 1767, 1788, 1802, 1814, 1833, 1837, 1838], "suit": [400, 586, 1206, 1704, 1738, 1739, 1742, 1743, 1777, 1788, 1814, 1824, 1832, 1840], "suitabl": [2, 8, 285, 287, 336, 338, 373, 386, 389, 391, 1158, 1221, 1704, 1738, 1755, 1756, 1757, 1781, 1829, 1838, 1841], "sulfid": [1692, 1752], "sum": [13, 64, 100, 150, 314, 346, 835, 1101, 1210, 1220, 1226, 1231, 1303, 1341, 1538, 1704, 1740, 1742, 1759, 1771, 1775, 1776, 1791, 1794, 1802, 1833, 1836, 1837, 1838], "sum_": [377, 1742, 1755, 1757, 1759, 1763, 1771, 1776, 1798, 1829, 1838, 1841], "sum_a": [1742, 1755, 1771, 1829], "sum_i": [1755, 1771, 1829], "sum_ia": 11, "sum_k": 1771, "sum_of_squar": 100, "summar": [0, 1730, 1733, 1742, 1743, 1748, 1753, 1771, 1798, 1799, 1817, 1838], "summari": [3, 5, 6, 7, 8, 9, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 26, 27, 29, 30, 61, 62, 63, 64, 66, 68, 70, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 86, 87, 88, 89, 90, 91, 92, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 108, 110, 111, 112, 113, 114, 115, 118, 119, 120, 122, 126, 128, 130, 131, 132, 133, 134, 135, 137, 138, 139, 140, 141, 143, 144, 145, 147, 148, 149, 150, 183, 184, 267, 275, 292, 321, 322, 323, 324, 325, 326, 327, 329, 343, 807, 1210, 1704, 1738, 1739, 1740, 1743, 1757, 1786, 1790, 1828, 1837, 1838, 1843, 1844], "summat": [1228, 1394, 1704, 1753, 1817], "summation_field": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "super_mix": [1714, 1842], "superbuild": 1738, "supercomput": [575, 1206, 1704, 1738], "superfici": [1714, 1842], "superfunct": [84, 147, 1714, 1757, 1827, 1842], "superior": [284, 1740, 1838], "supermatrix": [623, 1206, 1231, 1592, 1704], "supermolecular": [1802, 1837], "superposit": [84, 1714, 1777, 1779, 1781, 1831, 1838, 1842], "supersed": 1767, "supersystem": [1776, 1794], "supplement": [1714, 1842], "supplementari": [1738, 1837], "suppli": [100, 106, 148, 150, 284, 314, 331, 577, 592, 679, 706, 1206, 1704, 1730, 1733, 1738, 1740, 1743, 1748, 1791, 1797, 1801, 1817, 1821, 1838, 1844], "support": [0, 18, 128, 265, 284, 296, 381, 382, 787, 1129, 1210, 1221, 1224, 1231, 1241, 1651, 1692, 1704, 1730, 1735, 1738, 1740, 1742, 1749, 1750, 1752, 1753, 1754, 1756, 1757, 1759, 1761, 1769, 1774, 1775, 1777, 1782, 1790, 1792, 1794, 1797, 1798, 1802, 1803, 1810, 1817, 1823, 1826, 1832, 1833, 1836, 1837, 1838, 1841, 1844], "suppos": [1801, 1828, 1844], "suppress": [1738, 1759, 1794, 1828], "supramolecular": 1794, "sure": [884, 1126, 1210, 1221, 1704, 1714, 1734, 1735, 1738, 1747, 1748, 1753, 1756, 1767, 1774, 1781, 1785, 1788, 1817, 1823, 1833, 1838, 1842], "surfac": [617, 1206, 1704, 1711, 1714, 1750, 1778, 1781, 1802, 1832, 1842], "surpris": [1828, 1844], "surprisingli": [1757, 1844], "surround": [1730, 1844], "survei": 1788, "surviv": 1817, "suscept": [1828, 1837, 1844], "suspect": 1757, "sv": [1231, 1485, 1694, 1704, 1732, 1733], "sv_p_": [1694, 1707, 1731, 1732], "svp": [106, 1694, 1707, 1711, 1731, 1732, 1733, 1740, 1772, 1774, 1794], "svpd": [1694, 1707, 1731, 1732, 1733], "svwn": [295, 318, 319, 1695, 1698, 1703, 1714, 1739, 1757, 1758, 1766, 1781, 1800, 1842], "swap": [1713, 1742], "swear": 1767, "sweep": [1007, 1215, 1704, 1746], "switch": [2, 153, 614, 656, 769, 855, 1101, 1206, 1209, 1210, 1220, 1231, 1510, 1704, 1738, 1748, 1754, 1757, 1775, 1788, 1789, 1802, 1809, 1817, 1838], "sx": [295, 1695, 1697, 1698, 1700, 1701, 1702, 1758, 1766, 1817], "sy": [1767, 1786, 1788, 1817, 1828], "sym": [1714, 1785, 1841, 1842], "sym_check": [697, 1206, 1704], "symbol": [81, 91, 106, 120, 388, 389, 1150, 1221, 1229, 1433, 1704, 1736, 1746, 1764, 1767, 1771, 1808, 1833, 1835], "symemtri": [1714, 1842], "symlink": [1738, 1785, 1788], "symm": [284, 1713, 1740, 1752, 1785], "symm_oper": 17, "symmetr": [0, 1, 2, 13, 100, 103, 106, 300, 301, 302, 387, 573, 574, 575, 603, 656, 681, 697, 726, 881, 1206, 1208, 1210, 1226, 1231, 1301, 1591, 1601, 1649, 1704, 1711, 1714, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "symmetri": [0, 2, 11, 14, 16, 17, 91, 100, 106, 111, 118, 128, 130, 132, 139, 143, 145, 150, 237, 259, 262, 263, 286, 287, 295, 298, 300, 301, 302, 337, 338, 348, 363, 387, 390, 399, 420, 490, 495, 528, 569, 573, 574, 593, 609, 614, 615, 616, 617, 619, 648, 660, 671, 672, 681, 697, 698, 707, 833, 835, 887, 993, 1124, 1150, 1194, 1198, 1200, 1202, 1206, 1210, 1215, 1221, 1222, 1226, 1229, 1230, 1231, 1232, 1308, 1431, 1432, 1433, 1564, 1655, 1666, 1689, 1704, 1708, 1714, 1726, 1730, 1734, 1735, 1742, 1743, 1746, 1749, 1750, 1752, 1753, 1754, 1755, 1763, 1766, 1770, 1772, 1776, 1777, 1782, 1785, 1789, 1790, 1795, 1798, 1802, 1803, 1805, 1810, 1828, 1829, 1832, 1841, 1842, 1843, 1844], "symmetrize_gradi": 100, "symmetry_from_input": 106, "symmetryoper": [17, 1827], "symnorm": 12, "sync": [86, 150, 1786], "synergist": 1828, "synonym": [677, 1206, 1226, 1352, 1704, 1828, 1833], "syntax": [2, 279, 366, 379, 380, 1714, 1730, 1738, 1743, 1757, 1767, 1768, 1774, 1777, 1779, 1799, 1803, 1824, 1828, 1832, 1833, 1842, 1844], "sysadmin": 1738, "sysroot": 1738, "system": [1, 2, 106, 150, 261, 267, 286, 295, 298, 300, 301, 302, 337, 348, 381, 382, 608, 620, 660, 726, 777, 861, 1206, 1208, 1209, 1210, 1224, 1226, 1231, 1237, 1298, 1655, 1692, 1704, 1714, 1722, 1738, 1742, 1743, 1746, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1762, 1763, 1765, 1766, 1767, 1768, 1770, 1771, 1772, 1773, 1775, 1777, 1782, 1783, 1784, 1785, 1794, 1795, 1798, 1802, 1803, 1805, 1808, 1810, 1824, 1826, 1829, 1833, 1835, 1837, 1838, 1839, 1841, 1842], "system_n": 1738, "systemat": [2, 1781, 1837], "sz": [1817, 1821], "szabo": [1734, 1757], "szalai": [655, 1206, 1704], "szalewicz": [1714, 1734, 1759, 1781, 1828, 1837, 1842, 1844], "t": [0, 1, 2, 8, 11, 75, 76, 84, 103, 153, 167, 190, 279, 284, 295, 300, 301, 302, 318, 319, 346, 356, 367, 370, 384, 389, 390, 509, 568, 586, 603, 605, 635, 647, 652, 659, 664, 665, 697, 700, 786, 799, 819, 843, 846, 847, 848, 882, 961, 1070, 1075, 1083, 1084, 1085, 1088, 1106, 1201, 1205, 1206, 1210, 1213, 1219, 1221, 1226, 1229, 1230, 1354, 1399, 1406, 1411, 1420, 1428, 1429, 1455, 1480, 1669, 1670, 1675, 1680, 1683, 1689, 1692, 1694, 1695, 1697, 1698, 1700, 1702, 1703, 1704, 1706, 1707, 1711, 1714, 1717, 1720, 1723, 1730, 1731, 1732, 1733, 1734, 1735, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1777, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1828, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1844], "t1": [11, 641, 1206, 1669, 1680, 1692, 1704, 1708, 1752, 1776, 1781], "t1_diagnost": 11, "t2": [429, 641, 1199, 1206, 1230, 1459, 1461, 1704, 1708, 1837], "t2_coupl": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "t3": [699, 1206, 1704], "t3_ws_incor": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "t_": [1742, 1757, 1763, 1771, 1829, 1836], "t_1": [432, 452, 457, 1199, 1704, 1742, 1771], "t_1t_2": 1771, "t_2": [452, 457, 1199, 1704, 1742, 1771], "t_amp": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "t_cut_clmo": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "t_cut_cpao": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "t_cut_do": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "t_cut_do_ij": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "t_cut_do_pr": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "t_cut_mkn": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "t_cut_pno": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "t_cut_pr": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "t_i": [1742, 1771, 1829], "t_ia": 11, "ta": [1707, 1731], "tabl": [0, 17, 20, 86, 268, 284, 292, 318, 319, 343, 373, 391, 439, 473, 586, 737, 818, 850, 924, 1079, 1166, 1199, 1200, 1206, 1208, 1210, 1213, 1219, 1221, 1224, 1225, 1226, 1229, 1231, 1233, 1236, 1257, 1324, 1410, 1497, 1521, 1552, 1704, 1714, 1730, 1733, 1739, 1740, 1742, 1746, 1752, 1753, 1755, 1756, 1757, 1759, 1760, 1764, 1771, 1777, 1779, 1781, 1788, 1789, 1792, 1794, 1798, 1799, 1800, 1801, 1802, 1817, 1828, 1833, 1834, 1838, 1842, 1844], "tabul": [1714, 1743, 1752, 1754, 1759, 1832, 1842], "tack": [1743, 1767], "tackl": 0, "tag": [265, 284, 1738, 1740, 1757, 1767, 1785, 1787, 1794, 1804, 1814], "tagl": 1835, "taglin": [267, 1759], "tailor": [1738, 1808], "tajti": [655, 1206, 1704], "takatani": [1692, 1752], "take": [2, 100, 148, 335, 609, 749, 1206, 1208, 1225, 1232, 1279, 1296, 1666, 1704, 1714, 1735, 1737, 1738, 1743, 1747, 1748, 1750, 1752, 1753, 1756, 1757, 1759, 1762, 1764, 1767, 1770, 1775, 1783, 1788, 1795, 1797, 1798, 1799, 1801, 1802, 1809, 1810, 1822, 1824, 1828, 1833, 1837, 1838, 1842, 1843], "taken": [0, 2, 8, 84, 150, 285, 287, 336, 338, 346, 374, 395, 474, 573, 639, 1200, 1206, 1228, 1231, 1382, 1616, 1617, 1692, 1704, 1714, 1735, 1742, 1749, 1752, 1759, 1770, 1782, 1797, 1802, 1817, 1833, 1838, 1842], "takeshita": 1734, "tamm": [1231, 1656, 1704, 1841], "tamp": 1721, "tang": [1013, 1018, 1216, 1692, 1704, 1752], "tar": [1759, 1788], "tarbal": [1736, 1738, 1759, 1767, 1774], "target": [0, 8, 265, 268, 284, 288, 295, 299, 300, 301, 302, 312, 318, 319, 329, 339, 349, 378, 381, 382, 827, 992, 1158, 1210, 1215, 1221, 1229, 1231, 1400, 1401, 1412, 1433, 1485, 1704, 1714, 1738, 1740, 1746, 1754, 1764, 1766, 1768, 1770, 1772, 1781, 1785, 1788, 1792, 1794, 1795, 1800, 1808, 1815, 1826, 1837, 1842], "task": [92, 111, 265, 715, 1112, 1207, 1221, 1704, 1740, 1743, 1767, 1768, 1770, 1772, 1776, 1781, 1794, 1804, 1823, 1824, 1828, 1831, 1832, 1840, 1844], "task_bas": [1740, 1768, 1772, 1794, 1827], "task_list": [1740, 1772, 1794], "task_plann": [1768, 1777], "taskcomput": [1768, 1777], "tast": 1738, "tau": [295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1706, 1753, 1758, 1766, 1800, 1802], "tau_": 1757, "tau_compton_wavelength": 1706, "tau_compton_wavelength_over_2_pi": 1706, "tau_electron_mass_ratio": 1706, "tau_mass": 1706, "tau_mass_energy_equival": 1706, "tau_mass_energy_equivalent_in_mev": 1706, "tau_mass_in_u": 1706, "tau_molar_mass": 1706, "tau_muon_mass_ratio": 1706, "tau_neutron_mass_ratio": 1706, "tau_p": 1753, "tau_proton_mass_ratio": 1706, "taub": [1229, 1427, 1704, 1734], "tb": [650, 1206, 1704], "tc": [1707, 1731], "tcc": 1802, "tcscf": [569, 593, 676, 1206, 1222, 1682, 1704, 1714, 1781, 1829, 1842], "tcsh": [1738, 1748, 1767], "tcshrc": [1738, 1748, 1767], "td": [106, 295, 662, 1206, 1232, 1666, 1690, 1698, 1704, 1714, 1749, 1754, 1766, 1776, 1795, 1803, 1841, 1842, 1843], "tda": [608, 1206, 1231, 1656, 1704, 1714, 1841, 1842], "tddft": [295, 1698, 1757, 1766, 1781, 1841], "tdm": [0, 1, 2, 1704, 1714, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "tdscf": [277, 1652, 1653, 1704, 1714, 1724, 1777, 1790, 1842], "tdscf_coeff_cutoff": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1843, 1844], "tdscf_excit": 1841, "tdscf_guess": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1843, 1844], "tdscf_maxit": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1843, 1844], "tdscf_print": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1843, 1844], "tdscf_r_converg": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1843, 1844], "tdscf_state": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1843, 1844], "tdscf_tda": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1843, 1844], "tdscf_tdm_print": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1843, 1844], "tdscf_triplet": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1843, 1844], "tdscfconvergenceerror": 1827, "te": [1707, 1731], "te_integr": 1785, "team": [1757, 1777, 1780], "tear_down": 1788, "tech": [1692, 1752], "technic": [130, 1777, 1796, 1798], "techniqu": [441, 478, 517, 1199, 1200, 1202, 1229, 1688, 1704, 1742, 1753, 1757, 1771, 1775, 1781, 1798, 1824, 1828, 1838, 1844], "technologi": [1757, 1818, 1838], "tei": [103, 415, 740, 905, 1053, 1198, 1208, 1212, 1218, 1224, 1231, 1234, 1569, 1704, 1785], "tell": [284, 611, 627, 682, 1206, 1704, 1738, 1740, 1767, 1801, 1808, 1828, 1832, 1833, 1844], "teller": 1759, "temp": [288, 289, 339, 340, 386, 1772], "temperatur": [390, 701, 1206, 1232, 1667, 1704, 1706, 1714, 1754, 1776, 1842, 1843], "templat": [2, 290, 1738, 1770, 1808, 1821], "tempor": 1804, "temporari": [2, 84, 87, 1708, 1738, 1740, 1767, 1770], "temporarili": [1740, 1748, 1757, 1786, 1788], "ten": 1838, "tend": [1837, 1838], "tensor": [0, 92, 94, 100, 106, 539, 598, 669, 673, 695, 915, 916, 1072, 1203, 1206, 1213, 1219, 1230, 1231, 1444, 1486, 1669, 1704, 1708, 1738, 1742, 1756, 1757, 1767, 1771, 1776, 1824, 1837, 1838], "tent": [1738, 1788], "term": [0, 92, 295, 411, 430, 513, 557, 568, 575, 660, 693, 727, 745, 951, 1012, 1014, 1016, 1017, 1019, 1020, 1022, 1029, 1198, 1199, 1202, 1204, 1206, 1208, 1213, 1216, 1218, 1225, 1229, 1230, 1283, 1294, 1403, 1404, 1442, 1448, 1449, 1450, 1454, 1464, 1465, 1466, 1704, 1714, 1730, 1733, 1735, 1738, 1742, 1748, 1753, 1756, 1757, 1759, 1766, 1770, 1771, 1776, 1781, 1785, 1786, 1788, 1790, 1792, 1793, 1798, 1801, 1802, 1810, 1817, 1823, 1828, 1829, 1831, 1832, 1833, 1836, 1838, 1842, 1844], "termin": [616, 632, 656, 755, 883, 1206, 1208, 1210, 1231, 1516, 1704, 1738, 1743, 1748, 1767, 1838], "ters": 1801, "tertiari": [1714, 1842], "tesla": 1706, "test": [100, 106, 138, 283, 285, 286, 333, 336, 337, 400, 647, 665, 719, 882, 1096, 1206, 1207, 1210, 1219, 1226, 1369, 1370, 1692, 1704, 1710, 1711, 1713, 1714, 1718, 1720, 1721, 1722, 1724, 1725, 1726, 1727, 1729, 1730, 1735, 1743, 1748, 1752, 1755, 1757, 1759, 1760, 1764, 1767, 1772, 1777, 1781, 1787, 1799, 1802, 1803, 1809, 1814, 1815, 1828, 1832, 1837, 1838, 1840, 1843, 1844], "test_": 2, "test_addon": 1738, "test_b": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "test_cfour": 1738, "test_chemps2": 1738, "test_ci_properti": 2, "test_derivative_b": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "test_dftd3": 1738, "test_dkh": 1738, "test_funct": 138, "test_gdma": 1738, "test_grimme_3c": 1738, "test_json": 1738, "test_libefp": 1738, "test_mp2": 2, "test_mrcc": 1738, "test_name_frag": 2, "test_pcmsolv": 1738, "test_psi4": 1738, "test_psi4_bas": 1738, "test_psi4_ca": 1738, "test_psi4_cc": 1738, "test_psi4_dfmp2": 1738, "test_psi4_sapt": 1738, "test_psi4_scfproperti": 1738, "test_simint": 1738, "test_v2rdm_casscf": 1738, "test_vibanalysi": [1772, 1843], "testcomparisonerror": 1827, "tester": 106, "testfunct": 1808, "testingmacro": 2, "testlabel": 1738, "testnam": 1738, "testplugin": 1808, "teter93": [295, 318, 319, 1695, 1698, 1703, 1758, 1766, 1800], "tetrahedr": 1757, "tetram": [1714, 1842], "tetrod": 1706, "texa": 1743, "text": [87, 194, 245, 271, 282, 283, 284, 332, 333, 366, 379, 380, 386, 864, 1130, 1170, 1210, 1221, 1704, 1738, 1740, 1741, 1759, 1768, 1772, 1776, 1791, 1798, 1808, 1828, 1829, 1836], "textbf": [284, 1740, 1741], "textrm": 1829, "textsf": 1776, "textsl": 1776, "tga": 1750, "th": [0, 8, 17, 81, 91, 295, 318, 319, 681, 1206, 1695, 1698, 1699, 1703, 1704, 1755, 1758, 1766, 1799, 1800], "th1": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "th2": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "th3": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "th4": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "than": [0, 2, 8, 106, 138, 150, 192, 193, 203, 204, 285, 287, 314, 329, 336, 338, 388, 550, 582, 596, 608, 666, 671, 684, 710, 794, 808, 852, 863, 867, 875, 881, 1001, 1065, 1085, 1087, 1102, 1203, 1206, 1210, 1215, 1219, 1221, 1224, 1226, 1236, 1303, 1341, 1362, 1692, 1704, 1708, 1714, 1730, 1736, 1740, 1742, 1743, 1746, 1748, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1761, 1763, 1764, 1767, 1768, 1770, 1771, 1774, 1783, 1785, 1789, 1791, 1794, 1795, 1798, 1801, 1802, 1809, 1810, 1817, 1821, 1822, 1824, 1828, 1829, 1833, 1837, 1838, 1841, 1842, 1844], "thank": [1757, 1837], "thanthiriwatt": [1692, 1752], "thc": [94, 1131, 1132, 1133, 1134, 1136, 1137, 1221, 1704], "thei": [0, 2, 284, 285, 300, 301, 302, 336, 579, 614, 616, 682, 935, 1124, 1127, 1128, 1206, 1213, 1221, 1230, 1464, 1465, 1466, 1704, 1714, 1738, 1740, 1747, 1755, 1757, 1761, 1767, 1770, 1772, 1779, 1785, 1788, 1798, 1801, 1802, 1806, 1808, 1810, 1813, 1817, 1822, 1828, 1832, 1833, 1835, 1837, 1838, 1842, 1843, 1844], "them": [2, 112, 327, 329, 346, 1065, 1129, 1219, 1221, 1704, 1714, 1737, 1738, 1740, 1743, 1747, 1748, 1757, 1759, 1767, 1768, 1770, 1772, 1779, 1785, 1788, 1794, 1801, 1802, 1804, 1808, 1809, 1810, 1815, 1817, 1822, 1823, 1824, 1832, 1835, 1837, 1842, 1844], "theme": 1738, "themselv": [1757, 1817, 1841, 1843], "theor": [1734, 1740, 1781], "theorem": [925, 1213, 1225, 1259, 1260, 1704, 1757, 1781, 1798], "theoret": [1734, 1757, 1764, 1777, 1795], "theori": [0, 84, 140, 150, 165, 173, 237, 268, 269, 295, 296, 300, 301, 302, 308, 318, 319, 352, 356, 377, 378, 381, 382, 446, 484, 677, 957, 1199, 1200, 1206, 1208, 1213, 1225, 1229, 1230, 1231, 1289, 1423, 1479, 1671, 1673, 1688, 1689, 1690, 1695, 1696, 1697, 1698, 1700, 1703, 1704, 1714, 1715, 1730, 1733, 1734, 1743, 1744, 1745, 1746, 1754, 1758, 1761, 1766, 1769, 1770, 1772, 1776, 1777, 1780, 1782, 1790, 1792, 1794, 1799, 1800, 1806, 1826, 1828, 1833, 1842, 1844], "theoryfs2": 1738, "thereaft": 1743, "thereat": 1833, "therebi": [1757, 1759, 1838], "therefor": [2, 573, 890, 1206, 1210, 1704, 1739, 1743, 1757, 1763, 1767, 1776, 1798, 1817, 1824, 1828, 1833, 1837, 1838, 1844], "thereof": [1714, 1748, 1833, 1842], "thermal": [1691, 1776, 1843], "thermo": [300, 301, 302, 307, 400, 1704, 1705, 1709, 1714, 1772, 1842, 1843], "thermochem": [307, 390, 399, 1752, 1757, 1772, 1777, 1790], "thermochemistri": [390, 1757, 1781], "thermodynam": [701, 1206, 1232, 1665, 1666, 1667, 1704, 1714, 1828, 1842, 1843, 1844], "thesi": 1770, "theta": [100, 139, 855, 1210, 1228, 1396, 1704, 1789], "theta_a": [1759, 1802], "theta_b": [1759, 1802], "theta_c": 1759, "theta_point": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "theta_vib": [386, 1772], "thi": [0, 1, 2, 8, 9, 18, 73, 81, 84, 86, 87, 88, 98, 100, 106, 115, 132, 137, 138, 148, 150, 183, 184, 208, 209, 210, 235, 236, 247, 265, 277, 283, 284, 285, 295, 296, 297, 303, 314, 318, 319, 322, 325, 329, 331, 333, 335, 336, 342, 347, 356, 368, 369, 370, 377, 380, 381, 382, 389, 393, 399, 401, 404, 406, 407, 430, 470, 476, 539, 561, 574, 599, 603, 606, 608, 609, 610, 611, 616, 619, 620, 621, 623, 625, 627, 628, 629, 630, 631, 632, 633, 634, 635, 637, 639, 640, 641, 643, 644, 645, 648, 652, 656, 657, 658, 660, 661, 664, 665, 670, 671, 672, 675, 679, 681, 694, 695, 699, 701, 708, 709, 711, 712, 738, 755, 799, 810, 811, 823, 827, 833, 842, 852, 874, 881, 882, 884, 887, 888, 890, 891, 930, 949, 958, 1001, 1065, 1070, 1076, 1084, 1085, 1088, 1095, 1096, 1101, 1125, 1126, 1127, 1128, 1129, 1148, 1158, 1170, 1197, 1199, 1200, 1203, 1204, 1206, 1208, 1210, 1213, 1215, 1219, 1220, 1221, 1224, 1225, 1226, 1229, 1230, 1231, 1232, 1233, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1244, 1266, 1290, 1293, 1299, 1303, 1326, 1341, 1362, 1441, 1442, 1480, 1485, 1500, 1507, 1521, 1564, 1619, 1644, 1655, 1666, 1688, 1690, 1692, 1704, 1713, 1714, 1723, 1726, 1730, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1746, 1747, 1748, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1762, 1763, 1764, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1774, 1775, 1776, 1779, 1781, 1782, 1785, 1786, 1788, 1789, 1790, 1791, 1792, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1808, 1809, 1810, 1817, 1820, 1821, 1824, 1826, 1828, 1829, 1831, 1832, 1833, 1834, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "thibeault": 1734, "thick": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "thiessen": 1734, "thing": [603, 884, 1206, 1210, 1704, 1757, 1801, 1804, 1817, 1828], "think": [1230, 1480, 1704, 1737, 1813, 1824, 1837], "thiophen": [1692, 1752, 1802], "third": [106, 115, 150, 259, 295, 314, 318, 319, 381, 382, 592, 616, 630, 640, 671, 1125, 1206, 1221, 1230, 1449, 1452, 1704, 1730, 1734, 1738, 1740, 1753, 1755, 1766, 1770, 1771, 1781, 1782, 1788, 1791, 1798, 1800, 1802, 1826, 1833, 1835, 1837, 1838], "thirdli": 1743, "thisenergi": 2, "thole": [1228, 1385, 1386, 1387, 1388, 1704], "thompson": [1734, 1838], "thomson": 1706, "thomson_cross_sect": 1706, "thorough": [2, 1788, 1837], "thoroughli": 1788, "those": [2, 87, 371, 574, 616, 664, 665, 672, 681, 697, 1093, 1206, 1219, 1229, 1230, 1434, 1455, 1692, 1704, 1711, 1730, 1735, 1738, 1743, 1746, 1748, 1752, 1753, 1755, 1757, 1761, 1767, 1770, 1795, 1796, 1798, 1799, 1801, 1802, 1804, 1809, 1815, 1817, 1824, 1828, 1829, 1833, 1834, 1835, 1837, 1838, 1844], "though": [1714, 1737, 1738, 1740, 1743, 1748, 1757, 1759, 1764, 1767, 1774, 1785, 1786, 1808, 1810, 1821, 1832, 1838, 1842], "thousand": 1838, "thrash": 1756, "thread": [199, 251, 435, 469, 564, 661, 806, 901, 1199, 1200, 1205, 1206, 1210, 1212, 1224, 1229, 1230, 1231, 1240, 1397, 1435, 1436, 1508, 1704, 1726, 1737, 1738, 1756, 1763, 1777, 1781, 1786, 1788, 1804, 1817, 1832, 1837, 1838], "three": [2, 100, 141, 149, 259, 282, 284, 332, 608, 609, 640, 758, 902, 1206, 1208, 1212, 1230, 1231, 1455, 1462, 1481, 1586, 1671, 1704, 1708, 1711, 1714, 1730, 1738, 1740, 1743, 1747, 1752, 1753, 1756, 1763, 1767, 1770, 1776, 1780, 1781, 1782, 1795, 1802, 1817, 1829, 1832, 1833, 1835, 1837, 1838, 1842], "three_particl": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "threecenteroverlapint": [89, 1817, 1827], "threshold": [0, 1, 138, 408, 415, 588, 606, 626, 645, 704, 722, 740, 752, 905, 972, 977, 978, 979, 980, 981, 982, 983, 984, 985, 1053, 1197, 1198, 1206, 1207, 1208, 1212, 1214, 1218, 1224, 1226, 1228, 1230, 1231, 1234, 1312, 1389, 1455, 1498, 1506, 1567, 1569, 1603, 1638, 1644, 1654, 1704, 1749, 1753, 1757, 1768, 1770, 1771, 1785, 1837, 1838, 1841], "through": [2, 8, 94, 96, 106, 247, 275, 284, 295, 300, 301, 302, 342, 356, 575, 601, 611, 632, 633, 634, 652, 656, 1130, 1206, 1215, 1216, 1221, 1232, 1666, 1677, 1678, 1704, 1710, 1714, 1715, 1716, 1726, 1737, 1738, 1739, 1740, 1742, 1743, 1748, 1749, 1752, 1755, 1756, 1757, 1759, 1762, 1764, 1765, 1766, 1767, 1768, 1773, 1774, 1775, 1776, 1777, 1780, 1781, 1782, 1783, 1784, 1785, 1788, 1792, 1793, 1794, 1797, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1814, 1817, 1828, 1829, 1832, 1833, 1834, 1837, 1838, 1839, 1842, 1843, 1844], "throughout": [641, 1206, 1704, 1757, 1821, 1832, 1837, 1838], "throughput": [1734, 1781], "throw": [106, 1721, 1837], "throw_if_neg": 100, "thrown": [115, 1797, 1837, 1838], "thu": [0, 568, 584, 1206, 1704, 1735, 1738, 1742, 1743, 1754, 1755, 1757, 1763, 1774, 1798, 1829, 1833, 1835, 1837, 1838, 1840, 1841], "thymin": [1692, 1752, 1837], "thz": 377, "ti": [1707, 1731, 1838], "tia": 11, "tick": 1788, "ticket": 1804, "tidi": 1764, "tight": [2, 699, 975, 1206, 1214, 1704, 1733, 1757, 1763, 1838], "tighten": [1756, 1838], "tighter": [1757, 1824, 1838], "tightli": 1802, "tijab": 11, "tikhonow": [1229, 1426, 1428, 1704, 1785], "tikhonow_max": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "tikhonow_omega": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "tikhonow_tripl": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "tikonow_omega": 1785, "tild": [1743, 1763, 1802, 1836], "tile": [1231, 1661, 1704], "tile_sz": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "time": [0, 2, 5, 106, 183, 184, 261, 270, 276, 277, 279, 342, 356, 368, 369, 370, 377, 572, 575, 608, 614, 622, 647, 680, 690, 709, 711, 712, 833, 837, 1069, 1206, 1210, 1219, 1226, 1230, 1231, 1299, 1476, 1477, 1565, 1629, 1692, 1704, 1706, 1726, 1738, 1739, 1748, 1752, 1755, 1756, 1757, 1763, 1764, 1767, 1768, 1769, 1771, 1777, 1781, 1782, 1786, 1788, 1790, 1792, 1801, 1802, 1808, 1809, 1817, 1821, 1828, 1832, 1833, 1837, 1838, 1840, 1844], "timer": [170, 188, 213, 257, 258, 260, 261, 1813], "timer_off": 258, "tini": [1714, 1832, 1842], "tion": 106, "tip": [0, 1817], "tip3p": [1714, 1838, 1842], "titl": [111, 265, 317, 365, 1738, 1740, 1756, 1764, 1768, 1772, 1788, 1794, 1799, 1804, 1834, 1838], "tl": [1707, 1731, 1788], "tlaplacedenomin": 1827, "tmp": [288, 289, 339, 340, 1738, 1748, 1767], "tmp_path_factori": 1788, "tn": [1734, 1841], "to_arrai": [11, 100, 106, 148, 1797], "to_dict": [2, 106], "to_fil": [150, 1767, 1838], "to_schema": 106, "to_seri": [100, 148], "to_str": 106, "to_tupl": [64, 100, 148, 331, 1797], "toc": [86, 100, 1764], "tocclean": 86, "tocentri": 100, "tocentry_exist": 86, "tocprint": 86, "tocscan": 86, "tocwrit": 86, "todo": [106, 284, 1740, 1747, 1808], "toenni": [1013, 1018, 1216, 1704], "togeth": [84, 92, 100, 115, 692, 694, 1206, 1704, 1738, 1750, 1753, 1756, 1757, 1764, 1770, 1785, 1788, 1798, 1817, 1837, 1838, 1841, 1844], "toggl": [1, 1735, 1738, 1746, 1749, 1754, 1762, 1765, 1775, 1782, 1803, 1839], "token": 1788, "tol": [2, 106, 383, 1224, 1233, 1704, 1785], "toldict": [2, 383], "toler": [0, 1, 2, 106, 115, 285, 287, 336, 338, 342, 356, 383, 401, 472, 601, 609, 660, 710, 777, 916, 1005, 1072, 1135, 1197, 1200, 1206, 1209, 1213, 1215, 1219, 1221, 1226, 1230, 1231, 1301, 1335, 1440, 1486, 1538, 1572, 1600, 1704, 1743, 1746, 1754, 1757, 1771, 1785, 1795, 1838, 1841], "tomasi": [1734, 1754, 1803], "toml": 1788, "too": [370, 374, 395, 1738, 1743, 1748, 1750, 1756, 1757, 1770, 1785, 1810, 1838], "tooclos": [106, 1768], "took": [1817, 1833], "tool": [1736, 1748, 1767, 1769, 1777, 1786, 1814, 1824, 1827, 1829, 1833], "toolchain": [1746, 1747], "toolkit": 1781, "top": [2, 383, 573, 1206, 1704, 1736, 1738, 1748, 1764, 1767, 1770, 1783, 1787, 1788, 1801, 1805, 1806, 1817, 1828, 1832, 1837, 1842, 1844], "topic": [1743, 1779, 1804], "toro": 1734, "torqu": [1678, 1722, 1776], "torsion": [1714, 1802, 1842], "tot": 1843, "tot_result": 1775, "total": [0, 2, 8, 81, 105, 106, 147, 261, 277, 284, 286, 291, 294, 295, 296, 300, 301, 302, 305, 306, 307, 318, 319, 337, 341, 342, 345, 353, 356, 374, 395, 573, 574, 603, 609, 656, 681, 697, 881, 1099, 1125, 1206, 1210, 1220, 1221, 1227, 1231, 1376, 1490, 1649, 1655, 1658, 1669, 1670, 1671, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1688, 1689, 1690, 1704, 1714, 1740, 1741, 1743, 1750, 1752, 1756, 1757, 1759, 1764, 1766, 1767, 1769, 1770, 1771, 1772, 1774, 1775, 1776, 1781, 1794, 1795, 1800, 1802, 1803, 1810, 1828, 1829, 1832, 1833, 1834, 1836, 1837, 1838, 1841, 1842, 1843, 1844], "total_index": 11, "totalenergi": 1724, "touch": [150, 208, 209, 210, 235, 236, 1764, 1801], "toward": [1738, 1743, 1768, 1802, 1808, 1837], "tpdm": [0, 1, 2, 13, 61, 1225, 1296, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "tpdm_abcd_typ": [0, 1, 2, 1244, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "tpss": [295, 318, 319, 1695, 1697, 1698, 1702, 1703, 1758, 1766, 1800], "tpssh": [295, 318, 319, 1695, 1697, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "tpsslyp1w": [295, 318, 319, 1695, 1698, 1702, 1703, 1758, 1766, 1800], "tq": [284, 860, 875, 1210, 1704, 1714, 1733, 1740, 1741, 1743, 1842], "tq5": [284, 1733, 1740], "tq56": 1733, "tr": [384, 386, 1772], "trace": [100, 139, 767, 1209, 1704, 1738, 1754, 1799], "traceless": [89, 103, 142, 1714, 1799, 1817, 1842], "tracelessquadrupoleint": [1817, 1827], "track": [87, 1776, 1786, 1834], "tractabl": [1730, 1756, 1781], "tradeoff": [1714, 1755, 1842], "tradit": [295, 1766], "tradition": 1764, "trail": 1757, "train": 1764, "trajectori": [1226, 1356, 1374, 1704], "tran": [100, 1734, 1841, 1843], "transa": [100, 182, 259], "transb": [100, 182, 259], "transc": [100, 259], "transcrib": 1828, "transfer": [295, 1692, 1714, 1752, 1757, 1766, 1776, 1781, 1785, 1790, 1842], "transform": [13, 16, 27, 90, 98, 100, 103, 106, 115, 118, 132, 139, 150, 163, 166, 284, 295, 314, 342, 356, 474, 559, 596, 616, 664, 679, 697, 708, 710, 727, 1200, 1204, 1206, 1208, 1226, 1230, 1306, 1443, 1704, 1714, 1726, 1730, 1740, 1752, 1753, 1762, 1763, 1766, 1791, 1836, 1837, 1842], "transform_ci_integr": 13, "transform_mcscf_integr": 13, "transform_tei": 90, "transform_tei_first_half": 90, "transform_tei_second_half": 90, "transfrom": 103, "transit": [0, 13, 279, 329, 368, 369, 377, 495, 574, 603, 608, 610, 635, 652, 685, 887, 1200, 1206, 1210, 1226, 1231, 1354, 1657, 1668, 1669, 1690, 1704, 1714, 1738, 1742, 1755, 1776, 1779, 1788, 1790, 1795, 1798, 1817, 1824, 1835, 1841, 1842], "transition_dipol": [381, 382, 1826], "transition_quadrupol": [381, 382, 1826], "translat": [0, 8, 106, 284, 384, 386, 399, 676, 684, 685, 689, 691, 701, 702, 713, 1157, 1206, 1221, 1231, 1497, 1498, 1577, 1599, 1704, 1711, 1740, 1741, 1743, 1746, 1750, 1764, 1767, 1772, 1775, 1776, 1801, 1802, 1809, 1817, 1835], "translate_psi4": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "transmit": 1840, "transpar": [1735, 1739, 1759, 1767], "transpos": [27, 100, 139, 182, 259, 1756, 1810], "transpose_thi": 100, "transposit": [139, 1810], "transqt2": [561, 1204, 1704, 1738, 1809], "trap": [279, 1743], "travers": [154, 155, 156, 1714, 1779, 1810, 1842], "treat": [106, 284, 446, 484, 523, 547, 703, 704, 972, 981, 985, 1101, 1125, 1199, 1200, 1202, 1203, 1206, 1214, 1220, 1221, 1226, 1313, 1704, 1740, 1748, 1757, 1763, 1767, 1771, 1775, 1794, 1795, 1802, 1806, 1808, 1833, 1836, 1837, 1838], "treatment": [0, 284, 446, 484, 523, 547, 574, 613, 625, 626, 662, 665, 677, 693, 704, 1199, 1200, 1202, 1203, 1206, 1704, 1739, 1740, 1756, 1760, 1768, 1782, 1790, 1794, 1836, 1837], "tree": [1692, 1735, 1737, 1752, 1764, 1782, 1785, 1786, 1808], "tree_expansion_ord": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "tree_theta": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "trent": 106, "treutler": [968, 1214, 1231, 1528, 1532, 1534, 1631, 1633, 1704, 1757, 1838], "tri": 1838, "trial": [329, 342, 356, 823, 1210, 1704, 1743, 1788, 1841], "triangl": [100, 1759], "triangular": 1810, "tric": 1802, "trickier": 1817, "trigger": [2, 273, 383, 1738, 1743, 1788, 1802], "trimer": [1708, 1714, 1715, 1759, 1842], "trimethoxi": 1833, "trip": 1785, "tripl": [140, 284, 295, 318, 319, 451, 486, 605, 607, 662, 665, 1073, 1074, 1095, 1199, 1200, 1205, 1206, 1219, 1229, 1230, 1430, 1460, 1704, 1714, 1740, 1741, 1743, 1744, 1745, 1763, 1766, 1770, 1771, 1776, 1781, 1785, 1792, 1793, 1798, 1800, 1828, 1829, 1837, 1842], "triples_algorithm": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "triples_dii": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "triples_iabc_typ": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "triples_low_memori": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "triplet": [0, 1, 92, 100, 128, 277, 295, 314, 403, 494, 1197, 1200, 1224, 1231, 1239, 1658, 1669, 1680, 1704, 1714, 1727, 1755, 1766, 1776, 1785, 1791, 1828, 1829, 1837, 1838, 1841, 1842, 1844], "tripli": [697, 1206, 1704], "tritium": 1833, "triton": 1706, "triton_electron_mass_ratio": 1706, "triton_g_factor": 1706, "triton_mag_mom": 1706, "triton_mag_mom_to_bohr_magneton_ratio": 1706, "triton_mag_mom_to_nuclear_magneton_ratio": 1706, "triton_mass": 1706, "triton_mass_energy_equival": 1706, "triton_mass_energy_equivalent_in_mev": 1706, "triton_mass_in_u": 1706, "triton_molar_mass": 1706, "triton_proton_mass_ratio": 1706, "trivial": [1692, 1752, 1753, 1754, 1786, 1817], "trofimov": [0, 1734, 1781], "troublesom": [685, 1206, 1704, 1757], "trove": [1740, 1794], "truck": 1734, "true": [2, 8, 11, 13, 81, 89, 100, 103, 106, 119, 138, 148, 150, 265, 282, 283, 288, 289, 291, 295, 296, 297, 300, 301, 302, 303, 306, 307, 314, 317, 323, 332, 333, 339, 340, 341, 347, 365, 370, 374, 383, 386, 388, 389, 393, 395, 399, 418, 438, 451, 457, 461, 470, 480, 481, 486, 497, 515, 520, 526, 538, 554, 559, 561, 566, 596, 642, 675, 688, 691, 697, 698, 706, 713, 762, 795, 799, 809, 812, 821, 822, 823, 833, 836, 844, 849, 859, 860, 861, 862, 864, 865, 875, 884, 910, 919, 920, 921, 922, 945, 954, 991, 994, 1004, 1010, 1012, 1014, 1016, 1017, 1019, 1020, 1024, 1038, 1039, 1042, 1045, 1074, 1084, 1085, 1095, 1121, 1125, 1132, 1145, 1157, 1175, 1183, 1186, 1198, 1199, 1200, 1202, 1203, 1204, 1205, 1206, 1209, 1210, 1212, 1213, 1215, 1216, 1217, 1218, 1219, 1221, 1222, 1225, 1226, 1229, 1230, 1231, 1252, 1253, 1279, 1280, 1288, 1295, 1298, 1330, 1331, 1332, 1404, 1406, 1413, 1418, 1420, 1422, 1431, 1432, 1434, 1441, 1451, 1453, 1454, 1459, 1460, 1461, 1467, 1468, 1480, 1485, 1491, 1500, 1510, 1535, 1546, 1549, 1554, 1557, 1560, 1565, 1606, 1610, 1704, 1735, 1738, 1740, 1742, 1743, 1746, 1748, 1749, 1750, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1763, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1774, 1775, 1786, 1788, 1791, 1792, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1817, 1828, 1829, 1832, 1837, 1838, 1841, 1844], "true_atomic_numb": 106, "truhlar": [1692, 1730, 1733, 1734, 1740, 1752], "truli": [590, 1206, 1704, 1785], "trump": [8, 106, 1127, 1128, 1148, 1221, 1704, 1743, 1755, 1759, 1767], "truncat": [106, 882, 1083, 1084, 1210, 1219, 1230, 1460, 1462, 1704, 1730, 1742, 1755, 1763, 1767, 1768, 1771, 1781, 1828, 1837, 1844], "trust": [1226, 1344, 1345, 1704, 1802], "trv": [384, 386, 1772], "try": [277, 296, 318, 319, 827, 1210, 1704, 1738, 1750, 1756, 1757, 1769, 1785, 1786, 1788, 1800, 1802, 1823, 1828, 1838], "tschumper": 1734, "tt": [1013, 1018, 1216, 1704], "tu1": [1714, 1738, 1842, 1844], "tu2": [1714, 1842, 1844], "tu3": [1714, 1842, 1844], "tu4": [1714, 1842, 1844], "tu5": [1714, 1842], "tu6": [1714, 1842, 1844], "tune": [295, 1231, 1576, 1695, 1698, 1700, 1701, 1704, 1737, 1738, 1757, 1758, 1766, 1768, 1838], "tupl": [2, 26, 27, 64, 73, 75, 84, 89, 96, 100, 103, 106, 147, 148, 150, 295, 300, 301, 302, 318, 319, 331, 1714, 1740, 1759, 1760, 1766, 1768, 1772, 1774, 1794, 1797, 1800, 1842], "turbomol": [1226, 1324, 1704, 1802], "turn": [0, 1, 2, 106, 295, 359, 386, 468, 476, 561, 596, 599, 702, 823, 848, 882, 1022, 1024, 1095, 1200, 1204, 1206, 1210, 1216, 1217, 1219, 1230, 1231, 1441, 1480, 1485, 1500, 1508, 1520, 1704, 1738, 1742, 1748, 1757, 1766, 1770, 1771, 1772, 1776, 1782, 1785, 1789, 1802, 1808, 1828, 1837, 1838], "turn_on_actv": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "turnei": [1734, 1757, 1762, 1768, 1781, 1786, 1791, 1792, 1838], "tutori": [1749, 1770, 1777, 1781, 1824, 1832], "tuxfamili": 1738, "tw": [2, 285, 296, 336, 1769], "tweak": [0, 96, 138, 1737, 1757, 1770, 1787, 1837], "tweet": 1788, "twice": [0, 608, 1206, 1704, 1757, 1838], "two": [0, 2, 13, 20, 69, 84, 90, 94, 100, 112, 113, 115, 128, 143, 144, 148, 149, 150, 182, 284, 286, 291, 294, 295, 297, 309, 314, 327, 329, 337, 341, 345, 346, 347, 356, 360, 383, 416, 433, 466, 507, 514, 559, 574, 576, 589, 608, 609, 616, 627, 641, 660, 662, 666, 676, 693, 726, 727, 823, 826, 828, 843, 855, 858, 884, 888, 1167, 1182, 1198, 1199, 1200, 1201, 1202, 1204, 1206, 1208, 1210, 1221, 1222, 1225, 1230, 1242, 1459, 1461, 1690, 1704, 1708, 1713, 1714, 1734, 1735, 1738, 1740, 1742, 1750, 1752, 1753, 1754, 1756, 1757, 1759, 1763, 1764, 1766, 1770, 1771, 1774, 1775, 1776, 1781, 1782, 1783, 1785, 1786, 1788, 1789, 1791, 1792, 1795, 1797, 1798, 1799, 1801, 1802, 1803, 1806, 1809, 1817, 1821, 1823, 1824, 1828, 1829, 1832, 1833, 1835, 1836, 1837, 1838, 1842, 1844], "twobodyaoint": [69, 89, 144, 1817, 1827], "twocon": [1187, 1222, 1704, 1829], "twoel_hx": 84, "twoel_hx_ful": 128, "twoelectronint": 1827, "twopdm": 1708, "twostep": [726, 727, 746, 749, 750, 1208, 1704, 1753], "tx": [1750, 1836], "txt": [1738, 1764, 1783, 1785, 1788, 1804, 1808, 1823, 1839], "ty": [1750, 1757], "type": [0, 1, 2, 8, 11, 13, 14, 64, 68, 84, 92, 100, 106, 128, 130, 145, 147, 148, 150, 158, 176, 212, 255, 259, 262, 263, 265, 266, 267, 268, 270, 276, 282, 290, 292, 294, 298, 299, 300, 301, 302, 304, 305, 308, 309, 310, 311, 313, 318, 319, 321, 322, 324, 325, 328, 329, 330, 331, 332, 334, 335, 342, 343, 344, 345, 348, 349, 350, 351, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 380, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 395, 396, 397, 399, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1673, 1692, 1704, 1711, 1714, 1727, 1730, 1733, 1735, 1738, 1740, 1743, 1746, 1749, 1750, 1752, 1754, 1755, 1759, 1761, 1762, 1768, 1770, 1772, 1775, 1786, 1789, 1791, 1794, 1795, 1796, 1797, 1800, 1801, 1802, 1803, 1804, 1808, 1809, 1814, 1817, 1819, 1822, 1823, 1824, 1828, 1829, 1832, 1833, 1836, 1837, 1841, 1842, 1843, 1844], "typic": [0, 284, 1740, 1749, 1755, 1757, 1767, 1785, 1789, 1798, 1803, 1810, 1824, 1838], "tyrosin": 1802, "tz": [295, 318, 319, 1695, 1698, 1699, 1703, 1707, 1731, 1733, 1738, 1750, 1758, 1766, 1800], "tz2p": [1694, 1707, 1731, 1732, 1733], "tz2pf": [1694, 1707, 1731, 1732, 1733], "tzvp": [1694, 1707, 1730, 1731, 1732, 1733], "tzvpd": [1694, 1707, 1731, 1732, 1733], "tzvpp": [1694, 1707, 1714, 1731, 1732, 1733, 1842], "tzvppd": [1694, 1707, 1731, 1732, 1733], "u": [97, 106, 111, 386, 389, 390, 394, 979, 980, 982, 1214, 1230, 1470, 1679, 1689, 1692, 1704, 1706, 1734, 1738, 1743, 1748, 1752, 1757, 1764, 1772, 1776, 1781, 1785, 1786, 1797, 1798, 1828, 1833, 1836, 1837, 1838, 1841, 1844], "ubiquit": [1757, 1781], "ubuntu": [1737, 1738, 1746, 1748, 1749, 1762, 1773, 1775, 1781, 1782, 1784, 1803, 1806, 1807, 1808, 1839], "uff": [773, 1209, 1704, 1754, 1803], "ufh": [1714, 1842], "ugc": 1832, "ugur": 1798, "uhf": [0, 1, 2, 11, 286, 298, 300, 301, 302, 337, 348, 376, 381, 382, 397, 409, 448, 456, 475, 492, 562, 597, 601, 640, 662, 664, 672, 676, 681, 694, 748, 1154, 1187, 1197, 1199, 1200, 1204, 1206, 1208, 1212, 1221, 1222, 1564, 1599, 1614, 1662, 1674, 1682, 1704, 1708, 1710, 1711, 1714, 1724, 1739, 1742, 1743, 1749, 1753, 1754, 1756, 1757, 1768, 1771, 1772, 1776, 1781, 1798, 1803, 1809, 1826, 1827, 1828, 1832, 1833, 1837, 1838, 1842, 1844], "uhf_noon": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "uhfl": [1714, 1842], "uiuc": 1750, "uk": [1564, 1599, 1704, 1714, 1739, 1756, 1757, 1768, 1781, 1798, 1838, 1842], "uksfunct": 1827, "uli": 1810, "ultim": [1788, 1802, 1808], "ultrafin": [1231, 1636, 1704], "um": 1706, "umcn": [2, 287, 338, 1791], "umn": [1692, 1752], "ump2": 1756, "un": [386, 389, 1752, 1772], "unabl": [1743, 1759, 1774, 1782, 1792], "unaccept": [374, 395], "unaffect": [389, 1232, 1666, 1704, 1743, 1748, 1843], "unalt": [628, 1206, 1704], "unapp": [1828, 1844], "unavail": [652, 679, 1206, 1704, 1771, 1838], "unawar": 1804, "unbecom": 387, "uncertain": [355, 358], "uncertainti": 1706, "unchang": [370, 1226, 1318, 1319, 1320, 1321, 1322, 1704, 1743, 1759, 1760], "uncheck": 1788, "unclassifi": [386, 1772], "uncom": [2, 1788], "uncompil": 1738, "uncompress": [100, 148], "uncondition": [596, 1206, 1704], "uncontract": [590, 1206, 1704, 1714, 1836, 1842], "uncoupl": [75, 1837], "uncp": [1752, 1776], "undefin": [1692, 1736, 1752, 1767, 1787, 1788, 1808], "under": [2, 100, 111, 148, 283, 333, 390, 1737, 1738, 1770, 1771, 1781, 1785, 1788, 1795, 1802, 1806, 1833, 1838], "underbrac": 1838, "undergon": 1824, "underli": [2, 8, 1230, 1471, 1704, 1757, 1763, 1770, 1776, 1781, 1797, 1817, 1837], "underlin": 1809, "underneath": 1810, "underscor": [2, 96, 373, 376, 391, 397, 1730, 1764, 1785], "understand": [620, 681, 1206, 1704, 1739, 1770, 1803, 1817, 1828, 1844], "understood": 1754, "undertak": 1779, "undertaken": 1838, "undesir": 111, "undisplac": [1150, 1221, 1704, 1772], "undo": 1748, "unexpect": [2, 1738, 1782], "unfamiliar": 1844, "unfinish": [680, 1206, 1704], "unfit": 1708, "unfortun": [1753, 1757, 1810], "unfound": 1738, "unfrag": 1768, "unfreez": [1226, 1371, 1704], "unfreeze_dihedr": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "unfrozen": [1125, 1221, 1704, 1771, 1802, 1837], "unfulfil": 1802, "ungainli": [284, 1740, 1741], "uni": [106, 1759, 1774], "unif": [267, 1759], "unifi": [76, 1706, 1764, 1824], "unified_atomic_mass_unit": 1706, "uniform": [2, 1838], "uniformli": 1838, "unify_part2": 76, "unimport": 1771, "uniniti": [92, 1821], "uninstal": 1748, "unintend": 1821, "union": [2, 8, 64, 100, 106, 148, 150, 255, 263, 265, 267, 285, 287, 308, 322, 325, 331, 336, 338, 346, 350, 367, 370, 374, 377, 388, 395, 399, 1740, 1752, 1754, 1759, 1768, 1774, 1794, 1797], "uniq": [106, 1767], "uniqu": [98, 106, 115, 150, 352, 521, 523, 545, 547, 1202, 1203, 1704, 1743, 1756, 1759, 1776, 1794, 1810, 1817, 1828, 1833, 1837, 1838], "unit": [2, 70, 83, 86, 106, 139, 149, 288, 289, 339, 340, 368, 369, 374, 377, 386, 388, 390, 395, 399, 550, 650, 651, 705, 771, 781, 830, 861, 881, 994, 1098, 1203, 1206, 1209, 1210, 1215, 1220, 1226, 1228, 1231, 1349, 1351, 1364, 1365, 1383, 1586, 1704, 1706, 1734, 1742, 1743, 1746, 1749, 1754, 1755, 1757, 1767, 1768, 1770, 1772, 1775, 1776, 1782, 1799, 1802, 1803, 1821, 1828, 1829, 1832, 1833, 1837, 1838, 1841, 1844], "unitari": [994, 1010, 1215, 1704, 1734, 1746, 1781, 1798, 1838], "uniti": [635, 652, 1206, 1704, 1817], "unitless": 1776, "univ": [1692, 1752], "univers": [1694, 1706, 1707, 1731, 1732, 1734, 1757, 1791, 1794, 1832, 1837, 1839], "unix": 1781, "unknown": 1730, "unlabel": [284, 295, 300, 301, 302, 318, 319, 381, 382, 1730, 1740, 1743, 1752, 1766, 1772, 1800, 1826], "unless": [2, 8, 284, 295, 380, 457, 664, 676, 684, 685, 689, 691, 1199, 1206, 1226, 1324, 1692, 1704, 1730, 1738, 1740, 1742, 1743, 1752, 1755, 1756, 1764, 1766, 1767, 1768, 1776, 1785, 1786, 1801, 1802, 1804, 1808, 1832, 1838], "unlik": [0, 106, 367, 1759, 1810, 1817, 1833, 1838], "unmet": 1743, "unnam": 1799, "unnecessari": [106, 284, 1740, 1743, 1798, 1817], "unneed": 1738, "unnorm": [81, 122], "uno": 106, "uno_cutoff": 106, "unoccupi": [150, 314, 589, 671, 1102, 1128, 1145, 1165, 1206, 1221, 1704, 1750, 1755, 1771, 1789, 1791, 1810, 1829, 1838], "unoptim": 1738, "unorthogon": 115, "unpack": [1737, 1759, 1774, 1788], "unpair": [1828, 1833, 1844], "unperturb": [665, 1206, 1704], "unphys": [1770, 1789, 1798, 1802, 1838], "unpolar": 138, "unpredict": 1738, "unprovid": 1833, "unprun": 1757, "unpublish": [1692, 1752], "unreason": 1838, "unreconcil": 1743, "unrelax": [526, 600, 608, 665, 674, 1202, 1206, 1704, 1771], "unresolv": [1746, 1764], "unrestrict": [0, 2, 286, 298, 337, 348, 352, 676, 1206, 1229, 1231, 1429, 1564, 1704, 1714, 1739, 1742, 1753, 1756, 1757, 1771, 1781, 1798, 1799, 1828, 1838, 1842, 1844], "unscal": [148, 1230, 1470, 1704, 1776, 1832, 1837], "unset": [1231, 1654, 1704, 1738, 1767, 1841], "unsetenv": [1738, 1767], "unsign": [1810, 1821], "unsort": 1838, "unsound": 1837, "unspecifi": [106, 150, 346, 1711, 1714, 1774, 1809, 1842], "unsplit": [1036, 1218, 1704, 1770], "unstabl": [601, 1206, 1704, 1798, 1838], "unsupport": 1735, "untest": [271, 1774, 1822], "unthread": 1738, "until": [2, 247, 606, 645, 1206, 1226, 1231, 1341, 1498, 1663, 1704, 1752, 1753, 1757, 1781, 1788, 1802, 1838, 1841], "untouch": 2, "untweak": [267, 1759, 1776], "unus": [106, 1231, 1521, 1704, 1774], "unusu": [1756, 1844], "unvalid": 106, "unwant": [1746, 1762, 1765, 1773, 1775, 1782, 1783, 1784, 1839], "unzip": 1737, "uocc": 1810, "up": [0, 1, 2, 8, 84, 86, 92, 106, 111, 154, 155, 156, 157, 158, 226, 284, 323, 393, 433, 440, 466, 507, 514, 568, 699, 1124, 1126, 1199, 1200, 1201, 1202, 1206, 1221, 1224, 1225, 1230, 1231, 1235, 1242, 1435, 1436, 1460, 1483, 1490, 1555, 1704, 1714, 1723, 1735, 1736, 1737, 1740, 1742, 1743, 1748, 1754, 1755, 1757, 1759, 1762, 1764, 1767, 1768, 1770, 1771, 1776, 1777, 1782, 1783, 1786, 1788, 1794, 1798, 1799, 1801, 1802, 1804, 1806, 1809, 1810, 1814, 1817, 1818, 1823, 1828, 1832, 1837, 1838, 1842, 1844], "upcast": [1714, 1842], "upcom": [1786, 1788, 1801], "updat": [0, 1, 2, 84, 133, 143, 329, 457, 706, 726, 729, 744, 746, 747, 749, 759, 799, 845, 1001, 1199, 1206, 1208, 1215, 1229, 1231, 1328, 1329, 1330, 1331, 1332, 1333, 1405, 1419, 1499, 1704, 1711, 1714, 1715, 1724, 1730, 1733, 1734, 1735, 1737, 1739, 1740, 1742, 1743, 1746, 1747, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1828, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "update_dens": [143, 1817], "update_geometri": [106, 323, 1759, 1774, 1833], "update_orbit": 90, "upgrad": [2, 1771, 1817, 1828], "upgradehelp": 1827, "uphil": [603, 1206, 1704], "upload": 1788, "upon": [0, 2, 106, 188, 213, 295, 1226, 1367, 1704, 1738, 1742, 1743, 1755, 1759, 1766, 1771, 1773, 1783, 1784, 1786, 1788, 1796, 1802, 1831, 1832, 1835, 1838], "upper": [81, 100, 1226, 1344, 1704, 1801, 1802, 1838], "upper_bound": 1802, "uppercas": 1835, "upstream": [1, 106, 1737, 1738, 1746, 1749, 1754, 1759, 1762, 1765, 1773, 1775, 1782, 1783, 1784, 1785, 1786, 1788, 1803, 1839], "uremp": 1734, "urg": 1781, "url": 1788, "us": [0, 1, 2, 8, 11, 13, 14, 18, 62, 64, 83, 84, 87, 88, 92, 100, 103, 106, 110, 115, 128, 130, 132, 145, 148, 150, 153, 154, 155, 156, 157, 166, 192, 193, 195, 197, 199, 200, 203, 204, 205, 229, 235, 236, 243, 251, 265, 267, 271, 274, 279, 281, 284, 296, 297, 300, 301, 302, 303, 304, 312, 314, 318, 319, 322, 324, 325, 326, 327, 329, 331, 335, 342, 347, 350, 351, 352, 356, 366, 368, 369, 370, 375, 376, 377, 379, 389, 396, 397, 404, 407, 411, 414, 416, 427, 428, 430, 434, 438, 443, 446, 451, 457, 465, 467, 477, 479, 483, 484, 486, 488, 498, 510, 512, 513, 515, 519, 534, 535, 538, 543, 557, 561, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 580, 583, 584, 586, 590, 592, 593, 597, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 614, 615, 616, 617, 618, 619, 620, 622, 623, 624, 626, 627, 628, 632, 633, 634, 635, 636, 637, 638, 641, 643, 647, 648, 651, 652, 655, 656, 658, 660, 661, 664, 665, 666, 667, 669, 670, 672, 679, 681, 686, 688, 690, 691, 693, 694, 696, 697, 698, 702, 704, 705, 706, 707, 709, 711, 712, 726, 727, 732, 746, 750, 752, 757, 760, 762, 764, 765, 768, 770, 771, 775, 776, 778, 779, 780, 781, 786, 792, 801, 811, 812, 816, 819, 823, 827, 828, 830, 831, 833, 835, 837, 839, 860, 864, 865, 867, 870, 874, 875, 884, 886, 897, 906, 911, 912, 929, 930, 931, 935, 943, 946, 949, 956, 958, 961, 990, 993, 1000, 1004, 1055, 1061, 1070, 1076, 1083, 1084, 1085, 1088, 1095, 1096, 1099, 1100, 1101, 1102, 1105, 1106, 1107, 1120, 1125, 1126, 1129, 1132, 1146, 1147, 1150, 1154, 1157, 1166, 1167, 1170, 1173, 1175, 1179, 1180, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1206, 1208, 1209, 1210, 1211, 1212, 1213, 1215, 1218, 1219, 1220, 1221, 1222, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1235, 1238, 1240, 1244, 1266, 1281, 1290, 1299, 1300, 1304, 1314, 1333, 1337, 1339, 1352, 1356, 1371, 1376, 1392, 1398, 1411, 1428, 1429, 1430, 1431, 1432, 1435, 1436, 1441, 1456, 1458, 1459, 1461, 1470, 1471, 1475, 1481, 1485, 1500, 1501, 1510, 1520, 1546, 1549, 1555, 1556, 1557, 1564, 1568, 1570, 1572, 1575, 1588, 1589, 1609, 1610, 1611, 1613, 1615, 1619, 1623, 1637, 1643, 1655, 1656, 1672, 1681, 1688, 1704, 1708, 1711, 1714, 1723, 1725, 1726, 1727, 1730, 1736, 1737, 1740, 1742, 1743, 1746, 1747, 1750, 1752, 1753, 1755, 1756, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1804, 1805, 1806, 1807, 1809, 1812, 1813, 1814, 1818, 1819, 1823, 1829, 1832, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843], "usa": 1734, "usabl": 1843, "usag": [106, 195, 197, 283, 314, 333, 586, 664, 1097, 1206, 1220, 1704, 1748, 1750, 1754, 1767, 1775, 1790, 1791, 1832, 1837, 1838], "usapt": [1714, 1842], "use_batch": 1817, "use_df_int": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "use_dii": 1785, "use_libxc": 1757, "use_natur": 150, "use_shell_pair": [89, 1817], "use_spin_sym": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "use_spin_symmetri": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "useabl": 1738, "user": [0, 2, 8, 106, 208, 209, 210, 235, 236, 261, 267, 279, 281, 295, 304, 318, 319, 351, 359, 380, 457, 474, 644, 660, 823, 829, 881, 930, 949, 958, 964, 1065, 1097, 1124, 1125, 1199, 1200, 1206, 1210, 1213, 1214, 1219, 1220, 1221, 1224, 1225, 1226, 1229, 1231, 1232, 1235, 1266, 1290, 1312, 1521, 1666, 1688, 1704, 1714, 1726, 1736, 1737, 1738, 1740, 1742, 1748, 1750, 1751, 1753, 1755, 1759, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1774, 1775, 1777, 1780, 1781, 1782, 1785, 1786, 1788, 1790, 1791, 1794, 1795, 1798, 1799, 1800, 1801, 1803, 1808, 1809, 1810, 1815, 1816, 1817, 1821, 1823, 1824, 1827, 1828, 1829, 1831, 1832, 1833, 1834, 1836, 1837, 1838, 1840, 1842, 1843, 1844], "userprofil": 1748, "using_": 1785, "using_addon": 1785, "using_chemps2": 1785, "using_v2rdm_casscf": 1785, "uso": [1810, 1838], "usr": [1736, 1767, 1786, 1808, 1828], "usual": [0, 2, 84, 96, 284, 288, 289, 295, 300, 301, 302, 310, 318, 319, 329, 339, 340, 361, 367, 381, 382, 539, 575, 592, 599, 609, 616, 628, 658, 660, 662, 664, 726, 761, 774, 799, 835, 1203, 1206, 1208, 1209, 1210, 1231, 1620, 1704, 1730, 1735, 1738, 1740, 1742, 1743, 1752, 1753, 1754, 1755, 1757, 1760, 1766, 1772, 1776, 1785, 1786, 1794, 1796, 1798, 1800, 1801, 1802, 1806, 1808, 1810, 1817, 1823, 1826, 1828, 1829, 1832, 1833, 1835, 1837, 1838, 1843, 1844], "util": [2, 843, 1210, 1704, 1708, 1738, 1743, 1746, 1747, 1750, 1754, 1755, 1756, 1767, 1769, 1781, 1789, 1792, 1799, 1810, 1827, 1833, 1837, 1838], "utterli": 1783, "uus": 2, "v": [2, 76, 84, 100, 103, 147, 259, 295, 318, 319, 386, 1230, 1231, 1459, 1461, 1582, 1695, 1697, 1698, 1700, 1701, 1702, 1703, 1704, 1706, 1707, 1714, 1717, 1720, 1725, 1729, 1731, 1738, 1742, 1750, 1757, 1758, 1759, 1764, 1766, 1767, 1771, 1772, 1778, 1786, 1788, 1799, 1800, 1809, 1821, 1836, 1837, 1838, 1841, 1842], "v0": 1770, "v1": [96, 1017, 1018, 1019, 1020, 1147, 1216, 1221, 1230, 1231, 1445, 1548, 1704, 1736, 1737, 1738, 1740, 1748, 1757, 1759, 1770, 1774, 1783, 1786, 1787, 1798, 1814, 1828, 1837, 1838], "v182": 1788, "v2": 1783, "v2rdm1": 1729, "v2rdm2": 1729, "v2rdm3": 1729, "v2rdm4": 1729, "v2rdm5": 1729, "v2rdm6": 1729, "v2rdm7": 1729, "v2rdm_casscf": [400, 1738, 1748, 1777, 1780, 1785, 1842], "v_": [1757, 1771, 1836], "v_potenti": 84, "va": 84, "vacuum": 1706, "vagu": [329, 1804], "val": [61, 64, 88, 100, 138, 148, 150, 255, 277, 342, 356, 367, 1785], "val_ex_level": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "vale": 1722, "valeev": [1734, 1777, 1780, 1781, 1786], "valenc": [0, 295, 476, 625, 800, 1125, 1200, 1206, 1210, 1221, 1685, 1704, 1756, 1763, 1766, 1771, 1776, 1785, 1799, 1837], "valid": [2, 106, 114, 150, 219, 265, 267, 279, 284, 297, 314, 318, 319, 347, 377, 380, 715, 761, 774, 811, 874, 885, 1112, 1207, 1209, 1210, 1221, 1225, 1226, 1231, 1244, 1258, 1261, 1262, 1264, 1372, 1655, 1658, 1692, 1704, 1714, 1718, 1733, 1737, 1740, 1750, 1752, 1754, 1755, 1757, 1759, 1768, 1771, 1772, 1779, 1785, 1791, 1794, 1797, 1800, 1808, 1833, 1838, 1841, 1842, 1843, 1844], "valid_method": 111, "validate_dii": 84, "validate_opt": 114, "validationerror": [84, 150, 255, 297, 347, 374, 395, 1714, 1827, 1842], "valiron": 1794, "valu": [0, 1, 2, 5, 8, 62, 63, 64, 79, 82, 83, 84, 88, 96, 100, 103, 106, 110, 122, 126, 135, 138, 147, 148, 150, 195, 197, 200, 208, 209, 210, 235, 236, 244, 246, 248, 249, 254, 265, 267, 268, 272, 278, 285, 287, 295, 310, 316, 318, 319, 321, 322, 323, 325, 326, 327, 328, 335, 336, 338, 346, 359, 361, 370, 371, 374, 376, 377, 383, 389, 395, 397, 402, 403, 404, 407, 408, 409, 411, 415, 428, 430, 433, 434, 436, 437, 442, 443, 444, 445, 446, 449, 450, 454, 456, 465, 466, 467, 474, 475, 479, 482, 483, 484, 492, 496, 506, 507, 513, 514, 518, 519, 523, 539, 542, 543, 547, 551, 557, 568, 570, 571, 572, 573, 574, 575, 582, 584, 586, 589, 590, 592, 596, 599, 600, 606, 608, 609, 610, 613, 614, 615, 617, 619, 620, 622, 623, 624, 627, 632, 635, 636, 637, 638, 640, 641, 643, 644, 645, 647, 650, 652, 655, 656, 661, 662, 664, 665, 666, 667, 668, 669, 671, 673, 674, 676, 677, 681, 683, 684, 685, 689, 690, 691, 693, 696, 701, 702, 703, 704, 705, 707, 708, 709, 711, 712, 717, 719, 721, 725, 726, 727, 729, 730, 731, 732, 733, 736, 740, 746, 748, 750, 752, 758, 761, 764, 769, 773, 774, 787, 810, 811, 821, 830, 835, 837, 842, 843, 845, 851, 852, 858, 874, 880, 884, 889, 891, 892, 898, 899, 900, 905, 918, 923, 926, 927, 929, 930, 935, 936, 937, 938, 939, 944, 946, 947, 948, 949, 951, 958, 959, 960, 961, 963, 964, 965, 967, 968, 975, 989, 1000, 1001, 1011, 1013, 1015, 1018, 1047, 1048, 1049, 1053, 1070, 1075, 1076, 1088, 1096, 1098, 1101, 1106, 1107, 1110, 1119, 1120, 1125, 1129, 1131, 1146, 1147, 1153, 1158, 1163, 1166, 1167, 1168, 1187, 1195, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1234, 1240, 1241, 1242, 1248, 1249, 1256, 1266, 1279, 1281, 1282, 1284, 1290, 1291, 1292, 1293, 1296, 1297, 1313, 1324, 1329, 1331, 1332, 1338, 1339, 1341, 1342, 1346, 1352, 1354, 1357, 1358, 1359, 1360, 1366, 1368, 1375, 1376, 1383, 1384, 1394, 1398, 1399, 1402, 1403, 1405, 1417, 1429, 1437, 1438, 1443, 1445, 1446, 1453, 1454, 1455, 1469, 1470, 1472, 1475, 1479, 1484, 1485, 1487, 1497, 1499, 1500, 1501, 1502, 1505, 1507, 1509, 1518, 1520, 1521, 1522, 1523, 1525, 1527, 1528, 1534, 1537, 1555, 1556, 1563, 1569, 1589, 1599, 1601, 1609, 1615, 1616, 1617, 1620, 1621, 1626, 1628, 1629, 1630, 1631, 1633, 1634, 1644, 1649, 1658, 1664, 1665, 1667, 1695, 1698, 1699, 1703, 1704, 1706, 1713, 1714, 1715, 1724, 1726, 1730, 1733, 1738, 1739, 1740, 1742, 1743, 1746, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1762, 1766, 1767, 1768, 1770, 1771, 1772, 1774, 1775, 1776, 1777, 1781, 1785, 1788, 1789, 1792, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1808, 1809, 1810, 1817, 1823, 1828, 1829, 1833, 1835, 1836, 1837, 1838, 1841, 1842, 1843, 1844], "valuabl": 1785, "valuehi": 1740, "valuelo": 1740, "valuemd": 1740, "vamp": 1804, "van": [106, 1759, 1781, 1832, 1837], "var": 1788, "varepsilon": [377, 709, 711, 712, 1206, 1704], "vari": [267, 1753, 1757, 1759, 1776, 1828, 1838, 1844], "variabl": [0, 1, 2, 11, 106, 111, 150, 151, 152, 192, 193, 203, 204, 238, 239, 255, 268, 284, 295, 318, 319, 346, 352, 399, 635, 661, 1206, 1224, 1225, 1240, 1283, 1294, 1704, 1711, 1714, 1730, 1736, 1738, 1740, 1742, 1743, 1746, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1762, 1763, 1764, 1765, 1766, 1768, 1770, 1771, 1773, 1774, 1775, 1777, 1780, 1782, 1783, 1784, 1785, 1788, 1789, 1790, 1792, 1798, 1799, 1800, 1803, 1809, 1810, 1821, 1823, 1828, 1829, 1833, 1834, 1835, 1837, 1838, 1839, 1841, 1842, 1843, 1844], "variable_valu": 1823, "variables_": 1764, "variant": [0, 267, 295, 694, 1206, 1692, 1704, 1714, 1738, 1752, 1757, 1766, 1770, 1771, 1776, 1781, 1792, 1798, 1837, 1838, 1842], "variat": [2, 801, 1210, 1704, 1753, 1771, 1798, 1807, 1833, 1838], "variation": [739, 1208, 1704, 1753, 1755, 1763, 1789], "varieti": [2, 1711, 1714, 1737, 1743, 1757, 1767, 1781, 1840, 1842], "variou": [381, 382, 605, 669, 680, 1206, 1210, 1673, 1704, 1708, 1711, 1714, 1715, 1716, 1726, 1738, 1742, 1755, 1757, 1770, 1771, 1781, 1789, 1797, 1798, 1802, 1817, 1823, 1826, 1828, 1829, 1842, 1844], "varnam": 1764, "vast": 1808, "vaughn": 1829, "vb": 84, "vbase": [84, 1827], "vcc": [586, 1206, 1704, 1743], "vdot": [12, 1838], "vdw": [295, 1684, 1759, 1766, 1776, 1798], "vdz": [1714, 1842], "vdzp": [1694, 1707, 1731, 1732, 1774], "ve": [2, 1737, 1738, 1748, 1757, 1770, 1785, 1828, 1838, 1844], "vec": [1757, 1797, 1838], "vecs_cc3": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "vecs_per_root": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "vector": [0, 1, 2, 6, 9, 13, 16, 19, 22, 23, 24, 25, 31, 32, 34, 35, 37, 39, 43, 44, 45, 46, 47, 49, 50, 51, 54, 55, 56, 58, 60, 70, 73, 76, 80, 84, 85, 88, 100, 103, 104, 106, 110, 114, 115, 119, 128, 137, 138, 149, 150, 277, 321, 329, 331, 335, 342, 356, 404, 407, 410, 457, 470, 474, 491, 496, 500, 502, 504, 505, 575, 583, 594, 595, 607, 641, 644, 647, 679, 681, 734, 735, 736, 747, 751, 752, 757, 802, 803, 808, 811, 814, 815, 823, 829, 830, 835, 836, 837, 839, 842, 845, 847, 863, 867, 870, 874, 876, 881, 883, 884, 889, 911, 912, 931, 949, 1077, 1176, 1197, 1199, 1200, 1206, 1208, 1213, 1219, 1222, 1225, 1226, 1229, 1230, 1231, 1250, 1251, 1285, 1361, 1408, 1409, 1456, 1458, 1547, 1548, 1550, 1640, 1654, 1704, 1708, 1714, 1740, 1742, 1753, 1755, 1771, 1782, 1785, 1797, 1798, 1810, 1817, 1821, 1827, 1838, 1839, 1841, 1842], "vector3": [8, 106, 1827], "vector_axpi": 329, "vector_copi": 329, "vector_dot": [100, 148, 329], "vector_multipli": 12, "vector_scal": 329, "vel": [1668, 1669, 1690, 1776], "veloc": [402, 539, 677, 1197, 1203, 1206, 1231, 1657, 1704, 1706, 1742, 1776, 1841], "ventur": 1786, "ver": 1738, "verbos": [2, 106, 342, 346, 356, 376, 383, 397, 701, 1206, 1231, 1653, 1704, 1738, 1740, 1759, 1767, 1768, 1774, 1794, 1817, 1821, 1841], "verdet": [669, 1206, 1704], "vergil": [1748, 1788], "veri": [2, 342, 510, 575, 635, 641, 652, 833, 842, 882, 1153, 1201, 1206, 1210, 1221, 1231, 1629, 1704, 1714, 1738, 1742, 1748, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1763, 1764, 1767, 1770, 1771, 1781, 1788, 1797, 1798, 1804, 1817, 1824, 1828, 1832, 1833, 1835, 1837, 1838, 1841, 1842, 1844], "verifi": [1714, 1718, 1738, 1747, 1838, 1842], "verma": [1734, 1781, 1786, 1836], "versa": [1736, 1767], "versatil": 1781, "version": [96, 100, 138, 150, 192, 193, 203, 204, 206, 253, 279, 291, 295, 296, 303, 314, 341, 372, 375, 396, 701, 704, 706, 765, 906, 1206, 1209, 1212, 1704, 1714, 1715, 1730, 1733, 1735, 1736, 1737, 1743, 1748, 1750, 1754, 1755, 1757, 1759, 1762, 1764, 1766, 1767, 1769, 1771, 1775, 1777, 1781, 1785, 1787, 1788, 1791, 1792, 1798, 1802, 1804, 1808, 1809, 1810, 1817, 1819, 1824, 1828, 1829, 1836, 1837, 1842], "version_formatt": 1786, "versionlong": 1786, "verstraelen": [1734, 1799], "versu": 1757, "vert": [641, 708, 1206, 1704], "vert_": 1740, "vertic": [1714, 1803, 1842], "vi": [1736, 1767, 1786, 1788, 1814], "via": [0, 2, 76, 106, 267, 335, 577, 651, 655, 665, 677, 685, 1206, 1225, 1226, 1296, 1313, 1704, 1714, 1738, 1748, 1750, 1755, 1756, 1757, 1759, 1763, 1767, 1768, 1772, 1774, 1781, 1789, 1798, 1801, 1802, 1810, 1817, 1828, 1829, 1833, 1838, 1842, 1844], "vib": [2, 150, 383, 384, 385, 386, 387, 388, 389, 390, 1831, 1843], "vibinfo": [384, 386, 388, 389, 390, 399], "vibonli": 386, "vibrat": [2, 150, 300, 301, 302, 383, 384, 386, 388, 389, 390, 399, 574, 616, 619, 679, 701, 707, 1206, 1217, 1226, 1704, 1714, 1761, 1769, 1776, 1777, 1778, 1781, 1790, 1798, 1801, 1831, 1833, 1840, 1842], "vibrec": 399, "vibrot": [570, 573, 574, 1206, 1704], "vice": [1736, 1767], "video": 1770, "view": [12, 100, 148, 1735, 1764, 1770, 1771, 1780, 1782, 1788], "viewpoint": [0, 1804], "vim": 1786, "vimrc": 1738, "vint": 1817, "violat": 1798, "vir": [13, 98, 150, 1742, 1755, 1771, 1829], "virial": [1669, 1690, 1776], "virtual": [0, 11, 84, 95, 140, 150, 430, 433, 466, 507, 514, 589, 601, 626, 627, 664, 671, 727, 860, 1065, 1083, 1084, 1085, 1149, 1172, 1199, 1200, 1201, 1202, 1206, 1208, 1210, 1219, 1221, 1222, 1225, 1230, 1242, 1259, 1460, 1462, 1704, 1714, 1742, 1750, 1753, 1756, 1763, 1771, 1781, 1789, 1808, 1810, 1819, 1829, 1837, 1838, 1841, 1842], "virut": [875, 1210, 1704], "visibl": [1828, 1838, 1844], "visscher": 1734, "visual": [323, 1226, 1356, 1704, 1777, 1790, 1791, 1810, 1828, 1831, 1833, 1840, 1844], "vital": [2, 170, 1738], "viz": [1832, 1833], "vmd": [1777, 1831], "vmd_cube": 1750, "vmdpath": 1750, "vmfc": [1714, 1794, 1842], "vmfc_energy_body_dict": 1794, "vmfc_gradient_body_dict": 1794, "vmfc_hessian_body_dict": 1794, "vmol": [643, 1206, 1704], "vod": [1734, 1798], "void": 1810, "vol": [1225, 1256, 1271, 1704, 1734, 1781], "volt": 1706, "volum": [352, 376, 397, 1685, 1706, 1734, 1740, 1776, 1799], "volumetr": 2, "von": 1706, "von_klitzing_const": 1706, "voxel": 2, "vpt2": [570, 573, 574, 1206, 1704], "vsxc": [295, 318, 319, 1695, 1698, 1702, 1703, 1758, 1766, 1800], "vt": 1781, "vv": [411, 430, 513, 557, 727, 1198, 1199, 1202, 1204, 1208, 1704, 1738, 1753, 1801], "vv10": [138, 295, 318, 319, 1231, 1539, 1540, 1541, 1542, 1543, 1544, 1690, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1710, 1714, 1757, 1758, 1759, 1760, 1766, 1776, 1800, 1841, 1842], "vv10_b": 138, "vv10_c": 138, "vval": [111, 1799], "vvvv": [1225, 1296, 1704, 1798], "vw": 1837, "vwn": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "vwn5": [295, 318, 319, 1695, 1698, 1699, 1703, 1758, 1766, 1800], "w": [9, 103, 307, 356, 374, 386, 389, 395, 463, 503, 1199, 1200, 1704, 1706, 1707, 1714, 1731, 1734, 1748, 1757, 1759, 1772, 1781, 1782, 1788, 1794, 1798, 1815, 1836, 1837, 1842], "w_": 1798, "w_a": 1837, "w_b": 1837, "w_k": 329, "wa": [0, 18, 66, 81, 100, 148, 268, 277, 342, 356, 827, 1210, 1230, 1469, 1470, 1704, 1730, 1738, 1743, 1750, 1755, 1757, 1759, 1767, 1770, 1771, 1781, 1782, 1799, 1801, 1802, 1808, 1809, 1817, 1824, 1828, 1832, 1833, 1837, 1838, 1841, 1844], "waal": [106, 1759, 1781, 1832, 1837], "wabei": [510, 1201, 1704], "wabei_lowdisk": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "wai": [2, 247, 284, 568, 603, 616, 660, 672, 1124, 1206, 1221, 1232, 1666, 1704, 1714, 1730, 1735, 1738, 1740, 1743, 1747, 1752, 1753, 1755, 1757, 1767, 1770, 1777, 1781, 1782, 1786, 1795, 1797, 1798, 1799, 1801, 1802, 1803, 1810, 1817, 1819, 1822, 1828, 1832, 1833, 1836, 1837, 1838, 1842, 1843, 1844], "wait": [2, 1748, 1788], "waldrop": [1734, 1781, 1837], "wall": 1838, "wallac": 1836, "wang": [1734, 1753, 1781, 1786, 1802], "want": [0, 1, 2, 609, 1206, 1704, 1737, 1738, 1746, 1747, 1748, 1749, 1754, 1756, 1759, 1762, 1765, 1767, 1773, 1774, 1775, 1781, 1782, 1783, 1784, 1786, 1788, 1792, 1801, 1803, 1804, 1807, 1817, 1821, 1828, 1829, 1833, 1836, 1837, 1838, 1839, 1844], "warn": [0, 2, 150, 192, 193, 203, 204, 296, 314, 679, 833, 888, 1206, 1210, 1704, 1738, 1764, 1767, 1768, 1769, 1786, 1788, 1791, 1804, 1808, 1810, 1828], "washington": 1734, "watch": 1788, "water": [2, 574, 660, 1206, 1692, 1704, 1710, 1711, 1712, 1714, 1715, 1719, 1722, 1728, 1750, 1752, 1754, 1757, 1759, 1763, 1782, 1789, 1792, 1802, 1803, 1828, 1832, 1833, 1837, 1838, 1842, 1844], "water_dim": 1837, "wave": [352, 488, 586, 678, 1200, 1206, 1704, 1730, 1771, 1798, 1829, 1836], "wavefunct": [0, 1, 2, 11, 13, 14, 26, 61, 74, 76, 84, 104, 128, 130, 145, 161, 163, 164, 165, 166, 167, 173, 177, 178, 179, 180, 181, 185, 186, 190, 215, 216, 217, 218, 222, 232, 237, 265, 267, 270, 276, 277, 291, 295, 296, 297, 300, 301, 302, 303, 306, 307, 314, 317, 318, 319, 341, 347, 352, 365, 394, 399, 409, 421, 423, 455, 456, 464, 475, 492, 506, 508, 511, 529, 533, 552, 553, 556, 560, 563, 565, 567, 640, 681, 748, 863, 880, 891, 962, 993, 997, 1127, 1128, 1164, 1165, 1169, 1187, 1194, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1208, 1210, 1211, 1212, 1213, 1214, 1215, 1221, 1222, 1225, 1229, 1230, 1297, 1402, 1433, 1442, 1575, 1584, 1599, 1649, 1664, 1674, 1676, 1704, 1734, 1740, 1742, 1743, 1746, 1749, 1750, 1753, 1754, 1755, 1756, 1757, 1766, 1769, 1775, 1777, 1781, 1785, 1789, 1791, 1794, 1798, 1799, 1800, 1803, 1808, 1809, 1823, 1827, 1828, 1829, 1832, 1837, 1838, 1841, 1843, 1844], "wavefunctionprotocolenum": [265, 1740, 1794], "wavel": [1714, 1842], "wavelength": [324, 377, 1706, 1776], "wb": 1706, "wb88": 1757, "wb97": [295, 1695, 1698, 1701, 1714, 1757, 1758, 1766, 1842], "wb97m": [295, 1695, 1697, 1698, 1700, 1701, 1702, 1758, 1766], "wb97x": [295, 1695, 1697, 1698, 1700, 1701, 1710, 1714, 1739, 1757, 1758, 1759, 1766, 1774, 1781, 1842], "wb97x3c": [295, 1695, 1698, 1700, 1701, 1758, 1766], "wb97x_03": [1714, 1842], "wb97x_20": [1714, 1842], "wcm": [1734, 1781], "wcombin": [0, 1, 2, 92, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "wdin": [1734, 1776, 1781, 1799], "we": [2, 84, 247, 277, 324, 352, 356, 368, 369, 804, 948, 1210, 1213, 1225, 1231, 1248, 1554, 1555, 1647, 1655, 1704, 1730, 1738, 1740, 1743, 1747, 1753, 1755, 1756, 1757, 1761, 1764, 1767, 1770, 1771, 1781, 1782, 1785, 1786, 1788, 1789, 1795, 1797, 1798, 1801, 1802, 1809, 1810, 1813, 1817, 1821, 1822, 1823, 1824, 1825, 1828, 1829, 1832, 1833, 1837, 1838, 1841, 1844], "weak": [446, 484, 523, 547, 1199, 1200, 1202, 1203, 1704, 1706, 1757], "weak_mixing_angl": 1706, "weakli": [1692, 1752], "webbook": 1837, "webmo": [1768, 1791], "webserv": 1788, "websit": [1206, 1759, 1764, 1788], "weigend": [1734, 1838], "weight": [2, 92, 95, 140, 147, 307, 386, 389, 399, 618, 707, 738, 784, 1137, 1206, 1208, 1210, 1221, 1231, 1545, 1630, 1704, 1714, 1740, 1743, 1752, 1757, 1761, 1772, 1776, 1842], "weird": [1714, 1757, 1810, 1842], "welcom": [1777, 1785, 1818], "well": [0, 1, 84, 390, 575, 640, 662, 747, 835, 1206, 1208, 1210, 1704, 1714, 1738, 1743, 1748, 1752, 1754, 1756, 1759, 1764, 1770, 1771, 1781, 1785, 1798, 1799, 1802, 1805, 1817, 1828, 1833, 1837, 1838, 1842, 1844], "weller": 1734, "wennmoh": [1734, 1771], "were": [0, 150, 277, 314, 329, 342, 356, 1714, 1753, 1757, 1770, 1791, 1802, 1809, 1817, 1824, 1828, 1832, 1833, 1837, 1838, 1842, 1844], "werner": [443, 444, 479, 482, 519, 521, 543, 545, 1199, 1200, 1202, 1203, 1704], "wex": 1761, "wfn": [0, 1, 2, 11, 84, 145, 150, 267, 270, 276, 277, 284, 291, 295, 296, 297, 300, 301, 302, 303, 306, 307, 314, 317, 318, 319, 341, 347, 352, 365, 398, 399, 861, 1704, 1714, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "wfn_data": 150, "wfn_dict": 1767, "wfn_dimer": 1837, "wfn_from_dict": 1767, "wfn_from_fil": 1767, "wfn_lo": [284, 1740], "wfn_mona": 1837, "wfn_monb": 1837, "wfn_sym": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "wfn_type": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "what": [8, 277, 296, 329, 609, 616, 643, 656, 664, 672, 698, 708, 719, 732, 804, 893, 894, 1124, 1166, 1206, 1207, 1208, 1210, 1211, 1221, 1231, 1563, 1612, 1704, 1736, 1739, 1743, 1755, 1759, 1767, 1769, 1771, 1785, 1787, 1788, 1789, 1794, 1798, 1808, 1812, 1814, 1817, 1821, 1823, 1828, 1829, 1831, 1832, 1835, 1837, 1844], "whatev": [329, 1748, 1809, 1821], "whatsnew": 1828, "when": [2, 8, 100, 106, 148, 150, 170, 235, 236, 268, 269, 272, 277, 278, 283, 284, 295, 297, 300, 301, 302, 306, 307, 312, 318, 319, 328, 329, 333, 335, 342, 346, 347, 356, 357, 370, 374, 377, 393, 395, 470, 471, 570, 575, 577, 582, 586, 594, 623, 632, 635, 650, 651, 652, 661, 672, 682, 684, 691, 694, 808, 823, 837, 842, 884, 1001, 1041, 1079, 1086, 1125, 1132, 1158, 1167, 1200, 1206, 1210, 1215, 1218, 1219, 1221, 1224, 1226, 1231, 1240, 1303, 1339, 1341, 1500, 1507, 1555, 1556, 1575, 1648, 1655, 1656, 1704, 1726, 1730, 1736, 1740, 1743, 1750, 1753, 1754, 1755, 1759, 1762, 1763, 1764, 1766, 1767, 1768, 1770, 1772, 1774, 1776, 1777, 1779, 1780, 1782, 1785, 1786, 1788, 1792, 1794, 1797, 1800, 1801, 1802, 1808, 1809, 1810, 1817, 1821, 1824, 1828, 1832, 1833, 1836, 1837, 1838, 1840, 1841], "whenev": [935, 1198, 1201, 1202, 1213, 1223, 1704, 1743, 1748, 1782, 1809, 1837, 1838], "where": [0, 81, 100, 110, 148, 150, 279, 303, 308, 314, 318, 319, 329, 356, 371, 376, 380, 385, 397, 569, 574, 575, 582, 593, 621, 632, 635, 638, 645, 652, 660, 685, 708, 729, 811, 855, 861, 1047, 1100, 1181, 1206, 1208, 1210, 1217, 1218, 1220, 1222, 1229, 1405, 1704, 1711, 1714, 1730, 1735, 1738, 1742, 1743, 1746, 1748, 1749, 1750, 1753, 1755, 1756, 1757, 1759, 1761, 1762, 1763, 1764, 1765, 1767, 1768, 1770, 1771, 1773, 1774, 1775, 1776, 1777, 1779, 1781, 1782, 1783, 1784, 1785, 1786, 1789, 1791, 1795, 1796, 1797, 1798, 1800, 1802, 1803, 1804, 1809, 1810, 1815, 1817, 1818, 1824, 1828, 1829, 1833, 1835, 1837, 1838, 1839, 1841, 1842, 1844], "wherea": [318, 319, 1740, 1800, 1801, 1837, 1838], "wherein": [1756, 1794], "whereupon": 1738, "wherev": [1750, 1757, 1837], "whether": [1, 2, 8, 84, 106, 138, 150, 208, 209, 210, 212, 219, 220, 235, 236, 265, 267, 286, 288, 289, 298, 300, 301, 302, 314, 318, 319, 337, 339, 340, 348, 388, 389, 393, 470, 571, 573, 579, 596, 597, 598, 599, 600, 602, 605, 608, 610, 617, 625, 626, 636, 642, 658, 669, 674, 675, 678, 682, 683, 688, 691, 692, 695, 699, 701, 702, 703, 706, 707, 727, 731, 742, 745, 749, 758, 819, 989, 990, 991, 994, 996, 999, 1004, 1010, 1098, 1105, 1200, 1206, 1208, 1210, 1215, 1220, 1221, 1226, 1229, 1230, 1231, 1335, 1432, 1453, 1649, 1704, 1711, 1714, 1730, 1735, 1738, 1740, 1743, 1746, 1749, 1752, 1754, 1757, 1759, 1762, 1765, 1768, 1772, 1775, 1782, 1791, 1794, 1800, 1801, 1802, 1803, 1804, 1817, 1837, 1838, 1839, 1842], "which": [0, 2, 8, 13, 98, 100, 103, 106, 112, 148, 150, 241, 242, 266, 267, 268, 270, 276, 277, 279, 284, 285, 286, 287, 291, 296, 297, 299, 300, 301, 302, 303, 314, 317, 318, 319, 321, 327, 329, 330, 336, 337, 338, 341, 344, 347, 349, 355, 365, 374, 377, 381, 382, 383, 386, 387, 389, 395, 399, 415, 433, 434, 448, 466, 476, 490, 496, 507, 514, 539, 568, 570, 572, 574, 575, 580, 586, 589, 592, 601, 603, 608, 609, 614, 615, 616, 621, 627, 632, 634, 637, 639, 640, 650, 660, 662, 664, 665, 667, 669, 671, 679, 680, 681, 687, 692, 696, 697, 715, 729, 736, 740, 752, 761, 765, 774, 777, 794, 811, 816, 823, 832, 833, 835, 842, 874, 905, 964, 992, 1000, 1053, 1070, 1099, 1108, 1109, 1111, 1156, 1180, 1181, 1188, 1198, 1199, 1200, 1201, 1202, 1203, 1206, 1207, 1208, 1209, 1210, 1212, 1214, 1215, 1218, 1219, 1220, 1221, 1222, 1224, 1225, 1226, 1228, 1229, 1230, 1231, 1234, 1242, 1323, 1379, 1380, 1405, 1412, 1426, 1455, 1462, 1475, 1498, 1499, 1521, 1567, 1568, 1569, 1571, 1584, 1616, 1617, 1657, 1658, 1704, 1714, 1730, 1735, 1738, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1763, 1764, 1767, 1768, 1769, 1770, 1771, 1772, 1774, 1775, 1776, 1781, 1782, 1785, 1788, 1789, 1791, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1806, 1808, 1809, 1810, 1817, 1823, 1824, 1826, 1828, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1841, 1842, 1844], "whichev": [1759, 1774, 1788], "while": [2, 279, 300, 301, 302, 318, 319, 321, 433, 466, 507, 514, 575, 584, 589, 592, 596, 601, 615, 617, 623, 627, 640, 647, 655, 671, 673, 677, 679, 702, 704, 708, 738, 882, 1199, 1200, 1201, 1202, 1206, 1208, 1210, 1225, 1231, 1242, 1532, 1704, 1714, 1730, 1739, 1742, 1743, 1750, 1752, 1753, 1754, 1756, 1757, 1759, 1764, 1767, 1770, 1772, 1774, 1776, 1779, 1781, 1782, 1786, 1788, 1795, 1798, 1799, 1800, 1802, 1803, 1808, 1809, 1817, 1824, 1828, 1829, 1832, 1833, 1834, 1836, 1837, 1838, 1842, 1844], "white": [601, 609, 660, 1206, 1704, 1734, 1750], "whitespac": 1743, "who": [2, 1743, 1748, 1786, 1804, 1817], "whole": [2, 8, 1048, 1218, 1704, 1748, 1770, 1781, 1788, 1802, 1808], "wholli": 1838, "whose": [5, 1101, 1220, 1226, 1362, 1704, 1752, 1757, 1768, 1770, 1771, 1775, 1776, 1794, 1817, 1823, 1828, 1833, 1835, 1841, 1844], "why": [324, 1736, 1767, 1781, 1788, 1817], "wi7": [1692, 1752], "wiberg": [1685, 1776, 1799], "wiberg_lowdin_indic": [111, 1799], "wide": [1, 1730, 1738, 1747, 1757, 1781, 1838, 1844], "widehat": 1798, "widetild": 1798, "width": [106, 282, 313, 322, 323, 325, 332, 364, 377, 1685, 1750, 1776, 1799], "wien": 1706, "wien_frequency_displacement_law_const": 1706, "wien_wavelength_displacement_law_const": 1706, "wigner": [864, 1210, 1704, 1755], "wiki": [1817, 1821], "wikipedia": 1821, "wild": [2, 285, 296, 336, 901, 1212, 1704, 1769], "wilei": 1734, "wilk": 1781, "william": [1734, 1838], "willing": [1737, 1816], "wilson": 1740, "win": 1788, "wind": 1844, "window": [153, 1737, 1738, 1746, 1748, 1749, 1759, 1762, 1767, 1773, 1774, 1775, 1781, 1782, 1783, 1784, 1788, 1803, 1806, 1807, 1808, 1839], "windowswsl": 1788, "windu": 1734, "winnow": 2, "wipe": [86, 111], "wire": [1734, 1781, 1828, 1837, 1844], "wise": [2, 1738], "wish": [1748, 1770, 1771, 1781, 1786, 1789, 1829, 1844], "within": [2, 11, 90, 106, 299, 304, 349, 383, 419, 489, 527, 622, 662, 671, 695, 728, 761, 774, 832, 887, 1043, 1046, 1052, 1198, 1200, 1202, 1206, 1208, 1209, 1210, 1218, 1231, 1607, 1704, 1730, 1735, 1736, 1742, 1743, 1754, 1755, 1757, 1759, 1764, 1767, 1770, 1776, 1781, 1782, 1786, 1788, 1789, 1801, 1802, 1810, 1817, 1824, 1829, 1832, 1833, 1838], "without": [0, 1, 2, 76, 106, 150, 267, 307, 318, 319, 342, 344, 356, 374, 383, 395, 614, 616, 625, 664, 665, 674, 1206, 1231, 1554, 1692, 1704, 1714, 1736, 1742, 1743, 1746, 1748, 1749, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1762, 1765, 1767, 1769, 1771, 1772, 1773, 1775, 1776, 1781, 1782, 1783, 1784, 1785, 1787, 1790, 1794, 1798, 1800, 1802, 1803, 1809, 1810, 1814, 1828, 1838, 1839, 1842, 1844], "wizardri": 1737, "wk": [92, 1708], "wmr": [628, 1206, 1704], "woith": 1754, "wolf": [1777, 1780, 1836], "wolfsberg": 1838, "won": [279, 1070, 1088, 1219, 1704, 1748, 1759, 1764, 1767, 1771, 1786, 1788, 1808, 1821, 1835], "word": [284, 620, 651, 1206, 1704, 1730, 1740, 1741, 1785, 1798, 1838], "work": [0, 2, 8, 13, 106, 153, 284, 285, 314, 323, 336, 573, 605, 657, 666, 697, 786, 835, 881, 882, 1206, 1210, 1224, 1229, 1231, 1236, 1629, 1688, 1704, 1714, 1730, 1735, 1737, 1738, 1740, 1743, 1747, 1748, 1755, 1756, 1757, 1759, 1763, 1764, 1767, 1774, 1781, 1785, 1786, 1788, 1791, 1797, 1799, 1802, 1803, 1808, 1810, 1813, 1817, 1821, 1824, 1828, 1829, 1837, 1838, 1842, 1844], "workaround": 1837, "worker": [444, 482, 521, 545, 1199, 1200, 1202, 1203, 1704, 1829], "workflow": [1736, 1738, 1767, 1788, 1819, 1824], "workhors": 1757, "workhorsi": 1738, "working_branch": 1737, "workload": 1824, "workshop": 1804, "workstat": [575, 1206, 1704], "world": [1708, 1757, 1825], "wormit": 1734, "worri": [2, 1753, 1757, 1764, 1809], "wors": 1838, "worst": 106, "worth": [0, 1736, 1767], "worthwhil": [786, 1210, 1704, 1738], "would": [296, 376, 397, 601, 628, 660, 799, 855, 881, 1095, 1126, 1206, 1210, 1219, 1221, 1704, 1735, 1738, 1743, 1749, 1754, 1755, 1757, 1769, 1771, 1781, 1785, 1789, 1803, 1817, 1824, 1828, 1829, 1832, 1833, 1837, 1838, 1844], "wouter": [1215, 1677, 1777, 1780, 1781], "wouthuysen": [1734, 1836], "wow": 1810, "wp": [1734, 1841], "wpbe": [295, 1695, 1697, 1698, 1701, 1757, 1758, 1766], "wpbe0": [295, 1695, 1698, 1700, 1701, 1758, 1766], "wpbeh": [295, 1695, 1698, 1700, 1701, 1758, 1766], "wpbesol": 1757, "wrap": [106, 1743, 1759, 1796, 1810, 1832], "wrapper": [21, 84, 106, 1714, 1735, 1740, 1743, 1752, 1771, 1772, 1777, 1794, 1800, 1812, 1840, 1842], "wrapper_autofrag": 1768, "wrapper_databas": [1752, 1832], "writabl": [1738, 1748, 1767], "write": [12, 62, 74, 86, 87, 99, 100, 104, 148, 150, 187, 205, 295, 296, 314, 399, 424, 828, 867, 934, 1025, 1026, 1027, 1109, 1145, 1198, 1210, 1213, 1217, 1221, 1225, 1226, 1231, 1270, 1372, 1373, 1374, 1560, 1578, 1704, 1714, 1743, 1750, 1753, 1755, 1764, 1766, 1767, 1768, 1769, 1772, 1785, 1786, 1791, 1804, 1823, 1824, 1828, 1833, 1838, 1842, 1844], "write_molden": 150, "write_nbo": 150, "write_no": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "write_opt_histori": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "write_opt_result": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "write_orbit": [295, 1766, 1838], "write_scratch_fil": 87, "write_trajectori": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "writer": [296, 1769], "writer_file_label": [0, 1, 2, 303, 934, 1025, 1026, 1027, 1213, 1217, 1231, 1578, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "written": [0, 106, 208, 209, 210, 314, 586, 614, 639, 642, 643, 679, 828, 836, 1170, 1206, 1210, 1221, 1224, 1226, 1228, 1353, 1393, 1683, 1704, 1738, 1742, 1743, 1749, 1755, 1757, 1764, 1767, 1769, 1770, 1772, 1781, 1791, 1798, 1799, 1801, 1808, 1809, 1817, 1823, 1824, 1833, 1837], "wrong": [388, 1767, 1770, 1822, 1837, 1838], "wrt": 1752, "wsl": [1737, 1748], "wt": [1740, 1743, 1752], "wu": [1734, 1759], "www": [106, 388, 1737, 1738, 1743, 1750, 1759, 1774, 1781, 1788, 1792, 1839], "www3": [2, 287, 338, 1791], "x": [0, 5, 8, 9, 73, 84, 100, 106, 111, 133, 134, 138, 139, 147, 148, 150, 275, 295, 318, 319, 329, 335, 346, 356, 377, 386, 388, 389, 601, 685, 709, 1099, 1206, 1220, 1226, 1231, 1319, 1586, 1695, 1697, 1698, 1700, 1702, 1703, 1704, 1706, 1713, 1714, 1730, 1733, 1734, 1738, 1740, 1743, 1748, 1750, 1757, 1758, 1766, 1768, 1772, 1775, 1776, 1781, 1786, 1788, 1795, 1799, 1800, 1804, 1810, 1817, 1828, 1833, 1836, 1838, 1841, 1842, 1844], "x00": 1786, "x1": [94, 1799, 1821], "x1b95": [295, 318, 319, 1695, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "x2": [94, 536, 1203, 1704, 1799, 1821], "x2c": [677, 1103, 1163, 1206, 1221, 1704, 1714, 1730, 1762, 1781, 1836, 1842], "x2c1": [1714, 1842], "x2c1e": [677, 1206, 1704], "x2c2": [1714, 1842], "x2c3": [1714, 1842], "x3": [94, 1821], "x3lyp": [295, 318, 319, 1695, 1697, 1698, 1700, 1703, 1758, 1766, 1800], "x4": 94, "x5": [614, 1206, 1704], "x7f": 1786, "x86_64": [1738, 1748], "x_": [0, 329], "x_0": [322, 324, 325], "x_1": 1838, "x_2": 1838, "x_alpha": 138, "x_beta": 138, "x_d": 0, "x_function": [138, 1757], "x_hf": 1757, "x_hybrid": [1695, 1696, 1697, 1699, 1700, 1701, 1702, 1758], "x_lrc": [1695, 1696, 1697, 1699, 1700, 1701, 1702, 1758], "x_method_nam": 1757, "x_n": 1838, "x_omega": 138, "x_vec": 84, "xa": 0, "xarg": 1788, "xb1k": [295, 318, 319, 1695, 1698, 1700, 1702, 1703, 1758, 1766, 1800], "xc": [138, 295, 318, 319, 1230, 1468, 1690, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1714, 1757, 1758, 1759, 1766, 1776, 1784, 1800, 1837, 1842], "xc_build": 138, "xc_function": 1757, "xc_gga_x_lb": [1231, 1526, 1704], "xc_lda_c_vwn": [1231, 1524, 1704], "xc_method_nam": 1757, "xcfour": [570, 1206, 1704, 1743], "xclib_descript": [96, 138], "xcode": [1738, 1748, 1808], "xdist": [2, 1738, 1767], "xe": [1707, 1714, 1731, 1842], "xecc": [586, 699, 1206, 1704], "xfail": 1738, "xi": [0, 1, 2, 1704, 1708, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "xi_connect": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "xiao": 1753, "xie": [1230, 1469, 1704, 1734, 1781, 1837], "xjoda": [616, 643, 644, 1206, 1704], "xlyp": [295, 318, 319, 1695, 1697, 1698, 1699, 1703, 1758, 1766, 1800], "xn": [1734, 1799, 1841], "xnm": [1669, 1776], "xpass": 1738, "xsymcor": [616, 1206, 1704], "xtp0": [386, 1772], "xtpl": [295, 318, 319, 1714, 1740, 1766, 1800, 1842], "xtpl_highest_1": [284, 1740], "xtpl_type": 1740, "xvcc": [586, 641, 1206, 1704], "xvdint": [668, 1206, 1704], "xvee": [641, 1206, 1704], "xvmol": [660, 1206, 1704], "xvtran": [708, 1206, 1704], "xxx": [1714, 1730, 1842], "xy": [139, 1226, 1319, 1704, 1833], "xyz": [106, 134, 350, 1226, 1319, 1356, 1704, 1752, 1802, 1833, 1835], "xyz2int": [592, 1206, 1704], "xyzabc": 1782, "xyzint": [592, 1206, 1704], "xz": [139, 1733, 1833], "y": [8, 9, 73, 106, 111, 134, 139, 147, 150, 275, 329, 356, 377, 388, 601, 711, 1099, 1206, 1220, 1230, 1231, 1469, 1586, 1695, 1696, 1697, 1699, 1700, 1701, 1702, 1704, 1707, 1731, 1734, 1742, 1748, 1750, 1753, 1758, 1775, 1779, 1781, 1788, 1799, 1802, 1809, 1810, 1817, 1828, 1833, 1837, 1838, 1841, 1844], "y1": 1799, "y2": 1799, "yamaguchi": [1734, 1781], "yaml": [1738, 1747, 1764, 1788], "yang": [1734, 1759], "yapf": [1777, 1814, 1822], "ye": [0, 318, 319, 1738, 1748, 1795, 1796, 1800, 1804, 1808], "year": [2, 1757, 1787], "yellow": [1738, 1748, 1750], "yet": [284, 351, 370, 381, 382, 616, 1206, 1226, 1231, 1352, 1626, 1704, 1735, 1736, 1737, 1738, 1740, 1743, 1748, 1752, 1753, 1755, 1767, 1779, 1781, 1810, 1817, 1826, 1837, 1840], "yield": [539, 835, 1203, 1210, 1704, 1735, 1738, 1740, 1742, 1743, 1755, 1770, 1771, 1776, 1798, 1817, 1828, 1833, 1836, 1837, 1838], "yloxi": 1833, "yml": [1738, 1788], "ymp": [575, 1206, 1704], "yn": 1799, "york": [1734, 1781], "yoshimine_out_of_cor": [1231, 1620, 1704], "you": [0, 1, 2, 573, 586, 603, 664, 1124, 1126, 1206, 1221, 1704, 1735, 1737, 1738, 1743, 1746, 1747, 1748, 1749, 1754, 1756, 1757, 1759, 1762, 1764, 1765, 1767, 1770, 1771, 1773, 1774, 1775, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1792, 1801, 1802, 1803, 1807, 1808, 1809, 1810, 1821, 1828, 1829, 1832, 1835, 1836, 1837, 1838, 1839, 1843, 1844], "young": [1734, 1838], "your": [0, 2, 586, 620, 1206, 1704, 1735, 1737, 1738, 1743, 1748, 1749, 1750, 1754, 1756, 1759, 1764, 1767, 1774, 1777, 1782, 1785, 1786, 1788, 1792, 1803, 1808, 1809, 1814, 1816, 1818, 1828, 1835, 1838, 1844], "yourself": [1738, 1764, 1788, 1837], "yu": [1734, 1753, 1781, 1786], "yz": [139, 1833], "z": [2, 8, 9, 73, 94, 106, 111, 134, 139, 147, 150, 275, 284, 295, 318, 319, 323, 350, 388, 592, 594, 595, 637, 712, 873, 1099, 1206, 1210, 1220, 1231, 1586, 1694, 1704, 1711, 1714, 1724, 1730, 1732, 1733, 1734, 1740, 1741, 1743, 1750, 1755, 1757, 1766, 1768, 1775, 1776, 1779, 1781, 1786, 1788, 1799, 1800, 1802, 1817, 1828, 1832, 1833, 1837, 1838, 1841, 1842, 1844], "z1": 1799, "z2": 1799, "z_a": 1838, "z_i": 1776, "z_j": 1776, "z_kave": [835, 1210, 1704], "zach": 1763, "zapt": [295, 1714, 1739, 1766, 1776, 1781, 1842], "zapt2": [1739, 1781], "zapt25": 1755, "zapt4": [1714, 1842], "zaptn": [861, 891, 1210, 1673, 1704, 1714, 1755, 1776, 1842], "zero": [0, 2, 12, 64, 73, 88, 100, 106, 139, 148, 183, 184, 329, 443, 479, 519, 543, 569, 575, 593, 599, 609, 660, 707, 827, 881, 1199, 1200, 1202, 1203, 1206, 1210, 1224, 1229, 1238, 1426, 1434, 1691, 1704, 1743, 1752, 1756, 1759, 1775, 1776, 1794, 1810, 1821, 1828, 1833, 1838, 1843, 1844], "zero_ao_basis_set": 8, "zero_diagon": 100, "zero_ghost_frag": [106, 1768], "zero_internal_amp": [0, 1, 2, 1704, 1730, 1733, 1735, 1739, 1740, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "zero_low": 100, "zero_redund": 133, "zero_upp": 100, "zeroth": [1817, 1828, 1829, 1837, 1838, 1844], "zeta": [0, 1, 2, 284, 1704, 1707, 1730, 1731, 1733, 1735, 1738, 1739, 1740, 1741, 1742, 1743, 1746, 1747, 1748, 1749, 1750, 1752, 1753, 1754, 1755, 1756, 1757, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1788, 1789, 1791, 1792, 1794, 1795, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1813, 1815, 1816, 1817, 1820, 1821, 1822, 1823, 1825, 1826, 1827, 1829, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1843, 1844], "zhang": 1734, "zhao": [1692, 1752], "zhi": 1740, "zhou": 1734, "zip": [1737, 1781, 1788, 1802], "zlib": [1738, 1746, 1803], "zlo": 1740, "zlp": [295, 318, 319, 1695, 1698, 1702, 1703, 1758, 1766, 1800], "zmat": [592, 614, 1206, 1704, 1714, 1743, 1842], "zmatrix": [106, 1714, 1726, 1802, 1842], "zmd": 1740, "zn": [1707, 1731, 1799], "zno": [1714, 1842], "zoom": 323, "zpe": [707, 1206, 1704, 1752, 1843], "zpve": [1691, 1761, 1776, 1843], "zr": [1707, 1731], "zuchowski": [1692, 1734, 1752], "zwaan": 1781, "zzzzzzz": [1786, 1788], "\u00df": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u00e0": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u00e1": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u00e2": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u00e3": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u00e4": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u00e5": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u00e8": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u00e9": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u00ea": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u00eb": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u00ec": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u00ed": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u00ee": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u00ef": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u00f1": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u00f2": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u00f3": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u00f4": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u00f5": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u00f6": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u00f8": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u00f9": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u00fa": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u00fb": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u00fc": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u03c3": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550, 1551, 1552, 1553, 1554, 1555, 1556, 1557, 1558, 1559, 1560, 1561, 1562, 1563, 1564, 1565, 1566, 1567, 1568, 1569, 1570, 1571, 1572, 1573, 1574, 1575, 1576, 1577, 1578, 1579, 1580, 1581, 1582, 1583, 1584, 1585, 1586, 1587, 1588, 1589, 1590, 1591, 1592, 1593, 1594, 1595, 1596, 1597, 1598, 1599, 1600, 1601, 1602, 1603, 1604, 1605, 1606, 1607, 1608, 1609, 1610, 1611, 1612, 1613, 1614, 1615, 1616, 1617, 1618, 1619, 1620, 1621, 1622, 1623, 1624, 1625, 1626, 1627, 1628, 1629, 1630, 1631, 1632, 1633, 1634, 1635, 1636, 1637, 1638, 1639, 1640, 1641, 1642, 1643, 1644, 1645, 1646, 1647, 1648, 1649, 1650, 1651, 1652, 1653, 1654, 1655, 1656, 1657, 1658, 1659, 1660, 1661, 1662, 1663, 1664, 1665, 1666, 1667, 1668, 1669, 1670, 1671, 1672, 1673, 1674, 1675, 1676, 1677, 1678, 1679, 1680, 1681, 1682, 1683, 1684, 1685, 1686, 1687, 1688, 1689, 1690, 1691, 1692, 1693, 1694, 1695, 1696, 1697, 1698, 1699, 1700, 1701, 1702, 1703, 1704, 1705, 1706, 1707, 1708, 1709, 1710, 1711, 1712, 1713, 1714, 1715, 1716, 1717, 1718, 1719, 1720, 1721, 1722, 1723, 1724, 1725, 1726, 1727, 1728, 1729, 1730, 1731, 1732, 1733, 1734, 1735, 1736, 1737, 1738, 1739, 1740, 1741, 1742, 1743, 1744, 1745, 1746, 1747, 1748, 1749, 1750, 1751, 1752, 1753, 1754, 1755, 1756, 1757, 1758, 1759, 1760, 1761, 1762, 1763, 1764, 1765, 1766, 1767, 1768, 1769, 1770, 1771, 1772, 1773, 1774, 1775, 1776, 1777, 1778, 1779, 1780, 1781, 1782, 1783, 1784, 1785, 1786, 1787, 1788, 1789, 1790, 1791, 1792, 1793, 1794, 1795, 1796, 1797, 1798, 1799, 1800, 1801, 1802, 1803, 1804, 1805, 1806, 1807, 1808, 1809, 1810, 1811, 1812, 1813, 1814, 1815, 1816, 1817, 1818, 1819, 1820, 1821, 1822, 1823, 1824, 1825, 1826, 1827, 1829, 1830, 1831, 1832, 1833, 1834, 1835, 1836, 1837, 1838, 1839, 1840, 1841, 1842, 1843, 1844], "\u03c8": 13}, "titles": ["ADC: Ab Initio Polarization Propagator", "Interface to adcc by M. F. Herbst and M. Scheurer", "Test Suite", "AOShellCombinationsIterator", "AngularMomentumInt", "BSVec", "BasisExtents", "BasisFunctions", "BasisSet", "BlockOPoints", "BoysLocalizer", "CCWavefunction", "CIVector", "CIWavefunction", "CUHF", "CdSalc", "CdSalcList", "CharacterTable", "CompositeJK", "CorrelationFactor", "CorrelationTable", "CubeProperties", "DASUM", "DAXPY", "DCOPY", "DDOT", "DFEP2Wavefunction", "DFHelper", "DFSOMCSCF", "DFTGrid", "DFTensor", "DGBMV", "DGEEV", "DGEMM", "DGEMV", "DGER", "DGETRF", "DGETRI", "DGETRS", "DNRM2", "DPOTRF", "DPOTRI", "DPOTRS", "DROT", "DSBMV", "DSCAL", "DSWAP", "DSYEV", "DSYMM", "DSYMV", "DSYR", "DSYR2", "DSYR2K", "DSYRK", "DSYSV", "DTBMV", "DTBSV", "DTRMM", "DTRMV", "DTRSM", "DTRSV", "Deriv", "DerivCalcType", "DiagonalizeOrder", "Dimension", "DipoleInt", "DirectJK", "DiskSOMCSCF", "Dispersion", "ERI", "ESPPropCalc", "ElectricFieldInt", "ElectrostaticInt", "ExternalPotential", "FCHKWriter", "FDDS_Dispersion", "FISAPT", "FittedSlaterCorrelationFactor", "FittingMetric", "FragmentType", "Functional", "GaussianShell", "GaussianType", "GeometryUnits", "HF", "IDAMAX", "IO", "IOManager", "IntVector", "IntegralFactory", "IntegralTransform", "IrreducibleRepresentation", "JK", "KineticInt", "LS_THC_Computer", "LaplaceDenominator", "LibXCFunctional", "Localizer", "MOSpace", "MOWriter", "Matrix", "MatrixFactory", "MemDFJK", "MintsHelper", "MoldenWriter", "MolecularGrid", "Molecule", "MultipoleInt", "MultipoleSymmetry", "NablaInt", "NumIntHelper", "OEProp", "OneBodyAOInt", "OneBodySOInt", "Options", "OrbitalSpace", "OverlapInt", "PMLocalizer", "PetiteList", "PointFunctions", "PointGroup", "PotentialInt", "PrimitiveType", "Prop", "ProtoIntVector", "ProtoVector", "PsiReturnType", "QuadrupoleInt", "RHF", "RKSFunctions", "ROHF", "SADGuess", "SOBasisSet", "SOMCSCF", "SalcComponent", "SaveType", "ShellInfo", "Slice", "SuperFunctional", "SymmetryOperation", "TLaplaceDenominator", "ThreeCenterOverlapInt", "TracelessQuadrupoleInt", "TwoBodyAOInt", "TwoElectronInt", "UHF", "UKSFunctions", "VBase", "Vector", "Vector3", "Wavefunction", "array_variable", "array_variables", "be_quiet", "benchmark_blas1", "benchmark_blas2", "benchmark_blas3", "benchmark_disk", "benchmark_integrals", "benchmark_math", "ccdensity", "ccenergy", "cceom", "cchbar", "cclambda", "ccresponse", "cctransort", "cctriples", "clean", "clean_options", "clean_timers", "clean_variables", "close_outfile", "dct", "del_array_variable", "del_scalar_variable", "del_variable", "detci", "dfmp2", "dfocc", "dlpno", "dmrg", "doublet", "dpdbuf4", "dpdfile2", "dummy_einsums", "dummy_integratorxx", "fcidump_tei_helper", "finalize", "flush_outfile", "fnocc", "get_active_molecule", "get_array_variable", "get_array_variables", "get_datadir", "get_global_option", "get_global_option_list", "get_local_option", "get_memory", "get_num_threads", "get_option", "get_options", "get_output_file", "get_variable", "get_variables", "get_writer_file_prefix", "git_version", "has_array_variable", "has_global_option_changed", "has_local_option_changed", "has_option_changed", "has_scalar_variable", "has_variable", "initialize", "libint2_solid_harmonics_ordering", "mcscf", "mrcc_generate_input", "mrcc_load_densities", "occ", "option_exists_in_module", "options_to_python", "outfile_name", "plugin", "plugin_close", "plugin_close_all", "plugin_load", "prepare_options_for_module", "print_global_options", "print_options", "print_out", "print_variables", "psi_top_srcdir", "psimrcc", "psio_entry", "reopen_outfile", "revoke_global_option_changed", "revoke_local_option_changed", "sapt", "scalar_variable", "scalar_variables", "scatter", "scfgrad", "scfhess", "set_active_molecule", "set_array_variable", "set_datadir", "set_global_option", "set_global_option_python", "set_local_option", "set_local_option_python", "set_memory_bytes", "set_num_threads", "set_output_file", "set_psi_file_prefix", "set_scalar_variable", "set_variable", "test_matrix_dpd_interface", "timer_off", "timer_on", "triplet", "tstart", "tstop", "variable", "variables", "version", "AtomicComputer", "ConvergenceError", "EmpiricalDispersion", "ManagedMethodError", "MissingMethodError", "OptimizationConvergenceError", "ParsingError", "PastureRequiredError", "PsiException", "QMMM", "QMMMbohr", "SCFConvergenceError", "TDSCFConvergenceError", "TestComparisonError", "UpgradeHelper", "ValidationError", "activate", "banner", "basis_helper", "cbs", "compare_fchkfiles", "compare_fcidumps", "compare_moldenfiles", "copy_file_from_scratch", "copy_file_to_scratch", "create_plugin", "cubeprop", "docs_table_link", "dynamic_variable_bind", "energies_from_fcidump", "energy", "fchk", "fcidump", "fcidump_from_file", "find_approximate_string_matches", "freq", "frequencies", "frequency", "gdma", "geometry", "get_memory", "gradient", "hessian", "ipi_broker", "levenshtein", "libint2_configuration", "libint2_print_out", "mdi_run", "message_box", "molden", "molecule_get_attr", "molecule_set_attr", "oeprop", "opt", "optimize", "optimize_geometric", "DIIS", "Gaussian", "InPsight", "Lineshape", "Lorentzian", "OptionState", "OptionsState", "OptionsStateCM", "SolverEngine", "all_casings", "array_to_matrix", "banner", "basis_helper", "block_diagonal_array", "cg_solver", "compare_fchkfiles", "compare_fcidumps", "compare_moldenfiles", "copy_file_from_scratch", "copy_file_to_scratch", "cubeprop", "davidson_solver", "docs_table_link", "drop_duplicates", "energies_from_fcidump", "expand_psivars", "fcidump", "fcidump_from_file", "find_approximate_string_matches", "format_molecule_for_input", "format_options_for_input", "free_atom_volumes", "get_memory", "get_psifile", "getattr_ignorecase", "hamiltonian_solver", "hold_options_state", "import_ignorecase", "kwargs_lower", "levenshtein", "libint2_configuration", "libint2_print_out", "mat2arr", "message_box", "oeprop", "pcm_helper", "plump_qcvar", "prefactor_ecd", "prefactor_opa", "prepare_options_for_modules", "prepare_options_for_set_options", "provenance_stamp", "sanitize_method", "set_memory", "set_module_options", "set_options", "spectrum", "state_to_atomicinput", "pcm_helper", "process_input", "prop", "properties", "compare_vibinfos", "filter_nonvib", "filter_omega_to_real", "harmonic_analysis", "hessian_symmetrize", "print_molden_vibs", "print_vibs", "thermo", "sanitize_method", "sanitize_name", "scf_helper", "scf_wavefunction_factory", "set_memory", "set_module_options", "set_options", "tdscf", "vibanal_wfn", "Appendices", "<span class=\"xref std std-term\">CUTOFF_AMPS_PRINT</span>", "<span class=\"xref std std-term\">GAUGE</span>", "<span class=\"xref std std-term\">KIND</span>", "<span class=\"xref std std-term\">MAX_NUM_VECS</span>", "<span class=\"xref std std-term\">MAXITER</span>", "<span class=\"xref std std-term\">NUM_CORE_ORBITALS</span>", "<span class=\"xref std std-term\">NUM_GUESSES</span>", "<span class=\"xref std std-term\">R_CONVERGENCE</span>", "<span class=\"xref std std-term\">REFERENCE</span>", "<span class=\"xref std std-term\">ROOTS_PER_IRREP</span>", "<span class=\"xref std std-term\">AO_BASIS</span>", "<span class=\"xref std std-term\">CACHELEVEL</span>", "<span class=\"xref std std-term\">DEBUG</span>", "<span class=\"xref std std-term\">GAUGE</span>", "<span class=\"xref std std-term\">INTS_TOLERANCE</span>", "<span class=\"xref std std-term\">OPDM_ONLY</span>", "<span class=\"xref std std-term\">OPDM_RELAX</span>", "<span class=\"xref std std-term\">PROP_ALL</span>", "<span class=\"xref std std-term\">PROP_ROOT</span>", "<span class=\"xref std std-term\">PROP_SYM</span>", "<span class=\"xref std std-term\">REFERENCE</span>", "<span class=\"xref std std-term\">ROOTS_PER_IRREP</span>", "<span class=\"xref std std-term\">WFN</span>", "<span class=\"xref std std-term\">WRITE_NOS</span>", "<span class=\"xref std std-term\">XI</span>", "<span class=\"xref std std-term\">XI_CONNECT</span>", "<span class=\"xref std std-term\">ZETA</span>", "<span class=\"xref std std-term\">ABCD</span>", "<span class=\"xref std std-term\">ANALYZE</span>", "<span class=\"xref std std-term\">AO_BASIS</span>", "<span class=\"xref std std-term\">BCCD_MAXITER</span>", "<span class=\"xref std std-term\">BRUECKNER_ORBS_R_CONVERGENCE</span>", "<span class=\"xref std std-term\">CACHELEVEL</span>", "<span class=\"xref std std-term\">CACHETYPE</span>", "<span class=\"xref std std-term\">CC_NUM_THREADS</span>", "<span class=\"xref std std-term\">CC_OS_SCALE</span>", "<span class=\"xref std std-term\">CC_SS_SCALE</span>", "<span class=\"xref std std-term\">DIIS</span>", "<span class=\"xref std std-term\">E_CONVERGENCE</span>", "<span class=\"xref std std-term\">FORCE_RESTART</span>", "<span class=\"xref std std-term\">LOCAL</span>", "<span class=\"xref std std-term\">LOCAL_CPHF_CUTOFF</span>", "<span class=\"xref std std-term\">LOCAL_CUTOFF</span>", "<span class=\"xref std std-term\">LOCAL_METHOD</span>", "<span class=\"xref std std-term\">LOCAL_PAIRDEF</span>", "<span class=\"xref std std-term\">LOCAL_WEAKP</span>", "<span class=\"xref std std-term\">MAXITER</span>", "<span class=\"xref std std-term\">MP2_AMPS_PRINT</span>", "<span class=\"xref std std-term\">MP2_OS_SCALE</span>", "<span class=\"xref std std-term\">MP2_SS_SCALE</span>", "<span class=\"xref std std-term\">NEW_TRIPLES</span>", "<span class=\"xref std std-term\">NUM_AMPS_PRINT</span>", "<span class=\"xref std std-term\">PAIR_ENERGIES_PRINT</span>", "<span class=\"xref std std-term\">PROPERTY</span>", "<span class=\"xref std std-term\">R_CONVERGENCE</span>", "<span class=\"xref std std-term\">REFERENCE</span>", "<span class=\"xref std std-term\">RESTART</span>", "<span class=\"xref std std-term\">SCS_CCSD</span>", "<span class=\"xref std std-term\">SCS_MP2</span>", "<span class=\"xref std std-term\">SCSN_MP2</span>", "<span class=\"xref std std-term\">SEMICANONICAL</span>", "<span class=\"xref std std-term\">T2_COUPLED</span>", "<span class=\"xref std std-term\">T3_WS_INCORE</span>", "<span class=\"xref std std-term\">WFN</span>", "<span class=\"xref std std-term\">ABCD</span>", "<span class=\"xref std std-term\">CACHELEVEL</span>", "<span class=\"xref std std-term\">CACHETYPE</span>", "<span class=\"xref std std-term\">CC3_FOLLOW_ROOT</span>", "<span class=\"xref std std-term\">CC_NUM_THREADS</span>", "<span class=\"xref std std-term\">COLLAPSE_WITH_LAST</span>", "<span class=\"xref std std-term\">COLLAPSE_WITH_LAST_CC3</span>", "<span class=\"xref std std-term\">COMPLEX_TOLERANCE</span>", "<span class=\"xref std std-term\">E_CONVERGENCE</span>", "<span class=\"xref std std-term\">EOM_GUESS</span>", "<span class=\"xref std std-term\">EOM_REFERENCE</span>", "<span class=\"xref std std-term\">EXCITATION_RANGE</span>", "<span class=\"xref std std-term\">FULL_MATRIX</span>", "<span class=\"xref std std-term\">LOCAL</span>", "<span class=\"xref std std-term\">LOCAL_CUTOFF</span>", "<span class=\"xref std std-term\">LOCAL_DO_SINGLES</span>", "<span class=\"xref std std-term\">LOCAL_FILTER_SINGLES</span>", "<span class=\"xref std std-term\">LOCAL_METHOD</span>", "<span class=\"xref std std-term\">LOCAL_PRECONDITIONER</span>", "<span class=\"xref std std-term\">LOCAL_WEAKP</span>", "<span class=\"xref std std-term\">MAXITER</span>", "<span class=\"xref std std-term\">NEW_TRIPLES</span>", "<span class=\"xref std std-term\">NUM_AMPS_PRINT</span>", "<span class=\"xref std std-term\">OVERLAP_CHECK</span>", "<span class=\"xref std std-term\">PROP_ROOT</span>", "<span class=\"xref std std-term\">PROP_SYM</span>", "<span class=\"xref std std-term\">R_CONVERGENCE</span>", "<span class=\"xref std std-term\">REFERENCE</span>", "<span class=\"xref std std-term\">RESTART_EOM_CC3</span>", "<span class=\"xref std std-term\">RHF_TRIPLETS</span>", "<span class=\"xref std std-term\">ROOTS_PER_IRREP</span>", "<span class=\"xref std std-term\">SCHMIDT_ADD_RESIDUAL_TOLERANCE</span>", "<span class=\"xref std std-term\">SEMICANONICAL</span>", "<span class=\"xref std std-term\">SINGLES_PRINT</span>", "<span class=\"xref std std-term\">SS_E_CONVERGENCE</span>", "<span class=\"xref std std-term\">SS_R_CONVERGENCE</span>", "<span class=\"xref std std-term\">SS_SKIP_DIAG</span>", "<span class=\"xref std std-term\">SS_VECS_PER_ROOT</span>", "<span class=\"xref std std-term\">T3_WS_INCORE</span>", "<span class=\"xref std std-term\">VECS_CC3</span>", "<span class=\"xref std std-term\">VECS_PER_ROOT</span>", "<span class=\"xref std std-term\">WFN</span>", "<span class=\"xref std std-term\">CACHELEVEL</span>", "<span class=\"xref std std-term\">EOM_REFERENCE</span>", "<span class=\"xref std std-term\">T_AMPS</span>", "<span class=\"xref std std-term\">WABEI_LOWDISK</span>", "<span class=\"xref std std-term\">WFN</span>", "<span class=\"xref std std-term\">ABCD</span>", "<span class=\"xref std std-term\">AO_BASIS</span>", "<span class=\"xref std std-term\">CACHELEVEL</span>", "<span class=\"xref std std-term\">DIIS</span>", "<span class=\"xref std std-term\">JOBTYPE</span>", "<span class=\"xref std std-term\">LOCAL</span>", "<span class=\"xref std std-term\">LOCAL_CPHF_CUTOFF</span>", "<span class=\"xref std std-term\">LOCAL_CUTOFF</span>", "<span class=\"xref std std-term\">LOCAL_FILTER_SINGLES</span>", "<span class=\"xref std std-term\">LOCAL_METHOD</span>", "<span class=\"xref std std-term\">LOCAL_PAIRDEF</span>", "<span class=\"xref std std-term\">LOCAL_WEAKP</span>", "<span class=\"xref std std-term\">MAXITER</span>", "<span class=\"xref std std-term\">NUM_AMPS_PRINT</span>", "<span class=\"xref std std-term\">PROP_ALL</span>", "<span class=\"xref std std-term\">PROP_ROOT</span>", "<span class=\"xref std std-term\">PROP_SYM</span>", "<span class=\"xref std std-term\">R_CONVERGENCE</span>", "<span class=\"xref std std-term\">RESTART</span>", "<span class=\"xref std std-term\">ROOTS_PER_IRREP</span>", "<span class=\"xref std std-term\">SEKINO</span>", "<span class=\"xref std std-term\">WFN</span>", "<span class=\"xref std std-term\">ZETA</span>", "<span class=\"xref std std-term\">ABCD</span>", "<span class=\"xref std std-term\">ANALYZE</span>", "<span class=\"xref std std-term\">CACHELEVEL</span>", "<span class=\"xref std std-term\">DIIS</span>", "<span class=\"xref std std-term\">GAUGE</span>", "<span class=\"xref std std-term\">LINEAR</span>", "<span class=\"xref std std-term\">LOCAL</span>", "<span class=\"xref std std-term\">LOCAL_CPHF_CUTOFF</span>", "<span class=\"xref std std-term\">LOCAL_CUTOFF</span>", "<span class=\"xref std std-term\">LOCAL_FILTER_SINGLES</span>", "<span class=\"xref std std-term\">LOCAL_METHOD</span>", "<span class=\"xref std std-term\">LOCAL_PAIRDEF</span>", "<span class=\"xref std std-term\">LOCAL_WEAKP</span>", "<span class=\"xref std std-term\">MAXITER</span>", "<span class=\"xref std std-term\">NUM_AMPS_PRINT</span>", "<span class=\"xref std std-term\">OMEGA</span>", "<span class=\"xref std std-term\">PROPERTY</span>", "<span class=\"xref std std-term\">R_CONVERGENCE</span>", "<span class=\"xref std std-term\">REFERENCE</span>", "<span class=\"xref std std-term\">RESTART</span>", "<span class=\"xref std std-term\">SEKINO</span>", "<span class=\"xref std std-term\">WFN</span>", "<span class=\"xref std std-term\">AO_BASIS</span>", "<span class=\"xref std std-term\">CACHELEVEL</span>", "<span class=\"xref std std-term\">DELETE_TEI</span>", "<span class=\"xref std std-term\">REFERENCE</span>", "<span class=\"xref std std-term\">RUN_CCTRANSORT</span>", "<span class=\"xref std std-term\">SEMICANONICAL</span>", "<span class=\"xref std std-term\">WFN</span>", "<span class=\"xref std std-term\">CC_NUM_THREADS</span>", "<span class=\"xref std std-term\">REFERENCE</span>", "<span class=\"xref std std-term\">SEMICANONICAL</span>", "<span class=\"xref std std-term\">WFN</span>", "<span class=\"xref std std-term\">CFOUR_ABCDTYPE</span>", "<span class=\"xref std std-term\">CFOUR_ACTIVE_ORBI</span>", "<span class=\"xref std std-term\">CFOUR_ANH_ALGORITHM</span>", "<span class=\"xref std std-term\">CFOUR_ANH_DERIVATIVES</span>", "<span class=\"xref std std-term\">CFOUR_ANH_STEPSIZE</span>", "<span class=\"xref std std-term\">CFOUR_ANH_SYMMETRY</span>", "<span class=\"xref std std-term\">CFOUR_ANHARMONIC</span>", "<span class=\"xref std std-term\">CFOUR_AO_LADDERS</span>", "<span class=\"xref std std-term\">CFOUR_AV_SCF</span>", "<span class=\"xref std std-term\">CFOUR_BASIS</span>", "<span class=\"xref std std-term\">CFOUR_BRUCK_CONV</span>", "<span class=\"xref std std-term\">CFOUR_BRUECKNER</span>", "<span class=\"xref std std-term\">CFOUR_CACHE_RECS</span>", "<span class=\"xref std std-term\">CFOUR_CALC_LEVEL</span>", "<span class=\"xref std std-term\">CFOUR_CC_CONV</span>", "<span class=\"xref std std-term\">CFOUR_CC_EXPORDER</span>", "<span class=\"xref std std-term\">CFOUR_CC_EXTRAPOLATION</span>", "<span class=\"xref std std-term\">CFOUR_CC_MAXCYC</span>", "<span class=\"xref std std-term\">CFOUR_CC_PROGRAM</span>", "<span class=\"xref std std-term\">CFOUR_CHARGE</span>", "<span class=\"xref std std-term\">CFOUR_CIS_CONV</span>", "<span class=\"xref std std-term\">CFOUR_CONTINUUM</span>", "<span class=\"xref std std-term\">CFOUR_CONTRACTION</span>", "<span class=\"xref std std-term\">CFOUR_CONVERGENCE</span>", "<span class=\"xref std std-term\">CFOUR_COORDINATES</span>", "<span class=\"xref std std-term\">CFOUR_CORE_ORBITALS</span>", "<span class=\"xref std std-term\">CFOUR_CPHF_CONVER</span>", "<span class=\"xref std std-term\">CFOUR_CPHF_MAXCYC</span>", "<span class=\"xref std std-term\">CFOUR_CURVILINEAR</span>", "<span class=\"xref std std-term\">CFOUR_DBOC</span>", "<span class=\"xref std std-term\">CFOUR_DCT</span>", "<span class=\"xref std std-term\">CFOUR_DERIV_LEVEL</span>", "<span class=\"xref std std-term\">CFOUR_DIFF_TYPE</span>", "<span class=\"xref std std-term\">CFOUR_DROPMO</span>", "<span class=\"xref std std-term\">CFOUR_ECP</span>", "<span class=\"xref std std-term\">CFOUR_EIGENVECTOR</span>", "<span class=\"xref std std-term\">CFOUR_EL_ANHARM</span>", "<span class=\"xref std std-term\">CFOUR_EOM_NONIT</span>", "<span class=\"xref std std-term\">CFOUR_ESTATE_CONV</span>", "<span class=\"xref std std-term\">CFOUR_ESTATE_MAXCYC</span>", "<span class=\"xref std std-term\">CFOUR_ESTATE_PROP</span>", "<span class=\"xref std std-term\">CFOUR_ESTATE_SYM</span>", "<span class=\"xref std std-term\">CFOUR_ESTATE_TRANS</span>", "<span class=\"xref std std-term\">CFOUR_EVAL_HESS</span>", "<span class=\"xref std std-term\">CFOUR_EXCITATION</span>", "<span class=\"xref std std-term\">CFOUR_EXCITE</span>", "<span class=\"xref std std-term\">CFOUR_FC_FIELD</span>", "<span class=\"xref std std-term\">CFOUR_FD_CALCTYPE</span>", "<span class=\"xref std std-term\">CFOUR_FD_IRREPS</span>", "<span class=\"xref std std-term\">CFOUR_FD_PROJECT</span>", "<span class=\"xref std std-term\">CFOUR_FD_STEPSIZE</span>", "<span class=\"xref std std-term\">CFOUR_FD_USEGROUP</span>", "<span class=\"xref std std-term\">CFOUR_FILE_RECSIZ</span>", "<span class=\"xref std std-term\">CFOUR_FILE_STRIPE</span>", "<span class=\"xref std std-term\">CFOUR_FINITE_PERTURBATION</span>", "<span class=\"xref std std-term\">CFOUR_FOCK</span>", "<span class=\"xref std std-term\">CFOUR_FREQ_ALGORITHM</span>", "<span class=\"xref std std-term\">CFOUR_FROZEN_CORE</span>", "<span class=\"xref std std-term\">CFOUR_FROZEN_VIRT</span>", "<span class=\"xref std std-term\">CFOUR_GAMMA_ABCD</span>", "<span class=\"xref std std-term\">CFOUR_GENBAS_1</span>", "<span class=\"xref std std-term\">CFOUR_GENBAS_2</span>", "<span class=\"xref std std-term\">CFOUR_GENBAS_3</span>", "<span class=\"xref std std-term\">CFOUR_GENBAS_4</span>", "<span class=\"xref std std-term\">CFOUR_GEO_CONV</span>", "<span class=\"xref std std-term\">CFOUR_GEO_MAXCYC</span>", "<span class=\"xref std std-term\">CFOUR_GEO_MAXSTEP</span>", "<span class=\"xref std std-term\">CFOUR_GEO_METHOD</span>", "<span class=\"xref std std-term\">CFOUR_GIAO</span>", "<span class=\"xref std std-term\">CFOUR_GRID</span>", "<span class=\"xref std std-term\">CFOUR_GUESS</span>", "<span class=\"xref std std-term\">CFOUR_HBAR</span>", "<span class=\"xref std std-term\">CFOUR_HFSTABILITY</span>", "<span class=\"xref std std-term\">CFOUR_INCORE</span>", "<span class=\"xref std std-term\">CFOUR_INPUT_MRCC</span>", "<span class=\"xref std std-term\">CFOUR_INTEGRALS</span>", "<span class=\"xref std std-term\">CFOUR_JODA_PRINT</span>", "<span class=\"xref std std-term\">CFOUR_LINEQ_CONV</span>", "<span class=\"xref std std-term\">CFOUR_LINEQ_MAXCY</span>", "<span class=\"xref std std-term\">CFOUR_LINEQ_TYPE</span>", "<span class=\"xref std std-term\">CFOUR_LOCK_ORBOCC</span>", "<span class=\"xref std std-term\">CFOUR_MAXSTEP</span>", "<span class=\"xref std std-term\">CFOUR_MEM_UNIT</span>", "<span class=\"xref std std-term\">CFOUR_MEMORY_SIZE</span>", "<span class=\"xref std std-term\">CFOUR_METHOD</span>", "<span class=\"xref std std-term\">CFOUR_MRCC</span>", "<span class=\"xref std std-term\">CFOUR_MULTIPLICITY</span>", "<span class=\"xref std std-term\">CFOUR_NACOUPLING</span>", "<span class=\"xref std std-term\">CFOUR_NEGEVAL</span>", "<span class=\"xref std std-term\">CFOUR_NEWNORM</span>", "<span class=\"xref std std-term\">CFOUR_NONHF</span>", "<span class=\"xref std std-term\">CFOUR_NTOP_TAMP</span>", "<span class=\"xref std std-term\">CFOUR_OCCUPATION</span>", "<span class=\"xref std std-term\">CFOUR_OMP_NUM_THREADS</span>", "<span class=\"xref std std-term\">CFOUR_OPEN-SHELL</span>", "<span class=\"xref std std-term\">CFOUR_OPT_MAXCYC</span>", "<span class=\"xref std std-term\">CFOUR_ORBITALS</span>", "<span class=\"xref std std-term\">CFOUR_PERT_ORB</span>", "<span class=\"xref std std-term\">CFOUR_POINTS</span>", "<span class=\"xref std std-term\">CFOUR_PRINT</span>", "<span class=\"xref std std-term\">CFOUR_PROP_INTEGRAL</span>", "<span class=\"xref std std-term\">CFOUR_PROPS</span>", "<span class=\"xref std std-term\">CFOUR_QRHF_GENERAL</span>", "<span class=\"xref std std-term\">CFOUR_QRHF_ORBITAL</span>", "<span class=\"xref std std-term\">CFOUR_QRHFGUES</span>", "<span class=\"xref std std-term\">CFOUR_RAMAN_INT</span>", "<span class=\"xref std std-term\">CFOUR_RAMAN_ORB</span>", "<span class=\"xref std std-term\">CFOUR_RDO</span>", "<span class=\"xref std std-term\">CFOUR_REFERENCE</span>", "<span class=\"xref std std-term\">CFOUR_RELATIVISTIC</span>", "<span class=\"xref std std-term\">CFOUR_RELAX_DENS</span>", "<span class=\"xref std std-term\">CFOUR_RES_RAMAN</span>", "<span class=\"xref std std-term\">CFOUR_RESTART_CC</span>", "<span class=\"xref std std-term\">CFOUR_ROT_EVEC</span>", "<span class=\"xref std std-term\">CFOUR_SAVE_INTS</span>", "<span class=\"xref std std-term\">CFOUR_SCALE_ON</span>", "<span class=\"xref std std-term\">CFOUR_SCF_CONV</span>", "<span class=\"xref std std-term\">CFOUR_SCF_DAMPING</span>", "<span class=\"xref std std-term\">CFOUR_SCF_EXPORDER</span>", "<span class=\"xref std std-term\">CFOUR_SCF_EXPSTART</span>", "<span class=\"xref std std-term\">CFOUR_SCF_EXTRAPOLATION</span>", "<span class=\"xref std std-term\">CFOUR_SCF_MAXCYC</span>", "<span class=\"xref std std-term\">CFOUR_SD_FIELD</span>", "<span class=\"xref std std-term\">CFOUR_SPHERICAL</span>", "<span class=\"xref std std-term\">CFOUR_SPIN_FLIP</span>", "<span class=\"xref std std-term\">CFOUR_SPIN_ORBIT</span>", "<span class=\"xref std std-term\">CFOUR_SPIN_SCAL</span>", "<span class=\"xref std std-term\">CFOUR_SPINROTATION</span>", "<span class=\"xref std std-term\">CFOUR_SUBGROUP</span>", "<span class=\"xref std std-term\">CFOUR_SYM_CHECK</span>", "<span class=\"xref std std-term\">CFOUR_SYMMETRY</span>", "<span class=\"xref std std-term\">CFOUR_T3_EXTRAPOL</span>", "<span class=\"xref std std-term\">CFOUR_TAMP_SUM</span>", "<span class=\"xref std std-term\">CFOUR_THERMOCHEMISTRY</span>", "<span class=\"xref std std-term\">CFOUR_TRANS_INV</span>", "<span class=\"xref std std-term\">CFOUR_TREAT_PERT</span>", "<span class=\"xref std std-term\">CFOUR_UIJ_THRESHOLD</span>", "<span class=\"xref std std-term\">CFOUR_UNITS</span>", "<span class=\"xref std std-term\">CFOUR_UPDATE_HESSIAN</span>", "<span class=\"xref std std-term\">CFOUR_VIBRATION</span>", "<span class=\"xref std std-term\">CFOUR_VTRAN</span>", "<span class=\"xref std std-term\">CFOUR_XFIELD</span>", "<span class=\"xref std std-term\">CFOUR_XFORM_TOL</span>", "<span class=\"xref std std-term\">CFOUR_YFIELD</span>", "<span class=\"xref std std-term\">CFOUR_ZFIELD</span>", "<span class=\"xref std std-term\">TRANSLATE_PSI4</span>", "<span class=\"xref std std-term\">CPHF_MEM_SAFETY_FACTOR</span>", "<span class=\"xref std std-term\">CPHF_TASKS</span>", "<span class=\"xref std std-term\">DEBUG</span>", "<span class=\"xref std std-term\">DF_BASIS_SCF</span>", "<span class=\"xref std std-term\">EXPLICIT_HAMILTONIAN</span>", "<span class=\"xref std std-term\">MODULE</span>", "<span class=\"xref std std-term\">PRINT</span>", "<span class=\"xref std std-term\">SCF_TYPE</span>", "<span class=\"xref std std-term\">SOLVER_CONVERGENCE</span>", "<span class=\"xref std std-term\">SOLVER_MAXITER</span>", "<span class=\"xref std std-term\">SOLVER_N_GUESS</span>", "<span class=\"xref std std-term\">SOLVER_PRECONDITION</span>", "<span class=\"xref std std-term\">ALGORITHM</span>", "<span class=\"xref std std-term\">AO_BASIS</span>", "<span class=\"xref std std-term\">CACHELEVEL</span>", "<span class=\"xref std std-term\">DAMPING_PERCENTAGE</span>", "<span class=\"xref std std-term\">DCT_FUNCTIONAL</span>", "<span class=\"xref std std-term\">DCT_GUESS</span>", "<span class=\"xref std std-term\">DCT_TYPE</span>", "<span class=\"xref std std-term\">DF_BASIS_DCT</span>", "<span class=\"xref std std-term\">DIIS_MAX_VECS</span>", "<span class=\"xref std std-term\">DIIS_MIN_VECS</span>", "<span class=\"xref std std-term\">DIIS_START_CONVERGENCE</span>", "<span class=\"xref std std-term\">E_CONVERGENCE</span>", "<span class=\"xref std std-term\">ENERGY_LEVEL_SHIFT</span>", "<span class=\"xref std std-term\">GUESS_R_CONVERGENCE</span>", "<span class=\"xref std std-term\">INTS_TOLERANCE</span>", "<span class=\"xref std std-term\">MAXITER</span>", "<span class=\"xref std std-term\">ODC_GUESS</span>", "<span class=\"xref std std-term\">OPDM</span>", "<span class=\"xref std std-term\">ORBITAL_LEVEL_SHIFT</span>", "<span class=\"xref std std-term\">QC_COUPLING</span>", "<span class=\"xref std std-term\">QC_TYPE</span>", "<span class=\"xref std std-term\">R_CONVERGENCE</span>", "<span class=\"xref std std-term\">REFERENCE</span>", "<span class=\"xref std std-term\">RELAX_GUESS_ORBITALS</span>", "<span class=\"xref std std-term\">RESPONSE_ALGORITHM</span>", "<span class=\"xref std std-term\">STABILITY_ADD_VECTORS</span>", "<span class=\"xref std std-term\">STABILITY_AUGMENT_SPACE_TOL</span>", "<span class=\"xref std std-term\">STABILITY_CHECK</span>", "<span class=\"xref std std-term\">STABILITY_CONVERGENCE</span>", "<span class=\"xref std std-term\">STABILITY_MAX_SPACE_SIZE</span>", "<span class=\"xref std std-term\">STABILITY_N_EIGENVALUES</span>", "<span class=\"xref std std-term\">STABILITY_N_GUESS_VECTORS</span>", "<span class=\"xref std std-term\">THREE_PARTICLE</span>", "<span class=\"xref std std-term\">TIKHONOW_OMEGA</span>", "<span class=\"xref std std-term\">DDX_DIIS_MAX_VECS</span>", "<span class=\"xref std std-term\">DDX_ETA</span>", "<span class=\"xref std std-term\">DDX_FMM</span>", "<span class=\"xref std std-term\">DDX_FMM_LOCAL_LMAX</span>", "<span class=\"xref std std-term\">DDX_FMM_MULTIPOLE_LMAX</span>", "<span class=\"xref std std-term\">DDX_INCORE</span>", "<span class=\"xref std std-term\">DDX_LMAX</span>", "<span class=\"xref std std-term\">DDX_LOGFILE</span>", "<span class=\"xref std std-term\">DDX_MAXITER</span>", "<span class=\"xref std std-term\">DDX_MODEL</span>", "<span class=\"xref std std-term\">DDX_N_LEBEDEV</span>", "<span class=\"xref std std-term\">DDX_RADII</span>", "<span class=\"xref std std-term\">DDX_RADII_SCALING</span>", "<span class=\"xref std std-term\">DDX_RADII_SET</span>", "<span class=\"xref std std-term\">DDX_SHIFT</span>", "<span class=\"xref std std-term\">DDX_SOLUTE_RADIAL_POINTS</span>", "<span class=\"xref std std-term\">DDX_SOLUTE_SPHERICAL_POINTS</span>", "<span class=\"xref std std-term\">DDX_SOLVATION_CONVERGENCE</span>", "<span class=\"xref std std-term\">DDX_SOLVENT</span>", "<span class=\"xref std std-term\">DDX_SOLVENT_EPSILON</span>", "<span class=\"xref std std-term\">DDX_SOLVENT_EPSILON_OPTICAL</span>", "<span class=\"xref std std-term\">DDX_SOLVENT_KAPPA</span>", "<span class=\"xref std std-term\">A_RAS3_MAX</span>", "<span class=\"xref std std-term\">AVG_STATES</span>", "<span class=\"xref std std-term\">AVG_WEIGHTS</span>", "<span class=\"xref std std-term\">B_RAS3_MAX</span>", "<span class=\"xref std std-term\">BENDAZZOLI</span>", "<span class=\"xref std std-term\">CALC_S_SQUARED</span>", "<span class=\"xref std std-term\">CC</span>", "<span class=\"xref std std-term\">CC_A_RAS3_MAX</span>", "<span class=\"xref std std-term\">CC_B_RAS3_MAX</span>", "<span class=\"xref std std-term\">CC_EX_LEVEL</span>", "<span class=\"xref std std-term\">CC_FIX_EXTERNAL</span>", "<span class=\"xref std std-term\">CC_FIX_EXTERNAL_MIN</span>", "<span class=\"xref std std-term\">CC_MACRO</span>", "<span class=\"xref std std-term\">CC_MIXED</span>", "<span class=\"xref std std-term\">CC_RAS34_MAX</span>", "<span class=\"xref std std-term\">CC_RAS3_MAX</span>", "<span class=\"xref std std-term\">CC_RAS4_MAX</span>", "<span class=\"xref std std-term\">CC_UPDATE_EPS</span>", "<span class=\"xref std std-term\">CC_VAL_EX_LEVEL</span>", "<span class=\"xref std std-term\">CC_VARIATIONAL</span>", "<span class=\"xref std std-term\">CC_VECS_READ</span>", "<span class=\"xref std std-term\">CC_VECS_WRITE</span>", "<span class=\"xref std std-term\">CI_FILE_START</span>", "<span class=\"xref std std-term\">CI_MAXITER</span>", "<span class=\"xref std std-term\">CI_NUM_THREADS</span>", "<span class=\"xref std std-term\">CIBLKS_PRINT</span>", "<span class=\"xref std std-term\">COLLAPSE_SIZE</span>", "<span class=\"xref std std-term\">DETCI_FREEZE_CORE</span>", "<span class=\"xref std std-term\">DF_BASIS_MCSCF</span>", "<span class=\"xref std std-term\">DIAG_METHOD</span>", "<span class=\"xref std std-term\">DIIS</span>", "<span class=\"xref std std-term\">DIIS_FREQ</span>", "<span class=\"xref std std-term\">DIIS_MAX_VECS</span>", "<span class=\"xref std std-term\">DIIS_MIN_VECS</span>", "<span class=\"xref std std-term\">DIIS_START_ITER</span>", "<span class=\"xref std std-term\">DIPMOM</span>", "<span class=\"xref std std-term\">E_CONVERGENCE</span>", "<span class=\"xref std std-term\">EX_ALLOW</span>", "<span class=\"xref std std-term\">EX_LEVEL</span>", "<span class=\"xref std std-term\">FCI</span>", "<span class=\"xref std std-term\">FCI_STRINGS</span>", "<span class=\"xref std std-term\">FILTER_GUESS</span>", "<span class=\"xref std std-term\">FILTER_GUESS_DET1</span>", "<span class=\"xref std std-term\">FILTER_GUESS_DET2</span>", "<span class=\"xref std std-term\">FILTER_GUESS_SIGN</span>", "<span class=\"xref std std-term\">FILTER_ZERO_DET</span>", "<span class=\"xref std std-term\">FOLLOW_ROOT</span>", "<span class=\"xref std std-term\">FOLLOW_VECTOR</span>", "<span class=\"xref std std-term\">GUESS_VECTOR</span>", "<span class=\"xref std std-term\">H0_BLOCK_COUPLING</span>", "<span class=\"xref std std-term\">H0_BLOCK_COUPLING_SIZE</span>", "<span class=\"xref std std-term\">H0_BLOCKSIZE</span>", "<span class=\"xref std std-term\">H0_GUESS_SIZE</span>", "<span class=\"xref std std-term\">HD_AVG</span>", "<span class=\"xref std std-term\">HD_OTF</span>", "<span class=\"xref std std-term\">ICORE</span>", "<span class=\"xref std std-term\">ISTOP</span>", "<span class=\"xref std std-term\">LSE</span>", "<span class=\"xref std std-term\">LSE_COLLAPSE</span>", "<span class=\"xref std std-term\">LSE_TOLERANCE</span>", "<span class=\"xref std std-term\">MAX_NUM_VECS</span>", "<span class=\"xref std std-term\">MCSCF_ALGORITHM</span>", "<span class=\"xref std std-term\">MCSCF_CI_CLEANUP</span>", "<span class=\"xref std std-term\">MCSCF_DIIS_ERROR_TYPE</span>", "<span class=\"xref std std-term\">MCSCF_DIIS_FREQ</span>", "<span class=\"xref std std-term\">MCSCF_DIIS_MAX_VECS</span>", "<span class=\"xref std std-term\">MCSCF_DIIS_START</span>", "<span class=\"xref std std-term\">MCSCF_DPD_CLEANUP</span>", "<span class=\"xref std std-term\">MCSCF_E_CONVERGENCE</span>", "<span class=\"xref std std-term\">MCSCF_GUESS</span>", "<span class=\"xref std std-term\">MCSCF_MAX_ROT</span>", "<span class=\"xref std std-term\">MCSCF_MAXITER</span>", "<span class=\"xref std std-term\">MCSCF_R_CONVERGENCE</span>", "<span class=\"xref std std-term\">MCSCF_ROTATE</span>", "<span class=\"xref std std-term\">MCSCF_SO_START_E</span>", "<span class=\"xref std std-term\">MCSCF_SO_START_GRAD</span>", "<span class=\"xref std std-term\">MCSCF_TYPE</span>", "<span class=\"xref std std-term\">MIXED</span>", "<span class=\"xref std std-term\">MIXED4</span>", "<span class=\"xref std std-term\">MPN</span>", "<span class=\"xref std std-term\">MPN_ORDER_SAVE</span>", "<span class=\"xref std std-term\">MPN_SCHMIDT</span>", "<span class=\"xref std std-term\">MPN_WIGNER</span>", "<span class=\"xref std std-term\">MS0</span>", "<span class=\"xref std std-term\">NAT_ORBS</span>", "<span class=\"xref std std-term\">NO_DFILE</span>", "<span class=\"xref std std-term\">NUM_AMPS_PRINT</span>", "<span class=\"xref std std-term\">NUM_DETS_PRINT</span>", "<span class=\"xref std std-term\">NUM_INIT_VECS</span>", "<span class=\"xref std std-term\">NUM_ROOTS</span>", "<span class=\"xref std std-term\">OPDM</span>", "<span class=\"xref std std-term\">PERTURB_MAGNITUDE</span>", "<span class=\"xref std std-term\">PRECONDITIONER</span>", "<span class=\"xref std std-term\">R4S</span>", "<span class=\"xref std std-term\">R_CONVERGENCE</span>", "<span class=\"xref std std-term\">RAS34_MAX</span>", "<span class=\"xref std std-term\">RAS3_MAX</span>", "<span class=\"xref std std-term\">RAS4_MAX</span>", "<span class=\"xref std std-term\">REFERENCE</span>", "<span class=\"xref std std-term\">REFERENCE_SYM</span>", "<span class=\"xref std std-term\">REPL_OTF</span>", "<span class=\"xref std std-term\">RESTART</span>", "<span class=\"xref std std-term\">S</span>", "<span class=\"xref std std-term\">SF_RESTRICT</span>", "<span class=\"xref std std-term\">SIGMA_OVERLAP</span>", "<span class=\"xref std std-term\">TDM</span>", "<span class=\"xref std std-term\">TPDM</span>", "<span class=\"xref std std-term\">UPDATE</span>", "<span class=\"xref std std-term\">VAL_EX_LEVEL</span>", "<span class=\"xref std std-term\">WFN</span>", "<span class=\"xref std std-term\">DF_BASIS_EP2</span>", "<span class=\"xref std std-term\">EP2_CONVERGENCE</span>", "<span class=\"xref std std-term\">EP2_MAXITER</span>", "<span class=\"xref std std-term\">EP2_NUM_EA</span>", "<span class=\"xref std std-term\">EP2_NUM_IP</span>", "<span class=\"xref std std-term\">EP2_ORBITALS</span>", "<span class=\"xref std std-term\">BASIS</span>", "<span class=\"xref std std-term\">DF_BASIS_MP2</span>", "<span class=\"xref std std-term\">DF_INTS_IO</span>", "<span class=\"xref std std-term\">DF_INTS_NUM_THREADS</span>", "<span class=\"xref std std-term\">DFMP2_MEM_FACTOR</span>", "<span class=\"xref std std-term\">DFMP2_P2_TOLERANCE</span>", "<span class=\"xref std std-term\">DFMP2_P_TOLERANCE</span>", "<span class=\"xref std std-term\">INTS_TOLERANCE</span>", "<span class=\"xref std std-term\">MADMP2_SLEEP</span>", "<span class=\"xref std std-term\">MP2_OS_SCALE</span>", "<span class=\"xref std std-term\">MP2_SS_SCALE</span>", "<span class=\"xref std std-term\">ONEPDM</span>", "<span class=\"xref std std-term\">OPDM_RELAX</span>", "<span class=\"xref std std-term\">CC_DIIS_MAX_VECS</span>", "<span class=\"xref std std-term\">CC_DIIS_MIN_VECS</span>", "<span class=\"xref std std-term\">CC_LAMBDA</span>", "<span class=\"xref std std-term\">CC_MAXITER</span>", "<span class=\"xref std std-term\">CHOLESKY</span>", "<span class=\"xref std std-term\">CHOLESKY_TOLERANCE</span>", "<span class=\"xref std std-term\">COMPUT_S2</span>", "<span class=\"xref std std-term\">CUTOFF</span>", "<span class=\"xref std std-term\">DO_DIIS</span>", "<span class=\"xref std std-term\">DO_LEVEL_SHIFT</span>", "<span class=\"xref std std-term\">DO_SCS</span>", "<span class=\"xref std std-term\">DO_SOS</span>", "<span class=\"xref std std-term\">E3_SCALE</span>", "<span class=\"xref std std-term\">E_CONVERGENCE</span>", "<span class=\"xref std std-term\">EKT_IP</span>", "<span class=\"xref std std-term\">HESS_TYPE</span>", "<span class=\"xref std std-term\">INTEGRAL_CUTOFF</span>", "<span class=\"xref std std-term\">LEVEL_SHIFT</span>", "<span class=\"xref std std-term\">LINEQ_SOLVER</span>", "<span class=\"xref std std-term\">MAX_MOGRAD_CONVERGENCE</span>", "<span class=\"xref std std-term\">MO_DIIS_NUM_VECS</span>", "<span class=\"xref std std-term\">MO_MAXITER</span>", "<span class=\"xref std std-term\">MO_STEP_MAX</span>", "<span class=\"xref std std-term\">MOLDEN_WRITE</span>", "<span class=\"xref std std-term\">MP2_AMP_TYPE</span>", "<span class=\"xref std std-term\">MP2_OS_SCALE</span>", "<span class=\"xref std std-term\">MP2_SOS_SCALE</span>", "<span class=\"xref std std-term\">MP2_SOS_SCALE2</span>", "<span class=\"xref std std-term\">MP2_SS_SCALE</span>", "<span class=\"xref std std-term\">NAT_ORBS</span>", "<span class=\"xref std std-term\">OCC_ORBS_PRINT</span>", "<span class=\"xref std std-term\">OEPROP</span>", "<span class=\"xref std std-term\">OO_SCALE</span>", "<span class=\"xref std std-term\">OPT_METHOD</span>", "<span class=\"xref std std-term\">ORB_OPT</span>", "<span class=\"xref std std-term\">ORB_RESP_SOLVER</span>", "<span class=\"xref std std-term\">ORTH_TYPE</span>", "<span class=\"xref std std-term\">PCG_BETA_TYPE</span>", "<span class=\"xref std std-term\">PCG_CONVERGENCE</span>", "<span class=\"xref std std-term\">PCG_MAXITER</span>", "<span class=\"xref std std-term\">PPL_TYPE</span>", "<span class=\"xref std std-term\">QCHF</span>", "<span class=\"xref std std-term\">R_CONVERGENCE</span>", "<span class=\"xref std std-term\">READ_SCF_3INDEX</span>", "<span class=\"xref std std-term\">REG_PARAM</span>", "<span class=\"xref std std-term\">REGULARIZATION</span>", "<span class=\"xref std std-term\">REMP_A</span>", "<span class=\"xref std std-term\">RMS_MOGRAD_CONVERGENCE</span>", "<span class=\"xref std std-term\">SCS_TYPE</span>", "<span class=\"xref std std-term\">SOS_TYPE</span>", "<span class=\"xref std std-term\">TRIPLES_IABC_TYPE</span>", "<span class=\"xref std std-term\">WFN_TYPE</span>", "<span class=\"xref std std-term\">DF_BASIS_MP2</span>", "<span class=\"xref std std-term\">DLPNO_ALGORITHM</span>", "<span class=\"xref std std-term\">DLPNO_LOCAL_ORBITALS</span>", "<span class=\"xref std std-term\">DLPNO_MAXITER</span>", "<span class=\"xref std std-term\">DOI_BASIS_TOLERANCE</span>", "<span class=\"xref std std-term\">DOI_PRUNING_SCHEME</span>", "<span class=\"xref std std-term\">DOI_RADIAL_POINTS</span>", "<span class=\"xref std std-term\">DOI_SPHERICAL_POINTS</span>", "<span class=\"xref std std-term\">E_CONVERGENCE</span>", "<span class=\"xref std std-term\">F_CUT</span>", "<span class=\"xref std std-term\">LOCAL_CONVERGENCE</span>", "<span class=\"xref std std-term\">LOCAL_MAXITER</span>", "<span class=\"xref std std-term\">PNO_CONVERGENCE</span>", "<span class=\"xref std std-term\">R_CONVERGENCE</span>", "<span class=\"xref std std-term\">S_CUT</span>", "<span class=\"xref std std-term\">T_CUT_CLMO</span>", "<span class=\"xref std std-term\">T_CUT_CPAO</span>", "<span class=\"xref std std-term\">T_CUT_DO</span>", "<span class=\"xref std std-term\">T_CUT_DO_IJ</span>", "<span class=\"xref std std-term\">T_CUT_DO_PRE</span>", "<span class=\"xref std std-term\">T_CUT_MKN</span>", "<span class=\"xref std std-term\">T_CUT_PNO</span>", "<span class=\"xref std std-term\">T_CUT_PRE</span>", "<span class=\"xref std std-term\">DMRG_CASPT2_CALC</span>", "<span class=\"xref std std-term\">DMRG_CASPT2_IMAG</span>", "<span class=\"xref std std-term\">DMRG_CASPT2_IPEA</span>", "<span class=\"xref std std-term\">DMRG_CASPT2_ORBS</span>", "<span class=\"xref std std-term\">DMRG_DIIS</span>", "<span class=\"xref std std-term\">DMRG_DIIS_WRITE</span>", "<span class=\"xref std std-term\">DMRG_EXCITATION</span>", "<span class=\"xref std std-term\">DMRG_IRREP</span>", "<span class=\"xref std std-term\">DMRG_LOCAL_INIT</span>", "<span class=\"xref std std-term\">DMRG_MOLDEN_WRITE</span>", "<span class=\"xref std std-term\">DMRG_MPS_WRITE</span>", "<span class=\"xref std std-term\">DMRG_MULTIPLICITY</span>", "<span class=\"xref std std-term\">DMRG_OPDM_AO_PRINT</span>", "<span class=\"xref std std-term\">DMRG_PRINT_CORR</span>", "<span class=\"xref std std-term\">DMRG_SCF_ACTIVE_SPACE</span>", "<span class=\"xref std std-term\">DMRG_SCF_DIIS_THR</span>", "<span class=\"xref std std-term\">DMRG_SCF_GRAD_THR</span>", "<span class=\"xref std std-term\">DMRG_SCF_MAX_ITER</span>", "<span class=\"xref std std-term\">DMRG_SCF_STATE_AVG</span>", "<span class=\"xref std std-term\">DMRG_SWEEP_DVDSON_RTOL</span>", "<span class=\"xref std std-term\">DMRG_SWEEP_ENERGY_CONV</span>", "<span class=\"xref std std-term\">DMRG_SWEEP_MAX_SWEEPS</span>", "<span class=\"xref std std-term\">DMRG_SWEEP_NOISE_PREFAC</span>", "<span class=\"xref std std-term\">DMRG_SWEEP_STATES</span>", "<span class=\"xref std std-term\">DMRG_UNITARY_WRITE</span>", "<span class=\"xref std std-term\">DERTYPE</span>", "<span class=\"xref std std-term\">EFP_DISP</span>", "<span class=\"xref std std-term\">EFP_DISP_DAMPING</span>", "<span class=\"xref std std-term\">EFP_ELST</span>", "<span class=\"xref std std-term\">EFP_ELST_DAMPING</span>", "<span class=\"xref std std-term\">EFP_EXCH</span>", "<span class=\"xref std std-term\">EFP_IND</span>", "<span class=\"xref std std-term\">EFP_IND_DAMPING</span>", "<span class=\"xref std std-term\">EFP_QM_ELST</span>", "<span class=\"xref std std-term\">EFP_QM_IND</span>", "<span class=\"xref std std-term\">PRINT</span>", "<span class=\"xref std std-term\">QMEFP</span>", "<span class=\"xref std std-term\">DISP_SIZE</span>", "<span class=\"xref std std-term\">FD_PROJECT</span>", "<span class=\"xref std std-term\">GRADIENT_WRITE</span>", "<span class=\"xref std std-term\">HESSIAN_WRITE</span>", "<span class=\"xref std std-term\">NORMAL_MODES_WRITE</span>", "<span class=\"xref std std-term\">POINTS</span>", "<span class=\"xref std std-term\">CPHF_R_CONVERGENCE</span>", "<span class=\"xref std std-term\">CUBIC_BASIS_TOLERANCE</span>", "<span class=\"xref std std-term\">CUBIC_BLOCK_MAX_POINTS</span>", "<span class=\"xref std std-term\">CUBIC_GRID_OVERAGE</span>", "<span class=\"xref std std-term\">CUBIC_GRID_SPACING</span>", "<span class=\"xref std std-term\">FISAPT_CHARGE_COMPLETENESS</span>", "<span class=\"xref std std-term\">FISAPT_CUBE_DENSMAT</span>", "<span class=\"xref std std-term\">FISAPT_CUBE_LINKIBOS</span>", "<span class=\"xref std std-term\">FISAPT_CUBE_LINKIHOS</span>", "<span class=\"xref std std-term\">FISAPT_DO_FSAPT</span>", "<span class=\"xref std std-term\">FISAPT_DO_FSAPT_DISP</span>", "<span class=\"xref std std-term\">FISAPT_DO_PLOT</span>", "<span class=\"xref std std-term\">FISAPT_EXCH_PARPERP</span>", "<span class=\"xref std std-term\">FISAPT_FSAPT_EXCH_SCALE</span>", "<span class=\"xref std std-term\">FISAPT_FSAPT_FILEPATH</span>", "<span class=\"xref std std-term\">FISAPT_FSAPT_IND_RESPONSE</span>", "<span class=\"xref std std-term\">FISAPT_FSAPT_IND_SCALE</span>", "<span class=\"xref std std-term\">FISAPT_FSSAPT_FILEPATH</span>", "<span class=\"xref std std-term\">FISAPT_LINK_ASSIGNMENT</span>", "<span class=\"xref std std-term\">FISAPT_LINK_ORTHO</span>", "<span class=\"xref std std-term\">FISAPT_LINK_SELECTION</span>", "<span class=\"xref std std-term\">FISAPT_MANUAL_LINKS</span>", "<span class=\"xref std std-term\">FISAPT_MEM_SAFETY_FACTOR</span>", "<span class=\"xref std std-term\">FISAPT_PLOT_FILEPATH</span>", "<span class=\"xref std std-term\">INTS_TOLERANCE</span>", "<span class=\"xref std std-term\">LOCAL_CONVERGENCE</span>", "<span class=\"xref std std-term\">LOCAL_IBO_CONDITION</span>", "<span class=\"xref std std-term\">LOCAL_IBO_POWER</span>", "<span class=\"xref std std-term\">LOCAL_IBO_STARS</span>", "<span class=\"xref std std-term\">LOCAL_IBO_STARS_COMPLETENESS</span>", "<span class=\"xref std std-term\">LOCAL_IBO_USE_STARS</span>", "<span class=\"xref std std-term\">LOCAL_MAXITER</span>", "<span class=\"xref std std-term\">LOCAL_USE_GHOSTS</span>", "<span class=\"xref std std-term\">MAXITER</span>", "<span class=\"xref std std-term\">MINAO_BASIS</span>", "<span class=\"xref std std-term\">SSAPT0_SCALE</span>", "<span class=\"xref std std-term\">ACTIVE_NAT_ORBS</span>", "<span class=\"xref std std-term\">BRUECKNER_MAXITER</span>", "<span class=\"xref std std-term\">CC_SCALE_OS</span>", "<span class=\"xref std std-term\">CC_SCALE_SS</span>", "<span class=\"xref std std-term\">CC_TIMINGS</span>", "<span class=\"xref std std-term\">CEPA_LEVEL</span>", "<span class=\"xref std std-term\">CEPA_NO_SINGLES</span>", "<span class=\"xref std std-term\">CHOLESKY_TOLERANCE</span>", "<span class=\"xref std std-term\">COMPUTE_MP4_TRIPLES</span>", "<span class=\"xref std std-term\">COMPUTE_TRIPLES</span>", "<span class=\"xref std std-term\">DF_BASIS_CC</span>", "<span class=\"xref std std-term\">DFCC</span>", "<span class=\"xref std std-term\">DIIS_MAX_VECS</span>", "<span class=\"xref std std-term\">DIPMOM</span>", "<span class=\"xref std std-term\">E_CONVERGENCE</span>", "<span class=\"xref std std-term\">MAXITER</span>", "<span class=\"xref std std-term\">MP2_SCALE_OS</span>", "<span class=\"xref std std-term\">MP2_SCALE_SS</span>", "<span class=\"xref std std-term\">NAT_ORBS</span>", "<span class=\"xref std std-term\">OCC_PERCENTAGE</span>", "<span class=\"xref std std-term\">OCC_TOLERANCE</span>", "<span class=\"xref std std-term\">R_CONVERGENCE</span>", "<span class=\"xref std std-term\">RUN_CCSD</span>", "<span class=\"xref std std-term\">RUN_CEPA</span>", "<span class=\"xref std std-term\">RUN_MP2</span>", "<span class=\"xref std std-term\">RUN_MP3</span>", "<span class=\"xref std std-term\">RUN_MP4</span>", "<span class=\"xref std std-term\">SCS_CCSD</span>", "<span class=\"xref std std-term\">SCS_CEPA</span>", "<span class=\"xref std std-term\">SCS_MP2</span>", "<span class=\"xref std std-term\">TRIPLES_LOW_MEMORY</span>", "<span class=\"xref std std-term\">USE_DF_INTS</span>", "<span class=\"xref std std-term\">GDMA_LIMIT</span>", "<span class=\"xref std std-term\">GDMA_MULTIPOLE_UNITS</span>", "<span class=\"xref std std-term\">GDMA_ORIGIN</span>", "<span class=\"xref std std-term\">GDMA_RADIUS</span>", "<span class=\"xref std std-term\">GDMA_SWITCH</span>", "<span class=\"xref std std-term\">ACTIVE</span>", "<span class=\"xref std std-term\">BASIS_RELATIVISTIC</span>", "<span class=\"xref std std-term\">BENCH</span>", "<span class=\"xref std std-term\">BRIANQC_ENABLE</span>", "<span class=\"xref std std-term\">CC_TYPE</span>", "<span class=\"xref std std-term\">CI_TYPE</span>", "<span class=\"xref std std-term\">CUBEPROP_BASIS_FUNCTIONS</span>", "<span class=\"xref std std-term\">CUBEPROP_FILEPATH</span>", "<span class=\"xref std std-term\">CUBEPROP_ISOCONTOUR_THRESHOLD</span>", "<span class=\"xref std std-term\">CUBEPROP_ORBITALS</span>", "<span class=\"xref std std-term\">CUBEPROP_TASKS</span>", "<span class=\"xref std std-term\">CUBIC_BASIS_TOLERANCE</span>", "<span class=\"xref std std-term\">CUBIC_BLOCK_MAX_POINTS</span>", "<span class=\"xref std std-term\">CUBIC_GRID_OVERAGE</span>", "<span class=\"xref std std-term\">CUBIC_GRID_SPACING</span>", "<span class=\"xref std std-term\">DDX</span>", "<span class=\"xref std std-term\">DEBUG</span>", "<span class=\"xref std std-term\">DERTYPE</span>", "<span class=\"xref std std-term\">DF_BASIS_CC</span>", "<span class=\"xref std std-term\">DIE_IF_NOT_CONVERGED</span>", "<span class=\"xref std std-term\">DKH_ORDER</span>", "<span class=\"xref std std-term\">DOCC</span>", "<span class=\"xref std std-term\">EXTERNAL_POTENTIAL_SYMMETRY</span>", "<span class=\"xref std std-term\">FREEZE_CORE</span>", "<span class=\"xref std std-term\">FREEZE_CORE_POLICY</span>", "<span class=\"xref std std-term\">FROZEN_DOCC</span>", "<span class=\"xref std std-term\">FROZEN_UOCC</span>", "<span class=\"xref std std-term\">INTEGRAL_PACKAGE</span>", "<span class=\"xref std std-term\">LITERAL_CFOUR</span>", "<span class=\"xref std std-term\">LS_THC_BASIS_TOLERANCE</span>", "<span class=\"xref std std-term\">LS_THC_DF</span>", "<span class=\"xref std std-term\">LS_THC_PRUNING_SCHEME</span>", "<span class=\"xref std std-term\">LS_THC_RADIAL_POINTS</span>", "<span class=\"xref std std-term\">LS_THC_S_EPSILON</span>", "<span class=\"xref std std-term\">LS_THC_SPHERICAL_POINTS</span>", "<span class=\"xref std std-term\">LS_THC_WEIGHTS_TOLERANCE</span>", "<span class=\"xref std std-term\">MAT_NUM_COLUMN_PRINT</span>", "<span class=\"xref std std-term\">MAX_RADIAL_MOMENT</span>", "<span class=\"xref std std-term\">MBIS_D_CONVERGENCE</span>", "<span class=\"xref std std-term\">MBIS_MAXITER</span>", "<span class=\"xref std std-term\">MBIS_PRUNING_SCHEME</span>", "<span class=\"xref std std-term\">MBIS_RADIAL_POINTS</span>", "<span class=\"xref std std-term\">MBIS_SPHERICAL_POINTS</span>", "<span class=\"xref std std-term\">MOLDEN_WITH_VIRTUAL</span>", "<span class=\"xref std std-term\">MP2_TYPE</span>", "<span class=\"xref std std-term\">MP_TYPE</span>", "<span class=\"xref std std-term\">NUM_FROZEN_DOCC</span>", "<span class=\"xref std std-term\">NUM_FROZEN_UOCC</span>", "<span class=\"xref std std-term\">PARENT_SYMMETRY</span>", "<span class=\"xref std std-term\">PCM</span>", "<span class=\"xref std std-term\">PE</span>", "<span class=\"xref std std-term\">PRINT</span>", "<span class=\"xref std std-term\">PRINT_NOONS</span>", "<span class=\"xref std std-term\">PROPERTIES</span>", "<span class=\"xref std std-term\">PROPERTIES_ORIGIN</span>", "<span class=\"xref std std-term\">PUREAM</span>", "<span class=\"xref std std-term\">QC_MODULE</span>", "<span class=\"xref std std-term\">RAS1</span>", "<span class=\"xref std std-term\">RAS2</span>", "<span class=\"xref std std-term\">RAS3</span>", "<span class=\"xref std std-term\">RAS4</span>", "<span class=\"xref std std-term\">RELATIVISTIC</span>", "<span class=\"xref std std-term\">RESTRICTED_DOCC</span>", "<span class=\"xref std std-term\">RESTRICTED_UOCC</span>", "<span class=\"xref std std-term\">SCF_TYPE</span>", "<span class=\"xref std std-term\">SCREENING</span>", "<span class=\"xref std std-term\">SOCC</span>", "<span class=\"xref std std-term\">WFN</span>", "<span class=\"xref std std-term\">WRITER_FILE_LABEL</span>", "<span class=\"xref std std-term\">CANONICALIZE_ACTIVE_FAVG</span>", "<span class=\"xref std std-term\">CANONICALIZE_INACTIVE_FAVG</span>", "<span class=\"xref std std-term\">CI_DIIS</span>", "<span class=\"xref std std-term\">D_CONVERGENCE</span>", "<span class=\"xref std std-term\">DIIS</span>", "<span class=\"xref std std-term\">DIIS_MAX_VECS</span>", "<span class=\"xref std std-term\">DOCC</span>", "<span class=\"xref std std-term\">E_CONVERGENCE</span>", "<span class=\"xref std std-term\">FAVG</span>", "<span class=\"xref std std-term\">FAVG_START</span>", "<span class=\"xref std std-term\">FOLLOW_ROOT</span>", "<span class=\"xref std std-term\">FORCE_TWOCON</span>", "<span class=\"xref std std-term\">INTERNAL_ROTATIONS</span>", "<span class=\"xref std std-term\">LEVEL_SHIFT</span>", "<span class=\"xref std std-term\">MAXITER</span>", "<span class=\"xref std std-term\">MO_READ</span>", "<span class=\"xref std std-term\">REFERENCE</span>", "<span class=\"xref std std-term\">ROTATE_MO_ANGLE</span>", "<span class=\"xref std std-term\">ROTATE_MO_IRREP</span>", "<span class=\"xref std std-term\">ROTATE_MO_P</span>", "<span class=\"xref std std-term\">ROTATE_MO_Q</span>", "<span class=\"xref std std-term\">SOCC</span>", "<span class=\"xref std std-term\">TURN_ON_ACTV</span>", "<span class=\"xref std std-term\">WFN_SYM</span>", "<span class=\"xref std std-term\">BASIS</span>", "<span class=\"xref std std-term\">OMEGA_ERF</span>", "ADC", "CCDENSITY", "CCENERGY", "CCEOM", "CCHBAR", "CCLAMBDA", "CCRESPONSE", "CCTRANSORT", "CCTRIPLES", "CFOUR", "CPHF", "DCT", "DDX", "DETCI", "DFEP2", "DFMP2", "DFOCC", "DLPNO", "DMRG", "EFP", "FINDIF", "FISAPT", "FNOCC", "GDMA", "GLOBALS", "MCSCF", "MINTS", "MRCC", "OCC", "OPTKING", "PCM", "PE", "PSIMRCC", "SAPT", "SCF", "THERMO", "<span class=\"xref std std-term\">E_CONVERGENCE</span>", "<span class=\"xref std std-term\">INTS_TOLERANCE</span>", "<span class=\"xref std std-term\">MRCC_LEVEL</span>", "<span class=\"xref std std-term\">MRCC_METHOD</span>", "<span class=\"xref std std-term\">MRCC_NUM_DOUBLET_ROOTS</span>", "<span class=\"xref std std-term\">MRCC_NUM_SINGLET_ROOTS</span>", "<span class=\"xref std std-term\">MRCC_NUM_TRIPLET_ROOTS</span>", "<span class=\"xref std std-term\">MRCC_OMP_NUM_THREADS</span>", "<span class=\"xref std std-term\">MRCC_RESTART</span>", "<span class=\"xref std std-term\">CACHELEVEL</span>", "<span class=\"xref std std-term\">CC_MAXITER</span>", "<span class=\"xref std std-term\">CCL_ENERGY</span>", "<span class=\"xref std std-term\">CEPA_OS_SCALE</span>", "<span class=\"xref std std-term\">CEPA_SOS_SCALE</span>", "<span class=\"xref std std-term\">CEPA_SS_SCALE</span>", "<span class=\"xref std std-term\">CEPA_TYPE</span>", "<span class=\"xref std std-term\">CUTOFF</span>", "<span class=\"xref std std-term\">DIIS_MAX_VECS</span>", "<span class=\"xref std std-term\">DIIS_MIN_VECS</span>", "<span class=\"xref std std-term\">DO_DIIS</span>", "<span class=\"xref std std-term\">DO_LEVEL_SHIFT</span>", "<span class=\"xref std std-term\">DO_SCS</span>", "<span class=\"xref std std-term\">DO_SOS</span>", "<span class=\"xref std std-term\">E3_SCALE</span>", "<span class=\"xref std std-term\">E_CONVERGENCE</span>", "<span class=\"xref std std-term\">EA_POLES</span>", "<span class=\"xref std std-term\">EKT_EA</span>", "<span class=\"xref std std-term\">EKT_IP</span>", "<span class=\"xref std std-term\">EP_EA_POLES</span>", "<span class=\"xref std std-term\">EP_IP_POLES</span>", "<span class=\"xref std std-term\">EP_MAXITER</span>", "<span class=\"xref std std-term\">IP_POLES</span>", "<span class=\"xref std std-term\">LEVEL_SHIFT</span>", "<span class=\"xref std std-term\">MAX_MOGRAD_CONVERGENCE</span>", "<span class=\"xref std std-term\">MO_MAXITER</span>", "<span class=\"xref std std-term\">MO_READ</span>", "<span class=\"xref std std-term\">MO_STEP_MAX</span>", "<span class=\"xref std std-term\">MO_WRITE</span>", "<span class=\"xref std std-term\">MOGRAD_DAMPING</span>", "<span class=\"xref std std-term\">MP2_OS_SCALE</span>", "<span class=\"xref std std-term\">MP2_SOS_SCALE</span>", "<span class=\"xref std std-term\">MP2_SOS_SCALE2</span>", "<span class=\"xref std std-term\">MP2_SS_SCALE</span>", "<span class=\"xref std std-term\">NAT_ORBS</span>", "<span class=\"xref std std-term\">OCC_ORBS_PRINT</span>", "<span class=\"xref std std-term\">OEPROP</span>", "<span class=\"xref std std-term\">OPT_METHOD</span>", "<span class=\"xref std std-term\">ORB_OPT</span>", "<span class=\"xref std std-term\">ORB_RESP_SOLVER</span>", "<span class=\"xref std std-term\">ORTH_TYPE</span>", "<span class=\"xref std std-term\">OS_SCALE</span>", "<span class=\"xref std std-term\">PCG_BETA_TYPE</span>", "<span class=\"xref std std-term\">PCG_CONVERGENCE</span>", "<span class=\"xref std std-term\">PCG_MAXITER</span>", "<span class=\"xref std std-term\">R_CONVERGENCE</span>", "<span class=\"xref std std-term\">RELAXED</span>", "<span class=\"xref std std-term\">REMP_A</span>", "<span class=\"xref std std-term\">RMS_MOGRAD_CONVERGENCE</span>", "<span class=\"xref std std-term\">SCS_TYPE</span>", "<span class=\"xref std std-term\">SOS_TYPE</span>", "<span class=\"xref std std-term\">SPIN_SCALE_TYPE</span>", "<span class=\"xref std std-term\">SS_SCALE</span>", "<span class=\"xref std std-term\">SYMMETRIZE</span>", "<span class=\"xref std std-term\">TPDM_ABCD_TYPE</span>", "<span class=\"xref std std-term\">WFN_TYPE</span>", "<span class=\"xref std std-term\">ADD_AUXILIARY_BONDS</span>", "<span class=\"xref std std-term\">AUXILIARY_BOND_FACTOR</span>", "<span class=\"xref std std-term\">CART_HESS_READ</span>", "<span class=\"xref std std-term\">CARTESIAN_SYM_TOLERANCE</span>", "<span class=\"xref std std-term\">CONSECUTIVE_BACKSTEPS</span>", "<span class=\"xref std std-term\">COVALENT_CONNECT</span>", "<span class=\"xref std std-term\">CUSTOM_COORDS</span>", "<span class=\"xref std std-term\">DYNAMIC_LEVEL</span>", "<span class=\"xref std std-term\">ENSURE_BT_CONVERGENCE</span>", "<span class=\"xref std std-term\">EXT_FORCE_BEND</span>", "<span class=\"xref std std-term\">EXT_FORCE_CARTESIAN</span>", "<span class=\"xref std std-term\">EXT_FORCE_DIHEDRAL</span>", "<span class=\"xref std std-term\">EXT_FORCE_DISTANCE</span>", "<span class=\"xref std std-term\">EXT_FORCE_OOFP</span>", "<span class=\"xref std std-term\">FLEXIBLE_G_CONVERGENCE</span>", "<span class=\"xref std std-term\">FRAG_MODE</span>", "<span class=\"xref std std-term\">FRAG_REF_ATOMS</span>", "<span class=\"xref std std-term\">FREEZE_ALL_DIHEDRALS</span>", "<span class=\"xref std std-term\">FREEZE_INTERFRAG</span>", "<span class=\"xref std std-term\">FREEZE_INTRAFRAG</span>", "<span class=\"xref std std-term\">FROZEN_BEND</span>", "<span class=\"xref std std-term\">FROZEN_CARTESIAN</span>", "<span class=\"xref std std-term\">FROZEN_DIHEDRAL</span>", "<span class=\"xref std std-term\">FROZEN_DISTANCE</span>", "<span class=\"xref std std-term\">FROZEN_OOFP</span>", "<span class=\"xref std std-term\">FULL_HESS_EVERY</span>", "<span class=\"xref std std-term\">G_CONVERGENCE</span>", "<span class=\"xref std std-term\">GEOM_MAXITER</span>", "<span class=\"xref std std-term\">H_BOND_CONNECT</span>", "<span class=\"xref std std-term\">H_GUESS_EVERY</span>", "<span class=\"xref std std-term\">H_UPDATE_DEN_TOL</span>", "<span class=\"xref std std-term\">HESS_UPDATE</span>", "<span class=\"xref std std-term\">HESS_UPDATE_LIMIT</span>", "<span class=\"xref std std-term\">HESS_UPDATE_LIMIT_MAX</span>", "<span class=\"xref std std-term\">HESS_UPDATE_LIMIT_SCALE</span>", "<span class=\"xref std std-term\">HESS_UPDATE_USE_LAST</span>", "<span class=\"xref std std-term\">INTCOS_GENERATE_EXIT</span>", "<span class=\"xref std std-term\">INTERFRAG_COLLINEAR_TOL</span>", "<span class=\"xref std std-term\">INTERFRAG_COORDS</span>", "<span class=\"xref std std-term\">INTERFRAG_DIST_INV</span>", "<span class=\"xref std std-term\">INTERFRAG_HESS</span>", "<span class=\"xref std std-term\">INTERFRAG_MODE</span>", "<span class=\"xref std std-term\">INTERFRAG_STEP_LIMIT</span>", "<span class=\"xref std std-term\">INTERFRAGMENT_CONNECT</span>", "<span class=\"xref std std-term\">INTRAFRAG_HESS</span>", "<span class=\"xref std std-term\">INTRAFRAG_STEP_LIMIT</span>", "<span class=\"xref std std-term\">INTRAFRAG_STEP_LIMIT_MAX</span>", "<span class=\"xref std std-term\">INTRAFRAG_STEP_LIMIT_MIN</span>", "<span class=\"xref std std-term\">IRC_DIRECTION</span>", "<span class=\"xref std std-term\">IRC_POINTS</span>", "<span class=\"xref std std-term\">IRC_STEP_SIZE</span>", "<span class=\"xref std std-term\">MAX_DISP_G_CONVERGENCE</span>", "<span class=\"xref std std-term\">MAX_ENERGY_G_CONVERGENCE</span>", "<span class=\"xref std std-term\">MAX_FORCE_G_CONVERGENCE</span>", "<span class=\"xref std std-term\">OPT_COORDINATES</span>", "<span class=\"xref std std-term\">OPT_RESTART</span>", "<span class=\"xref std std-term\">OPT_TYPE</span>", "<span class=\"xref std std-term\">PRINT_OPT_PARAMS</span>", "<span class=\"xref std std-term\">PRINT_TRAJECTORY_XYZ_FILE</span>", "<span class=\"xref std std-term\">RANGED_BEND</span>", "<span class=\"xref std std-term\">RANGED_DIHEDRAL</span>", "<span class=\"xref std std-term\">RANGED_DISTANCE</span>", "<span class=\"xref std std-term\">RANGED_OOFP</span>", "<span class=\"xref std std-term\">RFO_FOLLOW_ROOT</span>", "<span class=\"xref std std-term\">RFO_NORMALIZATION_MAX</span>", "<span class=\"xref std std-term\">RFO_ROOT</span>", "<span class=\"xref std std-term\">RMS_DISP_G_CONVERGENCE</span>", "<span class=\"xref std std-term\">RMS_FORCE_G_CONVERGENCE</span>", "<span class=\"xref std std-term\">RSRFO_ALPHA_MAX</span>", "<span class=\"xref std std-term\">SAVE_OPTIMIZATION</span>", "<span class=\"xref std std-term\">STEP_TYPE</span>", "<span class=\"xref std std-term\">TEST_B</span>", "<span class=\"xref std std-term\">TEST_DERIVATIVE_B</span>", "<span class=\"xref std std-term\">UNFREEZE_DIHEDRALS</span>", "<span class=\"xref std std-term\">WRITE_OPT_HISTORY</span>", "<span class=\"xref std std-term\">WRITE_OPT_RESULT</span>", "<span class=\"xref std std-term\">WRITE_TRAJECTORY</span>", "<span class=\"xref std std-term\">PCM_CC_TYPE</span>", "<span class=\"xref std std-term\">PCM_SCF_TYPE</span>", "<span class=\"xref std std-term\">PCMSOLVER_PARSED_FNAME</span>", "<span class=\"xref std std-term\">BORDER</span>", "<span class=\"xref std std-term\">BORDER_N_REDIST</span>", "<span class=\"xref std std-term\">BORDER_REDIST_ORDER</span>", "<span class=\"xref std std-term\">BORDER_REDIST_POL</span>", "<span class=\"xref std std-term\">BORDER_RMIN</span>", "<span class=\"xref std std-term\">BORDER_RMIN_UNIT</span>", "<span class=\"xref std std-term\">BORDER_TYPE</span>", "<span class=\"xref std std-term\">DAMP_INDUCED</span>", "<span class=\"xref std std-term\">DAMP_MULTIPOLE</span>", "<span class=\"xref std std-term\">DAMPING_FACTOR_INDUCED</span>", "<span class=\"xref std std-term\">DAMPING_FACTOR_MULTIPOLE</span>", "<span class=\"xref std std-term\">INDUCED_CONVERGENCE</span>", "<span class=\"xref std std-term\">ISOTROPIC_POL</span>", "<span class=\"xref std std-term\">MAXITER</span>", "<span class=\"xref std std-term\">PE_ECP</span>", "<span class=\"xref std std-term\">POTFILE</span>", "<span class=\"xref std std-term\">SUMMATION_FIELDS</span>", "<span class=\"xref std std-term\">TREE_EXPANSION_ORDER</span>", "<span class=\"xref std std-term\">TREE_THETA</span>", "<span class=\"xref std std-term\">CC_NUM_THREADS</span>", "<span class=\"xref std std-term\">CORR_ANSATZ</span>", "<span class=\"xref std std-term\">CORR_CCSD_T</span>", "<span class=\"xref std std-term\">CORR_CHARGE</span>", "<span class=\"xref std std-term\">CORR_MULTP</span>", "<span class=\"xref std std-term\">CORR_WFN</span>", "<span class=\"xref std std-term\">COUPLING</span>", "<span class=\"xref std std-term\">COUPLING_TERMS</span>", "<span class=\"xref std std-term\">DAMPING_PERCENTAGE</span>", "<span class=\"xref std std-term\">DIAGONAL_CCSD_T</span>", "<span class=\"xref std std-term\">DIAGONALIZE_HEFF</span>", "<span class=\"xref std std-term\">DIIS_MAX_VECS</span>", "<span class=\"xref std std-term\">DIIS_START</span>", "<span class=\"xref std std-term\">E_CONVERGENCE</span>", "<span class=\"xref std std-term\">FAVG_CCSD_T</span>", "<span class=\"xref std std-term\">FOLLOW_ROOT</span>", "<span class=\"xref std std-term\">HEFF4</span>", "<span class=\"xref std std-term\">HEFF_PRINT</span>", "<span class=\"xref std std-term\">LOCK_SINGLET</span>", "<span class=\"xref std std-term\">MAXITER</span>", "<span class=\"xref std std-term\">MP2_CCSD_METHOD</span>", "<span class=\"xref std std-term\">MP2_GUESS</span>", "<span class=\"xref std std-term\">NO_SINGLES</span>", "<span class=\"xref std std-term\">OFFDIAGONAL_CCSD_T</span>", "<span class=\"xref std std-term\">PERTURB_CBS</span>", "<span class=\"xref std std-term\">PERTURB_CBS_COUPLING</span>", "<span class=\"xref std std-term\">PT_ENERGY</span>", "<span class=\"xref std std-term\">R_CONVERGENCE</span>", "<span class=\"xref std std-term\">SMALL_CUTOFF</span>", "<span class=\"xref std std-term\">TIKHONOW_MAX</span>", "<span class=\"xref std std-term\">TIKHONOW_OMEGA</span>", "<span class=\"xref std std-term\">TIKHONOW_TRIPLES</span>", "<span class=\"xref std std-term\">TRIPLES_ALGORITHM</span>", "<span class=\"xref std std-term\">TRIPLES_DIIS</span>", "<span class=\"xref std std-term\">USE_SPIN_SYM</span>", "<span class=\"xref std std-term\">USE_SPIN_SYMMETRY</span>", "<span class=\"xref std std-term\">WFN_SYM</span>", "<span class=\"xref std std-term\">ZERO_INTERNAL_AMPS</span>", "<span class=\"xref std std-term\">AIO_CPHF</span>", "<span class=\"xref std std-term\">AIO_DF_INTS</span>", "<span class=\"xref std std-term\">BASIS</span>", "<span class=\"xref std std-term\">CCD_E_CONVERGENCE</span>", "<span class=\"xref std std-term\">CCD_MAXITER</span>", "<span class=\"xref std std-term\">CCD_T_CONVERGENCE</span>", "<span class=\"xref std std-term\">COUPLED_INDUCTION</span>", "<span class=\"xref std std-term\">CPHF_R_CONVERGENCE</span>", "<span class=\"xref std std-term\">DENOMINATOR_ALGORITHM</span>", "<span class=\"xref std std-term\">DENOMINATOR_DELTA</span>", "<span class=\"xref std std-term\">DF_BASIS_ELST</span>", "<span class=\"xref std std-term\">DF_BASIS_SAPT</span>", "<span class=\"xref std std-term\">DO_CCD_DISP</span>", "<span class=\"xref std std-term\">DO_DISP_EXCH_SINF</span>", "<span class=\"xref std std-term\">DO_IND30_EXCH_SINF</span>", "<span class=\"xref std std-term\">DO_IND_EXCH_SINF</span>", "<span class=\"xref std std-term\">DO_MBPT_DISP</span>", "<span class=\"xref std std-term\">DO_THIRD_ORDER</span>", "<span class=\"xref std std-term\">EXCH_SCALE_ALPHA</span>", "<span class=\"xref std std-term\">FREEZE_CORE</span>", "<span class=\"xref std std-term\">INTS_TOLERANCE</span>", "<span class=\"xref std std-term\">MAX_CCD_DIISVECS</span>", "<span class=\"xref std std-term\">MAXITER</span>", "<span class=\"xref std std-term\">MIN_CCD_DIISVECS</span>", "<span class=\"xref std std-term\">NAT_ORBS_T2</span>", "<span class=\"xref std std-term\">NAT_ORBS_T3</span>", "<span class=\"xref std std-term\">NAT_ORBS_V4</span>", "<span class=\"xref std std-term\">OCC_TOLERANCE</span>", "<span class=\"xref std std-term\">PRINT</span>", "<span class=\"xref std std-term\">SAPT0_E10</span>", "<span class=\"xref std std-term\">SAPT0_E20DISP</span>", "<span class=\"xref std std-term\">SAPT0_E20IND</span>", "<span class=\"xref std std-term\">SAPT_DFT_DO_DHF</span>", "<span class=\"xref std std-term\">SAPT_DFT_DO_HYBRID</span>", "<span class=\"xref std std-term\">SAPT_DFT_EXCH_DISP_FIXED_SCALE</span>", "<span class=\"xref std std-term\">SAPT_DFT_EXCH_DISP_SCALE_SCHEME</span>", "<span class=\"xref std std-term\">SAPT_DFT_FUNCTIONAL</span>", "<span class=\"xref std std-term\">SAPT_DFT_GRAC_DETERMINATION</span>", "<span class=\"xref std std-term\">SAPT_DFT_GRAC_SHIFT_A</span>", "<span class=\"xref std std-term\">SAPT_DFT_GRAC_SHIFT_B</span>", "<span class=\"xref std std-term\">SAPT_DFT_MP2_DISP_ALG</span>", "<span class=\"xref std std-term\">SAPT_FDDS_DISP_LEG_LAMBDA</span>", "<span class=\"xref std std-term\">SAPT_FDDS_DISP_NUM_POINTS</span>", "<span class=\"xref std std-term\">SAPT_FDDS_V2_RHO_CUTOFF</span>", "<span class=\"xref std std-term\">SAPT_LEVEL</span>", "<span class=\"xref std std-term\">SAPT_MEM_CHECK</span>", "<span class=\"xref std std-term\">SAPT_MEM_FACTOR</span>", "<span class=\"xref std std-term\">SAPT_MEM_SAFETY</span>", "<span class=\"xref std std-term\">SAPT_QUIET</span>", "<span class=\"xref std std-term\">BASIS</span>", "<span class=\"xref std std-term\">BASIS_GUESS</span>", "<span class=\"xref std std-term\">CHOLESKY_TOLERANCE</span>", "<span class=\"xref std std-term\">COSX_BASIS_TOLERANCE</span>", "<span class=\"xref std std-term\">COSX_DENSITY_TOLERANCE</span>", "<span class=\"xref std std-term\">COSX_INTS_TOLERANCE</span>", "<span class=\"xref std std-term\">COSX_MAXITER_FINAL</span>", "<span class=\"xref std std-term\">COSX_OVERLAP_FITTING</span>", "<span class=\"xref std std-term\">COSX_PRUNING_SCHEME</span>", "<span class=\"xref std std-term\">COSX_RADIAL_POINTS_FINAL</span>", "<span class=\"xref std std-term\">COSX_RADIAL_POINTS_INITIAL</span>", "<span class=\"xref std std-term\">COSX_SPHERICAL_POINTS_FINAL</span>", "<span class=\"xref std std-term\">COSX_SPHERICAL_POINTS_INITIAL</span>", "<span class=\"xref std std-term\">D_CONVERGENCE</span>", "<span class=\"xref std std-term\">DAMPING_CONVERGENCE</span>", "<span class=\"xref std std-term\">DAMPING_PERCENTAGE</span>", "<span class=\"xref std std-term\">DF_BASIS_GUESS</span>", "<span class=\"xref std std-term\">DF_BASIS_SAD</span>", "<span class=\"xref std std-term\">DF_BASIS_SCF</span>", "<span class=\"xref std std-term\">DF_BUMP_R0</span>", "<span class=\"xref std std-term\">DF_BUMP_R1</span>", "<span class=\"xref std std-term\">DF_DOMAINS</span>", "<span class=\"xref std std-term\">DF_FITTING_CONDITION</span>", "<span class=\"xref std std-term\">DF_INTS_IO</span>", "<span class=\"xref std std-term\">DF_INTS_NUM_THREADS</span>", "<span class=\"xref std std-term\">DF_METRIC</span>", "<span class=\"xref std std-term\">DF_SCF_GUESS</span>", "<span class=\"xref std std-term\">DF_THETA</span>", "<span class=\"xref std std-term\">DFT_ALPHA</span>", "<span class=\"xref std std-term\">DFT_ALPHA_C</span>", "<span class=\"xref std std-term\">DFT_BASIS_TOLERANCE</span>", "<span class=\"xref std std-term\">DFT_BLOCK_MAX_POINTS</span>", "<span class=\"xref std std-term\">DFT_BLOCK_MAX_RADIUS</span>", "<span class=\"xref std std-term\">DFT_BLOCK_MIN_POINTS</span>", "<span class=\"xref std std-term\">DFT_BLOCK_SCHEME</span>", "<span class=\"xref std std-term\">DFT_BS_RADIUS_ALPHA</span>", "<span class=\"xref std std-term\">DFT_DENSITY_TOLERANCE</span>", "<span class=\"xref std std-term\">DFT_DISPERSION_PARAMETERS</span>", "<span class=\"xref std std-term\">DFT_GRAC_ALPHA</span>", "<span class=\"xref std std-term\">DFT_GRAC_BETA</span>", "<span class=\"xref std std-term\">DFT_GRAC_C_FUNC</span>", "<span class=\"xref std std-term\">DFT_GRAC_SHIFT</span>", "<span class=\"xref std std-term\">DFT_GRAC_X_FUNC</span>", "<span class=\"xref std std-term\">DFT_GRID_NAME</span>", "<span class=\"xref std std-term\">DFT_NUCLEAR_SCHEME</span>", "<span class=\"xref std std-term\">DFT_OMEGA</span>", "<span class=\"xref std std-term\">DFT_OMEGA_C</span>", "<span class=\"xref std std-term\">DFT_PRUNING_ALPHA</span>", "<span class=\"xref std std-term\">DFT_PRUNING_SCHEME</span>", "<span class=\"xref std std-term\">DFT_RADIAL_POINTS</span>", "<span class=\"xref std std-term\">DFT_RADIAL_SCHEME</span>", "<span class=\"xref std std-term\">DFT_REMOVE_DISTANT_POINTS</span>", "<span class=\"xref std std-term\">DFT_SPHERICAL_POINTS</span>", "<span class=\"xref std std-term\">DFT_SPHERICAL_SCHEME</span>", "<span class=\"xref std std-term\">DFT_V2_RHO_CUTOFF</span>", "<span class=\"xref std std-term\">DFT_VV10_B</span>", "<span class=\"xref std std-term\">DFT_VV10_C</span>", "<span class=\"xref std std-term\">DFT_VV10_POSTSCF</span>", "<span class=\"xref std std-term\">DFT_VV10_RADIAL_POINTS</span>", "<span class=\"xref std std-term\">DFT_VV10_RHO_CUTOFF</span>", "<span class=\"xref std std-term\">DFT_VV10_SPHERICAL_POINTS</span>", "<span class=\"xref std std-term\">DFT_WEIGHTS_TOLERANCE</span>", "<span class=\"xref std std-term\">DIIS</span>", "<span class=\"xref std std-term\">DIIS_MAX_VECS</span>", "<span class=\"xref std std-term\">DIIS_MIN_VECS</span>", "<span class=\"xref std std-term\">DIIS_RMS_ERROR</span>", "<span class=\"xref std std-term\">DIIS_START</span>", "<span class=\"xref std std-term\">DISTRIBUTED_MATRIX</span>", "<span class=\"xref std std-term\">E_CONVERGENCE</span>", "<span class=\"xref std std-term\">EXTERN</span>", "<span class=\"xref std std-term\">FAIL_ON_MAXITER</span>", "<span class=\"xref std std-term\">FOLLOW_STEP_INCREMENT</span>", "<span class=\"xref std std-term\">FOLLOW_STEP_SCALE</span>", "<span class=\"xref std std-term\">FRAC_DIIS</span>", "<span class=\"xref std std-term\">FRAC_LOAD</span>", "<span class=\"xref std std-term\">FRAC_OCC</span>", "<span class=\"xref std std-term\">FRAC_RENORMALIZE</span>", "<span class=\"xref std std-term\">FRAC_START</span>", "<span class=\"xref std std-term\">FRAC_VAL</span>", "<span class=\"xref std std-term\">GUESS</span>", "<span class=\"xref std std-term\">GUESS_MIX</span>", "<span class=\"xref std std-term\">GUESS_PERSIST</span>", "<span class=\"xref std std-term\">INCFOCK</span>", "<span class=\"xref std std-term\">INCFOCK_CONVERGENCE</span>", "<span class=\"xref std std-term\">INCFOCK_FULL_FOCK_EVERY</span>", "<span class=\"xref std std-term\">INTS_TOLERANCE</span>", "<span class=\"xref std std-term\">LEVEL_SHIFT</span>", "<span class=\"xref std std-term\">LEVEL_SHIFT_CUTOFF</span>", "<span class=\"xref std std-term\">LINK_INTS_TOLERANCE</span>", "<span class=\"xref std std-term\">LOCAL_CONVERGENCE</span>", "<span class=\"xref std std-term\">LOCAL_MAXITER</span>", "<span class=\"xref std std-term\">MAX_ATTEMPTS</span>", "<span class=\"xref std std-term\">MAX_MEM_BUF</span>", "<span class=\"xref std std-term\">MAXITER</span>", "<span class=\"xref std std-term\">MOLDEN_WRITE</span>", "<span class=\"xref std std-term\">MOM_OCC</span>", "<span class=\"xref std std-term\">MOM_START</span>", "<span class=\"xref std std-term\">MOM_VIR</span>", "<span class=\"xref std std-term\">NL_DISPERSION_PARAMETERS</span>", "<span class=\"xref std std-term\">ONEPOT_GRID_READ</span>", "<span class=\"xref std std-term\">ORBITALS_WRITE</span>", "<span class=\"xref std std-term\">PARALLEL</span>", "<span class=\"xref std std-term\">PERTURB_DIPOLE</span>", "<span class=\"xref std std-term\">PERTURB_H</span>", "<span class=\"xref std std-term\">PERTURB_MAGNITUDE</span>", "<span class=\"xref std std-term\">PERTURB_WITH</span>", "<span class=\"xref std std-term\">PHI_POINTS</span>", "<span class=\"xref std std-term\">PK_ALL_NONSYM</span>", "<span class=\"xref std std-term\">PK_MAX_BUCKETS</span>", "<span class=\"xref std std-term\">PRINT_BASIS</span>", "<span class=\"xref std std-term\">PRINT_MOS</span>", "<span class=\"xref std std-term\">PROCESS_GRID</span>", "<span class=\"xref std std-term\">QCHF</span>", "<span class=\"xref std std-term\">R_POINTS</span>", "<span class=\"xref std std-term\">RADIUS</span>", "<span class=\"xref std std-term\">REFERENCE</span>", "<span class=\"xref std std-term\">S_CHOLESKY_TOLERANCE</span>", "<span class=\"xref std std-term\">S_ORTHOGONALIZATION</span>", "<span class=\"xref std std-term\">S_TOLERANCE</span>", "<span class=\"xref std std-term\">SAD_CHOL_TOLERANCE</span>", "<span class=\"xref std std-term\">SAD_D_CONVERGENCE</span>", "<span class=\"xref std std-term\">SAD_E_CONVERGENCE</span>", "<span class=\"xref std std-term\">SAD_FRAC_OCC</span>", "<span class=\"xref std std-term\">SAD_MAXITER</span>", "<span class=\"xref std std-term\">SAD_PRINT</span>", "<span class=\"xref std std-term\">SAD_SCF_TYPE</span>", "<span class=\"xref std std-term\">SAD_SPIN_AVERAGE</span>", "<span class=\"xref std std-term\">SAPGAU_BASIS</span>", "<span class=\"xref std std-term\">SAPT</span>", "<span class=\"xref std std-term\">SAVE_JK</span>", "<span class=\"xref std std-term\">SAVE_UHF_NOS</span>", "<span class=\"xref std std-term\">SCF_INITIAL_ACCELERATOR</span>", "<span class=\"xref std std-term\">SCF_INITIAL_FINISH_DIIS_TRANSITION</span>", "<span class=\"xref std std-term\">SCF_INITIAL_START_DIIS_TRANSITION</span>", "<span class=\"xref std std-term\">SCF_MEM_SAFETY_FACTOR</span>", "<span class=\"xref std std-term\">SCF_PROPERTIES</span>", "<span class=\"xref std std-term\">SCF_SUBTYPE</span>", "<span class=\"xref std std-term\">SNLINK_BASIS_TOLERANCE</span>", "<span class=\"xref std std-term\">SNLINK_DENSITY_TOLERANCE</span>", "<span class=\"xref std std-term\">SNLINK_FORCE_CARTESIAN</span>", "<span class=\"xref std std-term\">SNLINK_GPU_MEM</span>", "<span class=\"xref std std-term\">SNLINK_GRID_BATCH_SIZE</span>", "<span class=\"xref std std-term\">SNLINK_INTEGRATOR_KERNEL</span>", "<span class=\"xref std std-term\">SNLINK_INTS_TOLERANCE</span>", "<span class=\"xref std std-term\">SNLINK_LOAD_BALANCER_KERNEL</span>", "<span class=\"xref std std-term\">SNLINK_LWD_KERNEL</span>", "<span class=\"xref std std-term\">SNLINK_MOL_WEIGHTS_KERNEL</span>", "<span class=\"xref std std-term\">SNLINK_PRUNING_SCHEME</span>", "<span class=\"xref std std-term\">SNLINK_RADIAL_POINTS</span>", "<span class=\"xref std std-term\">SNLINK_RADIAL_SCHEME</span>", "<span class=\"xref std std-term\">SNLINK_REDUCTION_KERNEL</span>", "<span class=\"xref std std-term\">SNLINK_SPHERICAL_POINTS</span>", "<span class=\"xref std std-term\">SNLINK_USE_DEBUG_GRID</span>", "<span class=\"xref std std-term\">SNLINK_USE_GPU</span>", "<span class=\"xref std std-term\">SOLVER_CONVERGENCE</span>", "<span class=\"xref std std-term\">SOLVER_MAXITER</span>", "<span class=\"xref std std-term\">SOLVER_N_GUESS</span>", "<span class=\"xref std std-term\">SOLVER_N_ROOT</span>", "<span class=\"xref std std-term\">SOLVER_ROOTS_PER_IRREP</span>", "<span class=\"xref std std-term\">SOSCF</span>", "<span class=\"xref std std-term\">SOSCF_CONV</span>", "<span class=\"xref std std-term\">SOSCF_MAX_ITER</span>", "<span class=\"xref std std-term\">SOSCF_MIN_ITER</span>", "<span class=\"xref std std-term\">SOSCF_PRINT</span>", "<span class=\"xref std std-term\">SOSCF_START_CONVERGENCE</span>", "<span class=\"xref std std-term\">STABILITY_ANALYSIS</span>", "<span class=\"xref std std-term\">TDSCF_COEFF_CUTOFF</span>", "<span class=\"xref std std-term\">TDSCF_GUESS</span>", "<span class=\"xref std std-term\">TDSCF_MAXITER</span>", "<span class=\"xref std std-term\">TDSCF_PRINT</span>", "<span class=\"xref std std-term\">TDSCF_R_CONVERGENCE</span>", "<span class=\"xref std std-term\">TDSCF_STATES</span>", "<span class=\"xref std std-term\">TDSCF_TDA</span>", "<span class=\"xref std std-term\">TDSCF_TDM_PRINT</span>", "<span class=\"xref std std-term\">TDSCF_TRIPLETS</span>", "<span class=\"xref std std-term\">THETA_POINTS</span>", "<span class=\"xref std std-term\">THICKNESS</span>", "<span class=\"xref std std-term\">TILE_SZ</span>", "<span class=\"xref std std-term\">UHF_NOONS</span>", "<span class=\"xref std std-term\">WCOMBINE</span>", "<span class=\"xref std std-term\">WFN</span>", "<span class=\"xref std std-term\">P</span>", "<span class=\"xref std std-term\">ROTATIONAL_SYMMETRY_NUMBER</span>", "<span class=\"xref std std-term\">T</span>", "ADC", "CCENERGY", "CFOUR", "DCT", "DDX", "DETCI", "DFMP2", "DFOCC", "DLPNO", "DMRG", "EFP", "FISAPT", "FNOCC", "GDMA", "MCSCF", "MRCC", "OCC", "OEPROP", "PCM", "PE", "PSIMRCC", "SAPT", "SCF", "THERMO", "BAKERJCC96", "&lt;no title&gt;", "&lt;no title&gt;", "&lt;no title&gt;", "&lt;no title&gt;", "&lt;no title&gt;", "&lt;no title&gt;", "&lt;no title&gt;", "&lt;no title&gt;", "&lt;no title&gt;", "&lt;no title&gt;", "&lt;no title&gt;", "Keywords by Alpha", "Keywords by Module", "Physical Constants", "&lt;no title&gt;", "PSIOH Intermediate Files", "PSI Variables by Module", "BRIANQC", "CFOUR", "CHEMPS2", "COOKBOOK", "&lt;no title&gt;", "DFTD3", "DFTD4", "DKH", "GCP", "GDMA", "GPU_DFCC", "JSON", "LIBEFP", "MRCC", "PCMSOLVER", "PSI4NUMPY", "PYTHON", "SIMINT", "SNSMP2", "V2RDM_CASSCF", "Basis Sets", "Basis Sets by Element", "Auxiliary Basis Sets", "Basis Sets by Family", "Bibliography", "Interface to the BrianQC GPU module by the BrianQC team", "Build &amp; Run FAQ", "Obtaining <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>", "Compiling and Installing from Source", "Capabilities and Alternate Implementations", "Complete Basis Set", "&lt;no title&gt;", "CC: Coupled Cluster Theory", "Interface to CFOUR by J. Stanton &amp; J. Gauss", "&lt;no title&gt;", "&lt;no title&gt;", "Interface to CheMPS2 by S. Wouters", "Code style conventions", "Conda Binary Distribution", "Interface to CPPE by M. Scheurer", "Generation of Cube Files \u2014 <code class=\"xref py py-func docutils literal notranslate\"><span class=\"pre\">cubeprop()</span></code>", "Customization: Adding Simple Extensions", "Database \u2014 <code class=\"xref py py-func docutils literal notranslate\"><span class=\"pre\">database()</span></code>", "DCT: Density Cumulant Theory", "Interface to ddx by A. Mikhalev, A. Jha, M. Nottoli and M. F. Herbst", "CI: Configuration Interaction", "DF-MP2: Density-Fitted 2nd-Order M\u00f8ller\u2013Plesset Perturbation Theory", "DFT: Density Functional Theory", "DFT Functionals", "Interface to DFTD3 by S. Grimme", "DFT-NL", "Spectroscopic Constants for Diatomics", "Interface to DKH by A. Wolf, M. Reiher, and B. A. Hess", "DLPNO-MP2: Domain-Based Local Pair Natural Orbital MP2", "Updating the <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span> Users\u2019 and Programmers\u2019 Manual", "Interface to LibECPInt by R. Shaw", "Single-Point Energy \u2014 <code class=\"xref py py-func docutils literal notranslate\"><span class=\"pre\">energy()</span></code>", "Installation and Runtime Configuration", "External API Objects", "Interface to programs through FCHK files \u2014 <code class=\"xref py py-func docutils literal notranslate\"><span class=\"pre\">fchk()</span></code>", "F/I-SAPT: Functional Group and/or Intramolecular SAPT", "FNOCC: Frozen natural orbitals for CCSD(T), QCISD(T), CEPA, and MP4", "Harmonic Vibrational Analysis and Visualization of Normal Modes \u2014 <code class=\"xref py py-func docutils literal notranslate\"><span class=\"pre\">frequency()</span></code> and <code class=\"xref py py-func docutils literal notranslate\"><span class=\"pre\">hessian()</span></code>", "Interface to gau2grid by D. G. A. Smith", "Interface to gCP by S. Grimme", "Interface to GDMA Distributed Multipole Analysis by A. J. Stone \u2014 <code class=\"xref py py-func docutils literal notranslate\"><span class=\"pre\">gdma()</span></code>", "PSI Variables by Alpha", "<span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>: Open-Source Quantum Chemistry", "A <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span> Tutorial", "Function Intercalls", "Interfaces: Enhancing <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span> Capabilities", "Introduction", "Interface to LIBEFP by I. Kaliman", "Interface to Libint by E. Valeev", "Interface to Libxc by M. A. L. Marques", "Adding Add-Ons", "Git, Versioning", "Managing: Git, Conda, CMake and all that", "Release Procedures", "MCSCF: Multi-Configurational Self-Consistent-Field", "Theoretical Methods: SCF to FCI", "Interface to Molden \u2014 <code class=\"xref py py-func docutils literal notranslate\"><span class=\"pre\">molden()</span></code>", "Interface to MRCC by M. K\u00e1llay", "&lt;no title&gt;", "Basis Set Superposition Corrections", "Notes on Options", "Notes on Options", "Interface to NumPy", "OCC: Orbital-Optimized Coupled-Cluster and M\u00f8ller\u2013Plesset Perturbation Theories", "Evaluation of One-Electron Properties \u2014 <code class=\"xref py py-func docutils literal notranslate\"><span class=\"pre\">oeprop()</span></code>", "Geometry Optimization \u2014 <code class=\"xref py py-func docutils literal notranslate\"><span class=\"pre\">optimize()</span></code> and <code class=\"xref py py-func docutils literal notranslate\"><span class=\"pre\">gradient()</span></code>", "LibOptions: globals, locals, has_changed and all that", "Geometry Optimization", "Interface to PCMSolver by R. Di Remigio", "PEP1: Proposing PsiPEP for <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>", "Psi4FockCI: A General Fock-Space CI For Spin-Flip And IP/EA", "Spin-Network-Scaled MP2 (SNS-MP2) by D. E. Shaw", "Plugin v2rdm_casscf by A. E. DePrince", "Creating New Plugins", "Adding Methods to Driver", "Linear Algebra in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>", "Community Code of Conduct", "Programming with the Core Libraries", "Debugging and Profiling", "Programmers FAQ", "Integrating New Features into <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>", "Where to Get Help", "Integrals in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>", "Introduction to Programming in <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>", "Adding New Code to <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>", "Setting Up Your Development Environment", "C++ Style", "Python Style", "General layout of the core: where new C++ code should live", "Ways to Add Code: Psi4NumPy, Plugins, Full Integration", "Welcome to New Programmers", "Property", "<span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span> API: Linking C++ and Python", "PsiAPI Tutorial: Using Psi4 as a Python Module", "PSIMRCC Implementation of Mk-MRCC Theory", "PsiPEP: Plans and Practices to Organize <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span>", "Psithon Functions: Invoking a Calculation", "Psithon: Structuring an Input File", "Molecule and Geometry Specification", "Defining a Method Alias", "Creating a Database", "Scalar relativistic Hamiltonians", "SAPT: Symmetry-Adapted Perturbation Theory", "HF: Hartree\u2013Fock Theory", "Interface to SIMINT by B. Pritchard", "Embarrassing Parallelism", "TDSCF: Time-dependent Hartree\u2013Fock and density-functional theory", "Test Suite and Sample Inputs", "Vibrational and Thermochemical Analysis", "Psithon Tutorial: Using <span style=\"font-family: Optima, sans-serif; text-transform: none;\">P<span style=\"font-size: 82%;\">SI</span>4</span> as an Executable"], "titleterms": {"": [884, 1210, 1735, 1738, 1746, 1759, 1774, 1785, 1837], "0": 1821, "1": [1733, 1770, 1838], "2": 1788, "2nd": 1756, "3": 1788, "3rc1": 1788, "4": [1694, 1695, 1696, 1697, 1699, 1700, 1701, 1702, 1706, 1707, 1708, 1731, 1732, 1733, 1735, 1736, 1737, 1738, 1739, 1742, 1743, 1746, 1748, 1758, 1764, 1777, 1778, 1780, 1781, 1797, 1799, 1802, 1804, 1810, 1814, 1815, 1816, 1817, 1818, 1819, 1824, 1825, 1827, 1830, 1833, 1838, 1844], "8": 1788, "82": [1694, 1695, 1696, 1697, 1699, 1700, 1701, 1702, 1706, 1707, 1708, 1731, 1732, 1733, 1735, 1736, 1737, 1739, 1742, 1743, 1746, 1748, 1758, 1764, 1777, 1778, 1780, 1781, 1797, 1799, 1802, 1804, 1810, 1814, 1815, 1816, 1817, 1818, 1819, 1824, 1825, 1827, 1830, 1833, 1838, 1844], "9": 1738, "A": [1754, 1762, 1770, 1773, 1775, 1778, 1784, 1805, 1807, 1829, 1836, 1837], "And": 1805, "For": 1805, "In": 1730, "NO": 1837, "No": 1738, "On": [1738, 1785, 1788], "One": [1799, 1817], "Ons": 1785, "The": [1764, 1817, 1825, 1837], "_py_falsestruct": 1738, "a24": [1692, 1752], "a24alt": [1692, 1752], "a_ras3_max": [782, 1210], "ab": 0, "abcd": [428, 465, 512, 535, 1199, 1200, 1202, 1203], "absorpt": 1841, "access": [1771, 1772, 1798, 1817], "acen": [1692, 1752], "activ": [281, 1102, 1221], "active_nat_orb": [1065, 1219], "actual": 1738, "ad": [2, 1751, 1770, 1785, 1809, 1819], "adapt": [1781, 1837], "adc": [0, 1197, 1668, 1781], "adcc": [0, 1], "add": [1738, 1785, 1824], "add_auxiliary_bond": [1226, 1298], "addit": 1770, "address": 1817, "advanc": [1757, 1770, 1771, 1798, 1833, 1837], "after": 1738, "aio_cphf": [1230, 1435, 1837], "aio_df_int": [1230, 1436, 1837], "aka": 400, "algebra": [1781, 1810], "algorithm": [726, 1208, 1210, 1226, 1231, 1739, 1742, 1753, 1756, 1757, 1771, 1781, 1798, 1817, 1838], "alia": 1834, "alias": 1740, "all": [1758, 1787, 1801], "all_cas": 330, "allow": 1799, "alpha": [1704, 1776], "altern": [1210, 1739], "an": [1748, 1785, 1786, 1832, 1844], "ana": 1748, "anaconda": 1738, "analysi": [1770, 1772, 1775, 1828, 1838, 1843, 1844], "analyt": [1739, 1742, 1753, 1756, 1757, 1771, 1781, 1798], "analyz": [429, 536, 1199, 1203], "angular": 1738, "angularmomentumint": 4, "annot": 1786, "annual": 1788, "anticip": 1788, "ao": 1810, "ao_basi": [411, 430, 513, 557, 727, 1198, 1199, 1202, 1204, 1208], "aoshellcombinationsiter": 3, "api": [1740, 1768, 1772, 1794, 1827], "appendic": 400, "appli": 1747, "approach": 1808, "approv": 1738, "approxim": [1771, 1837], "ar": 1738, "arbitrari": 1755, "arrai": 1797, "array_to_matrix": 331, "array_vari": [151, 152], "ascii": 1786, "assembl": 1788, "atom": 1833, "atomiccomput": 265, "author": 1788, "auto": 1821, "auxiliari": [1694, 1708, 1732], "auxiliary_bond_factor": [1226, 1299], "avail": [0, 1695, 1696, 1697, 1699, 1700, 1701, 1702, 1707, 1731, 1733, 1738, 1752, 1758, 1781, 1802, 1817, 1838], "avg_stat": [783, 1210], "avg_weight": [784, 1210], "avoid": 1824, "b": [1762, 1839], "b_ras3_max": [785, 1210], "bakerjcc93": [1692, 1752], "bakerjcc96": [1692, 1752], "banner": [282, 332], "base": [1754, 1763, 1810], "basi": [400, 898, 1195, 1212, 1223, 1230, 1231, 1437, 1484, 1694, 1707, 1730, 1731, 1732, 1733, 1738, 1740, 1771, 1794, 1799, 1832, 1836, 1837], "basic": [1692, 1742, 1752, 1755, 1771, 1789, 1797, 1798, 1799, 1802, 1828, 1837, 1844], "basis_guess": [1231, 1485], "basis_help": [283, 333], "basis_relativist": [1103, 1221, 1836], "basisext": 6, "basisfunct": 7, "basisset": 8, "bbi": [1692, 1752], "bccd_maxit": [431, 1199], "be_quiet": 153, "befor": 1788, "bench": [1104, 1221], "bench12": [1692, 1752], "benchmark_blas1": 154, "benchmark_blas2": 155, "benchmark_blas3": 156, "benchmark_disk": 157, "benchmark_integr": 158, "benchmark_math": 159, "bendazzoli": [786, 1210], "bibliographi": 1734, "binari": [1736, 1737, 1748, 1808], "bla": [1738, 1810], "block": 1817, "block_diagonal_arrai": 334, "blockopoint": 9, "bodi": [1759, 1771], "bond": [1833, 1837], "border": [1228, 1378, 1749], "border_n_redist": [1228, 1379, 1749], "border_redist_ord": [1228, 1380, 1749], "border_redist_pol": [1228, 1381, 1749], "border_rmin": [1228, 1382, 1749], "border_rmin_unit": [1228, 1383, 1749], "border_typ": [1228, 1384, 1749], "bot": 1822, "boysloc": 10, "bra": 1817, "branch": 1788, "brianqc": [1710, 1735], "brianqc_en": [1105, 1221, 1735], "broken": 1838, "brueckner_maxit": [1066, 1219], "brueckner_orbs_r_converg": [432, 1199, 1742], "bsvec": 5, "buffer": 1817, "bug": 1816, "build": [1, 1735, 1736, 1738, 1746, 1749, 1754, 1762, 1765, 1773, 1775, 1782, 1783, 1784, 1785, 1788, 1803, 1839], "built": [1730, 1735], "bump": 1786, "c": [1738, 1814, 1821, 1823, 1827], "cachelevel": [412, 433, 466, 507, 514, 537, 558, 728, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1208, 1225, 1242, 1742], "cachetyp": [434, 467, 1199, 1200, 1742], "calc_s_squar": [787, 1210], "calcul": [0, 1742, 1828, 1831, 1838, 1844], "call": [1810, 1817], "cannot": 1786, "canonicalize_active_favg": [1171, 1222], "canonicalize_inactive_favg": [1172, 1222], "capabl": [0, 1738, 1739, 1742, 1746, 1756, 1757, 1771, 1780, 1781, 1798, 1799], "cart_hess_read": [1226, 1300], "cartesian_sym_toler": [1226, 1301], "case": 2, "caviti": 1754, "cb": 284, "cc": [788, 1210, 1742, 1781, 1785], "cc3_follow_root": [468, 1200], "cc_a_ras3_max": [789, 1210], "cc_b_ras3_max": [790, 1210], "cc_diis_max_vec": [911, 1213], "cc_diis_min_vec": [912, 1213], "cc_ex_level": [791, 1210], "cc_fix_extern": [792, 1210], "cc_fix_external_min": [793, 1210], "cc_lambda": [913, 1213], "cc_macro": [794, 1210], "cc_maxit": [914, 1213, 1225, 1243], "cc_mix": [795, 1210], "cc_num_thread": [435, 469, 564, 1199, 1200, 1205, 1229, 1397], "cc_os_scal": [436, 1199], "cc_ras34_max": [796, 1210], "cc_ras3_max": [797, 1210], "cc_ras4_max": [798, 1210], "cc_scale_o": [1067, 1219, 1771], "cc_scale_ss": [1068, 1219, 1771], "cc_ss_scale": [437, 1199], "cc_time": [1069, 1219, 1771], "cc_type": [1106, 1221, 1739, 1742, 1756, 1757, 1771, 1781, 1798], "cc_update_ep": [799, 1210], "cc_val_ex_level": [800, 1210], "cc_variat": [801, 1210], "cc_vecs_read": [802, 1210], "cc_vecs_writ": [803, 1210], "ccd_e_converg": [1230, 1438], "ccd_maxit": [1230, 1439], "ccd_t_converg": [1230, 1440], "ccdensiti": [160, 1198], "ccenergi": [161, 1199, 1669, 1742], "cceom": [162, 1200], "cchbar": [163, 1201], "ccl_energi": [1225, 1244], "cclambda": [164, 1202], "cclr": 1742, "ccrespons": [165, 1203], "ccsd": 1771, "cctransort": [166, 1204], "cctripl": [167, 1205], "ccwavefunct": 11, "cdsalc": 15, "cdsalclist": 16, "center": 1837, "cepa": 1771, "cepa_level": [1070, 1219, 1771], "cepa_no_singl": [1071, 1219, 1771], "cepa_os_scal": [1225, 1245], "cepa_sos_scal": [1225, 1246], "cepa_ss_scal": [1225, 1247], "cepa_typ": [1225, 1248], "cfour": [1206, 1670, 1711, 1743], "cfour_abcdtyp": [568, 1206], "cfour_active_orbi": [569, 1206], "cfour_anh_algorithm": [570, 1206], "cfour_anh_deriv": [571, 1206], "cfour_anh_steps": [572, 1206], "cfour_anh_symmetri": [573, 1206], "cfour_anharmon": [574, 1206], "cfour_ao_ladd": [575, 1206], "cfour_av_scf": [576, 1206], "cfour_basi": [577, 1206], "cfour_bruck_conv": [578, 1206], "cfour_brueckn": [579, 1206], "cfour_cache_rec": [580, 1206], "cfour_calc_level": [581, 1206], "cfour_cc_conv": [582, 1206], "cfour_cc_expord": [583, 1206], "cfour_cc_extrapol": [584, 1206], "cfour_cc_maxcyc": [585, 1206], "cfour_cc_program": [586, 1206], "cfour_charg": [587, 1206], "cfour_cis_conv": [588, 1206], "cfour_continuum": [589, 1206], "cfour_contract": [590, 1206], "cfour_converg": [591, 1206], "cfour_coordin": [592, 1206], "cfour_core_orbit": [593, 1206], "cfour_cphf_conv": [594, 1206], "cfour_cphf_maxcyc": [595, 1206], "cfour_curvilinear": [596, 1206], "cfour_dboc": [597, 1206], "cfour_dct": [598, 1206], "cfour_deriv_level": [599, 1206], "cfour_diff_typ": [600, 1206], "cfour_dropmo": [601, 1206], "cfour_ecp": [602, 1206], "cfour_eigenvector": [603, 1206], "cfour_el_anharm": [604, 1206], "cfour_eom_nonit": [605, 1206], "cfour_estate_conv": [606, 1206], "cfour_estate_maxcyc": [607, 1206], "cfour_estate_prop": [608, 1206], "cfour_estate_sym": [609, 1206], "cfour_estate_tran": [610, 1206], "cfour_eval_hess": [611, 1206], "cfour_excit": [612, 613, 1206], "cfour_fc_field": [614, 1206], "cfour_fd_calctyp": [615, 1206], "cfour_fd_irrep": [616, 1206], "cfour_fd_project": [617, 1206], "cfour_fd_steps": [618, 1206], "cfour_fd_usegroup": [619, 1206], "cfour_file_recsiz": [620, 1206], "cfour_file_strip": [621, 1206], "cfour_finite_perturb": [622, 1206], "cfour_fock": [623, 1206], "cfour_freq_algorithm": [624, 1206], "cfour_frozen_cor": [625, 1206], "cfour_frozen_virt": [626, 1206], "cfour_gamma_abcd": [627, 1206], "cfour_genbas_1": [628, 1206], "cfour_genbas_2": [629, 1206], "cfour_genbas_3": [630, 1206], "cfour_genbas_4": [631, 1206], "cfour_geo_conv": [632, 1206], "cfour_geo_maxcyc": [633, 1206], "cfour_geo_maxstep": [634, 1206], "cfour_geo_method": [635, 1206], "cfour_giao": [636, 1206], "cfour_grid": [637, 1206], "cfour_guess": [638, 1206], "cfour_hbar": [639, 1206], "cfour_hfstabl": [640, 1206], "cfour_incor": [641, 1206], "cfour_input_mrcc": [642, 1206], "cfour_integr": [643, 1206], "cfour_joda_print": [644, 1206], "cfour_lineq_conv": [645, 1206], "cfour_lineq_maxci": [646, 1206], "cfour_lineq_typ": [647, 1206], "cfour_lock_orbocc": [648, 1206], "cfour_maxstep": [649, 1206], "cfour_mem_unit": [650, 1206], "cfour_memory_s": [651, 1206], "cfour_method": [652, 1206], "cfour_mrcc": [653, 1206], "cfour_multipl": [654, 1206], "cfour_nacoupl": [655, 1206], "cfour_negev": [656, 1206], "cfour_newnorm": [657, 1206], "cfour_nonhf": [658, 1206], "cfour_ntop_tamp": [659, 1206], "cfour_occup": [660, 1206], "cfour_omp_num_thread": [661, 1206], "cfour_open": [662, 1206], "cfour_opt_maxcyc": [663, 1206], "cfour_orbit": [664, 1206], "cfour_pert_orb": [665, 1206], "cfour_point": [666, 1206], "cfour_print": [667, 1206], "cfour_prop": [669, 1206], "cfour_prop_integr": [668, 1206], "cfour_qrhf_gener": [670, 1206], "cfour_qrhf_orbit": [671, 1206], "cfour_qrhfgu": [672, 1206], "cfour_raman_int": [673, 1206], "cfour_raman_orb": [674, 1206], "cfour_rdo": [675, 1206], "cfour_refer": [676, 1206], "cfour_relativist": [677, 1206], "cfour_relax_den": [678, 1206], "cfour_res_raman": [679, 1206], "cfour_restart_cc": [680, 1206], "cfour_rot_evec": [681, 1206], "cfour_save_int": [682, 1206], "cfour_scale_on": [683, 1206], "cfour_scf_conv": [684, 1206], "cfour_scf_damp": [685, 1206], "cfour_scf_expord": [686, 1206], "cfour_scf_expstart": [687, 1206], "cfour_scf_extrapol": [688, 1206], "cfour_scf_maxcyc": [689, 1206], "cfour_sd_field": [690, 1206], "cfour_spher": [691, 1206], "cfour_spin_flip": [692, 1206], "cfour_spin_orbit": [693, 1206], "cfour_spin_sc": [694, 1206], "cfour_spinrot": [695, 1206], "cfour_subgroup": [696, 1206], "cfour_sym_check": [697, 1206], "cfour_symmetri": [698, 1206], "cfour_t3_extrapol": [699, 1206], "cfour_tamp_sum": [700, 1206], "cfour_thermochemistri": [701, 1206], "cfour_trans_inv": [702, 1206], "cfour_treat_pert": [703, 1206], "cfour_uij_threshold": [704, 1206], "cfour_unit": [705, 1206], "cfour_update_hessian": [706, 1206], "cfour_vibr": [707, 1206], "cfour_vtran": [708, 1206], "cfour_xfield": [709, 1206], "cfour_xform_tol": [710, 1206], "cfour_yfield": [711, 1206], "cfour_zfield": [712, 1206], "cg_solver": 335, "chang": [1788, 1802, 1817], "channel": 1788, "charact": 1786, "charactert": 17, "charg": [1770, 1837], "chemistri": 1777, "chemps2": [1712, 1746], "choleski": [915, 1213], "cholesky_toler": [916, 1072, 1213, 1219, 1231, 1486, 1771], "choos": 1738, "ci": [1755, 1781, 1805], "ci_dii": [1173, 1222], "ci_file_start": [804, 1210], "ci_maxit": [805, 1210, 1755], "ci_num_thread": [806, 1210], "ci_typ": [1107, 1221], "ciblks_print": [807, 1210], "circular": 1841, "cite": 1781, "civector": 12, "ciwavefunct": 13, "clang": 1747, "class": [1821, 1827], "clean": 168, "clean_opt": 169, "clean_tim": 170, "clean_vari": 171, "clone": 1737, "close_outfil": 172, "cluster": [1210, 1742, 1755, 1771, 1781, 1798], "cmake": [1738, 1787], "cmakelist": 2, "code": [1736, 1737, 1738, 1747, 1786, 1811, 1819, 1823, 1824], "codebas": [1764, 1786], "collapse_s": [808, 1210], "collapse_with_last": [470, 1200], "collapse_with_last_cc3": [471, 1200], "collect": 1788, "command": [1738, 1748, 1767], "comment": 1804, "commun": [1811, 1825], "compact": 1738, "compare_fchkfil": [285, 336], "compare_fcidump": [286, 337], "compare_moldenfil": [287, 338], "compare_vibinfo": 383, "comparison": 2, "compil": [1738, 1748, 1808], "complet": [1740, 1823], "complex_toler": [472, 1200], "compon": [1735, 1798], "compositejk": 18, "comput": [1755, 1770, 1789, 1837], "comput_s2": [917, 1213], "compute_mp4_tripl": [1073, 1219, 1771], "compute_shel": 1817, "compute_tripl": [1074, 1219, 1771], "conda": [1737, 1738, 1748, 1787, 1788, 1808], "conduct": 1811, "configur": [1, 1736, 1738, 1746, 1749, 1754, 1755, 1762, 1765, 1767, 1771, 1773, 1775, 1781, 1782, 1783, 1784, 1789, 1803, 1839], "conflict": 1738, "consecutive_backstep": [1226, 1302], "consist": 1789, "constant": [1706, 1761, 1832], "constrain": 1802, "construct": [1781, 1838], "consum": 1823, "contain": 1748, "content": [2, 1777], "continum": 1754, "continuum": 1803, "contribut": 1747, "control": [1206, 1226, 1231, 1832, 1837], "convent": [1747, 1798], "converg": [1226, 1231, 1798, 1802, 1838], "convergenceerror": 266, "cookbook": 1713, "coordin": [1226, 1802, 1833], "copy_file_from_scratch": [288, 339], "copy_file_to_scratch": [289, 340], "copyright": 1788, "core": [1692, 1730, 1752, 1772, 1786, 1810, 1812, 1823, 1827, 1838], "corr_ansatz": [1229, 1398], "corr_ccsd_t": [1229, 1399], "corr_charg": [1229, 1400], "corr_multp": [1229, 1401], "corr_wfn": [1229, 1402], "correct": [1697, 1701, 1757, 1758, 1759, 1781, 1794, 1828, 1844], "correlationfactor": 19, "correlationt": 20, "cosx": [1231, 1838], "cosx_basis_toler": [1231, 1487], "cosx_density_toler": [1231, 1488], "cosx_ints_toler": [1231, 1489], "cosx_maxiter_fin": [1231, 1490], "cosx_overlap_fit": [1231, 1491], "cosx_pruning_schem": [1231, 1492], "cosx_radial_points_fin": [1231, 1493], "cosx_radial_points_initi": [1231, 1494], "cosx_spherical_points_fin": [1231, 1495], "cosx_spherical_points_initi": [1231, 1496], "coulomb": 1838, "counter": 1788, "counterpois": [1828, 1844], "coupl": [1210, 1229, 1403, 1742, 1755, 1771, 1781, 1798], "coupled_induct": [1230, 1441, 1837], "coupling_term": [1229, 1404], "coval": 1833, "covalent_connect": [1226, 1303], "cphf": 1207, "cphf_mem_safety_factor": [714, 1207], "cphf_r_converg": [1029, 1218, 1230, 1442, 1837], "cphf_task": [715, 1207], "cpp": 1802, "cppe": 1749, "crai": 1738, "creat": [1786, 1808, 1835], "create_plugin": 290, "criteria": [1802, 1838], "ctest": [2, 1738], "cube": [1750, 1770], "cubeprop": [291, 341, 1750], "cubeprop_basis_funct": [1108, 1221, 1750], "cubeprop_filepath": [1109, 1221, 1750], "cubeprop_isocontour_threshold": [1110, 1221], "cubeprop_orbit": [1111, 1221, 1750], "cubeprop_task": [1112, 1221, 1750], "cubeproperti": 21, "cubic_basis_toler": [1030, 1113, 1218, 1221], "cubic_block_max_point": [1031, 1114, 1218, 1221], "cubic_grid_overag": [1032, 1115, 1218, 1221, 1750], "cubic_grid_spac": [1033, 1116, 1218, 1221, 1750], "cuhf": 14, "cumul": [1753, 1781], "current": [1742, 1799], "curv": 1757, "custom": 1751, "custom_coord": [1226, 1304], "cutoff": [918, 1213, 1225, 1249], "cutoff_amps_print": [0, 1, 401, 1197], "d": [1773, 1806, 1837], "d_converg": [1174, 1222, 1231, 1497], "damp_induc": [1228, 1385], "damp_multipol": [1228, 1386], "damping_converg": [1231, 1498], "damping_factor_induc": [1228, 1387], "damping_factor_multipol": [1228, 1388], "damping_percentag": [729, 1208, 1229, 1231, 1405, 1499], "dasum": 22, "dat": 2, "data": [2, 1797], "databas": [1752, 1833, 1835], "davidson_solv": 342, "daxpi": 23, "dcopi": 24, "dct": [173, 1208, 1671, 1753, 1781], "dct_function": [730, 1208], "dct_guess": [731, 1208], "dct_type": [732, 1208], "dd": 1754, "ddot": 25, "ddx": [1117, 1209, 1221, 1672, 1754], "ddx_diis_max_vec": [760, 1209, 1754], "ddx_eta": [761, 1209, 1754], "ddx_fmm": [762, 1209, 1754], "ddx_fmm_local_lmax": [763, 1209, 1754], "ddx_fmm_multipole_lmax": [764, 1209, 1754], "ddx_incor": [765, 1209, 1754], "ddx_lmax": [766, 1209, 1754], "ddx_logfil": [767, 1209, 1754], "ddx_maxit": [768, 1209, 1754], "ddx_model": [769, 1209, 1754], "ddx_n_lebedev": [770, 1209, 1754], "ddx_radii": [771, 1209, 1754], "ddx_radii_sc": [772, 1209, 1754], "ddx_radii_set": [773, 1209, 1754], "ddx_shift": [774, 1209, 1754], "ddx_solute_radial_point": [775, 1209, 1754], "ddx_solute_spherical_point": [776, 1209, 1754], "ddx_solvation_converg": [777, 1209, 1754], "ddx_solvent": [778, 1209, 1754], "ddx_solvent_epsilon": [779, 1209, 1754], "ddx_solvent_epsilon_opt": [780, 1209], "ddx_solvent_kappa": [781, 1209, 1754], "deal": 1802, "debug": [2, 413, 716, 1118, 1198, 1207, 1221, 1736, 1738, 1813, 1837], "declar": [1801, 1821], "decontract": 1730, "default": [1694, 1732, 1739, 1742, 1756, 1757, 1771, 1781, 1798, 1838], "defin": [1730, 1834], "definit": 1754, "del_array_vari": 174, "del_scalar_vari": 175, "del_vari": 176, "delete_tei": [559, 1204], "denominator_algorithm": [1230, 1443, 1837], "denominator_delta": [1230, 1444, 1837], "densiti": [1210, 1746, 1753, 1756, 1757, 1771, 1781, 1817, 1838, 1841], "depend": [1736, 1738, 1841], "deprinc": 1807, "deriv": [61, 1739, 1781, 1817, 1821], "derivcalctyp": 62, "dertyp": [1011, 1119, 1216, 1221], "detail": [1738, 1739, 1742, 1743, 1748, 1756, 1757, 1771, 1792, 1798], "detci": [177, 1210, 1673, 1755], "detci_freeze_cor": [809, 1210], "dev": 1748, "develop": [1738, 1808, 1820, 1824], "df": 1756, "df_basis_cc": [1075, 1120, 1219, 1221, 1771], "df_basis_dct": [733, 1208], "df_basis_elst": [1230, 1445, 1837], "df_basis_ep2": [892, 1211], "df_basis_guess": [1231, 1500], "df_basis_mcscf": [810, 1210], "df_basis_mp2": [899, 963, 1212, 1214], "df_basis_sad": [1231, 1501], "df_basis_sapt": [1230, 1446, 1837], "df_basis_scf": [717, 1207, 1231, 1502], "df_bump_r0": [1231, 1503], "df_bump_r1": [1231, 1504], "df_domain": [1231, 1505], "df_fitting_condit": [1231, 1506], "df_ints_io": [900, 1212, 1231, 1507], "df_ints_num_thread": [901, 1212, 1231, 1508], "df_metric": [1231, 1509], "df_scf_guess": [1231, 1510], "df_theta": [1231, 1511], "dfcc": [1076, 1219, 1771], "dfep2": 1211, "dfep2wavefunct": 26, "dfhelper": 27, "dfmp2": [178, 1212, 1674, 1756], "dfmp2_mem_factor": [902, 1212], "dfmp2_p2_toler": [903, 1212], "dfmp2_p_toler": [904, 1212], "dfocc": [179, 1213, 1675, 1798], "dfscf": 1231, "dfsomcscf": 28, "dft": [1230, 1231, 1695, 1757, 1758, 1760, 1837], "dft_alpha": [1231, 1512], "dft_alpha_c": [1231, 1513], "dft_basis_toler": [1231, 1514], "dft_block_max_point": [1231, 1515], "dft_block_max_radiu": [1231, 1516], "dft_block_min_point": [1231, 1517], "dft_block_schem": [1231, 1518], "dft_bs_radius_alpha": [1231, 1519], "dft_density_toler": [1231, 1520], "dft_dispersion_paramet": [1231, 1521], "dft_grac_alpha": [1231, 1522], "dft_grac_beta": [1231, 1523], "dft_grac_c_func": [1231, 1524], "dft_grac_shift": [1231, 1525], "dft_grac_x_func": [1231, 1526], "dft_grid_nam": [1231, 1527], "dft_nuclear_schem": [1231, 1528], "dft_omega": [1231, 1529], "dft_omega_c": [1231, 1530], "dft_pruning_alpha": [1231, 1531], "dft_pruning_schem": [1231, 1532], "dft_radial_point": [1231, 1533], "dft_radial_schem": [1231, 1534], "dft_remove_distant_point": [1231, 1535], "dft_spherical_point": [1231, 1536], "dft_spherical_schem": [1231, 1537], "dft_v2_rho_cutoff": [1231, 1538], "dft_vv10_b": [1231, 1539], "dft_vv10_c": [1231, 1540], "dft_vv10_postscf": [1231, 1541], "dft_vv10_radial_point": [1231, 1542], "dft_vv10_rho_cutoff": [1231, 1543], "dft_vv10_spherical_point": [1231, 1544], "dft_weights_toler": [1231, 1545], "dftd3": [1715, 1759], "dftd4": [1716, 1759], "dftensor": 30, "dftgrid": 29, "dgbmv": 31, "dgeev": 32, "dgemm": 33, "dgemv": 34, "dger": 35, "dgetr": 38, "dgetrf": 36, "dgetri": 37, "di": 1803, "diag_method": [811, 1210, 1755], "diagon": 1210, "diagonal_ccsd_t": [1229, 1406], "diagonalize_heff": [1229, 1407], "diagonalizeord": 63, "diagram": 1827, "diagrammat": 1781, "diatom": 1761, "dichroism": 1841, "die_if_not_converg": [1121, 1221], "differ": [1739, 1770, 1781], "diffus": 1733, "dii": [321, 438, 515, 538, 812, 1175, 1199, 1202, 1203, 1210, 1222, 1231, 1546], "diis_freq": [813, 1210], "diis_max_vec": [734, 814, 1077, 1176, 1208, 1210, 1219, 1222, 1225, 1229, 1231, 1250, 1408, 1547, 1771], "diis_min_vec": [735, 815, 1208, 1210, 1225, 1231, 1251, 1548], "diis_rms_error": [1231, 1549], "diis_start": [1229, 1231, 1409, 1550], "diis_start_converg": [736, 1208], "diis_start_it": [816, 1210], "dimens": [64, 1810], "dimer": 1802, "dipmom": [817, 1078, 1210, 1219, 1755, 1771], "dipoleint": 65, "dir": [1737, 1786], "direct": [1821, 1838], "directjk": 66, "directori": [1738, 1785, 1808], "discretis": 1754, "disksomcscf": 67, "disp_siz": [1023, 1217], "dispers": [68, 1697, 1757, 1758, 1759], "distribut": [1748, 1775, 1785], "distributed_matrix": [1231, 1551], "dkh": [1717, 1762], "dkh_order": [1122, 1221, 1762], "dlpno": [180, 1214, 1676, 1763], "dlpno_algorithm": [964, 1214], "dlpno_local_orbit": [965, 1214], "dlpno_maxit": [966, 1214], "dmrg": [181, 1215, 1677, 1746, 1781], "dmrg_caspt2_calc": [986, 1215, 1746], "dmrg_caspt2_imag": [987, 1215, 1746], "dmrg_caspt2_ipea": [988, 1215, 1746], "dmrg_caspt2_orb": [989, 1215, 1746], "dmrg_dii": [990, 1215, 1746], "dmrg_diis_writ": [991, 1215, 1746], "dmrg_excit": [992, 1215, 1746], "dmrg_irrep": [993, 1215, 1746], "dmrg_local_init": [994, 1215, 1746], "dmrg_molden_writ": [995, 1215, 1746], "dmrg_mps_write": [996, 1215, 1746], "dmrg_multipl": [997, 1215, 1746], "dmrg_opdm_ao_print": [998, 1215, 1746], "dmrg_print_corr": [999, 1215, 1746], "dmrg_scf_active_spac": [1000, 1215, 1746], "dmrg_scf_diis_thr": [1001, 1215, 1746], "dmrg_scf_grad_thr": [1002, 1215, 1746], "dmrg_scf_max_it": [1003, 1215, 1746], "dmrg_scf_state_avg": [1004, 1215, 1746], "dmrg_sweep_dvdson_rtol": [1005, 1215, 1746], "dmrg_sweep_energy_conv": [1006, 1215, 1746], "dmrg_sweep_max_sweep": [1007, 1215, 1746], "dmrg_sweep_noise_prefac": [1008, 1215, 1746], "dmrg_sweep_stat": [1009, 1215, 1746], "dmrg_unitary_writ": [1010, 1215, 1746], "dnrm2": 39, "do": [1738, 1748, 1786, 1788], "do_ccd_disp": [1230, 1447, 1837], "do_dii": [919, 1213, 1225, 1252, 1798], "do_disp_exch_sinf": [1230, 1448, 1837], "do_ind30_exch_sinf": [1230, 1449, 1837], "do_ind_exch_sinf": [1230, 1450, 1837], "do_level_shift": [920, 1213, 1225, 1253, 1798], "do_mbpt_disp": [1230, 1451, 1837], "do_sc": [921, 1213, 1225, 1254], "do_so": [922, 1213, 1225, 1255], "do_third_ord": [1230, 1452, 1837], "doc": 1785, "docc": [1123, 1177, 1221, 1222, 1810], "docker": 1788, "docs_table_link": [292, 343], "document": [1764, 1788], "doi": 1214, "doi_basis_toler": [967, 1214], "doi_pruning_schem": [968, 1214], "doi_radial_point": [969, 1214], "doi_spherical_point": [970, 1214], "domain": 1763, "doubl": [1696, 1739, 1742, 1756, 1757, 1758, 1771, 1781, 1798], "doublet": 182, "dougla": 1733, "download": [1748, 1788], "dpdbuf4": 183, "dpdfile2": 184, "dpotr": 42, "dpotrf": 40, "dpotri": 41, "driver": [1738, 1772, 1801, 1809, 1827], "drop_dupl": 344, "drot": 43, "dsbmv": 44, "dscal": 45, "dswap": 46, "dsyev": 47, "dsymm": 48, "dsymv": 49, "dsyr": 50, "dsyr2": 51, "dsyr2k": 52, "dsyrk": 53, "dsysv": 54, "dtbmv": 55, "dtbsv": 56, "dtrmm": 57, "dtrmv": 58, "dtrsm": 59, "dtrsv": 60, "dual": 1733, "dummy_einsum": 185, "dummy_integratorxx": 186, "dun": 1733, "dynamic_level": [1226, 1305], "dynamic_variable_bind": 293, "e": [1739, 1742, 1756, 1757, 1771, 1781, 1783, 1788, 1798, 1806, 1807, 1810], "e3_scal": [923, 1213, 1225, 1256], "e_converg": [439, 473, 737, 818, 924, 971, 1079, 1178, 1199, 1200, 1208, 1210, 1213, 1214, 1219, 1222, 1224, 1225, 1229, 1231, 1233, 1257, 1410, 1552, 1742, 1771, 1798], "ea": 1805, "ea_pol": [1225, 1258], "easi": [1828, 1844], "easier": [1748, 1824], "ecosystem": 1788, "ecp": [1730, 1838], "editor": 1747, "effect": [1231, 1730, 1838], "efp": [1216, 1678, 1782], "efp_disp": [1012, 1216], "efp_disp_damp": [1013, 1216], "efp_elst": [1014, 1216], "efp_elst_damp": [1015, 1216], "efp_exch": [1016, 1216], "efp_ind": [1017, 1216], "efp_ind_damp": [1018, 1216], "efp_qm_elst": [1019, 1216], "efp_qm_ind": [1020, 1216], "ekt_ea": [1225, 1259], "ekt_ip": [925, 1213, 1225, 1260], "electricfieldint": 71, "electron": [1771, 1799, 1817, 1841], "electrostaticint": 72, "element": [1707, 1731], "elementari": 1767, "els": 1785, "elsewher": 1738, "embarrass": 1840, "embed": 1749, "empir": 1759, "empiricaldispers": 267, "enabl": 1735, "end": 1737, "energi": [295, 1766], "energies_from_fcidump": [294, 345], "energy_level_shift": [738, 1208], "engin": 1817, "enhanc": 1780, "ensure_bt_converg": [1226, 1306], "environ": [1735, 1738, 1767, 1820], "environment": 1231, "eom_guess": [474, 1200, 1742], "eom_refer": [475, 508, 1200, 1201], "ep2_converg": [893, 1211], "ep2_maxit": [894, 1211], "ep2_num_ea": [895, 1211], "ep2_num_ip": [896, 1211], "ep2_orbit": [897, 1211], "ep_ea_pol": [1225, 1261], "ep_ip_pol": [1225, 1262], "ep_maxit": [1225, 1263], "eri": [69, 1757, 1838], "error": [1736, 1738], "esppropcalc": 70, "evalu": 1799, "ex_allow": [819, 1210], "ex_level": [820, 1210, 1755], "exampl": [1770, 1829, 1836, 1837, 1843], "exch_scale_alpha": [1230, 1453, 1837], "exchang": [1837, 1838], "excit": 1742, "excitation_rang": [476, 1200], "execut": [1738, 1844], "expand_psivar": 346, "expert": [1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1208, 1209, 1210, 1212, 1214, 1216, 1218, 1219, 1221, 1222, 1224, 1225, 1227, 1229, 1230, 1231], "explicit": 1821, "explicit_hamiltonian": [718, 1207], "expos": 1823, "ext_force_bend": [1226, 1307], "ext_force_cartesian": [1226, 1308], "ext_force_dihedr": [1226, 1309], "ext_force_dist": [1226, 1310], "ext_force_oofp": [1226, 1311], "extens": [1736, 1751], "extern": [1231, 1553, 1768, 1817, 1838], "external_potential_symmetri": [1124, 1221], "externalpotenti": 73, "extra": [2, 1788], "extrapol": 1740, "f": [1, 1754, 1770], "f12": 1733, "f_cut": [972, 1214], "fail_on_maxit": [1231, 1554], "famili": [1694, 1695, 1696, 1697, 1699, 1700, 1701, 1702, 1706, 1707, 1708, 1731, 1732, 1733, 1735, 1736, 1737, 1739, 1742, 1743, 1746, 1748, 1758, 1764, 1777, 1778, 1780, 1781, 1797, 1799, 1802, 1804, 1810, 1814, 1815, 1816, 1817, 1818, 1819, 1824, 1825, 1827, 1830, 1833, 1838, 1844], "faq": [1736, 1814], "faster": 1748, "favg": [1179, 1222], "favg_ccsd_t": [1229, 1411], "favg_start": [1180, 1222], "fchk": [296, 1769], "fchkwriter": 74, "fci": [821, 1210, 1755, 1790], "fci_str": [822, 1210], "fcidump": [297, 347], "fcidump_from_fil": [298, 348], "fcidump_tei_help": 187, "fd_project": [1024, 1217], "fdds_dispers": 75, "featur": 1815, "field": 1789, "file": [2, 1210, 1708, 1738, 1750, 1767, 1769, 1770, 1808, 1832, 1844], "filter_guess": [823, 1210], "filter_guess_det1": [824, 1210], "filter_guess_det2": [825, 1210], "filter_guess_sign": [826, 1210], "filter_nonvib": 384, "filter_omega_to_r": 385, "filter_zero_det": [827, 1210], "final": [188, 1788], "find": [1737, 1738, 1786], "find_approximate_string_match": [299, 349], "findif": 1217, "finit": [1739, 1781], "fink": 1738, "first": [1788, 1836, 1837], "fisapt": [76, 1218, 1679], "fisapt_charge_complet": [1034, 1218], "fisapt_cube_densmat": [1035, 1218, 1770], "fisapt_cube_linkibo": [1036, 1218, 1770], "fisapt_cube_linkiho": [1037, 1218, 1770], "fisapt_do_fsapt": [1038, 1218], "fisapt_do_fsapt_disp": [1039, 1218], "fisapt_do_plot": [1040, 1218], "fisapt_exch_parperp": [1041, 1218, 1770], "fisapt_fsapt_exch_scal": [1042, 1218], "fisapt_fsapt_filepath": [1043, 1218], "fisapt_fsapt_ind_respons": [1044, 1218], "fisapt_fsapt_ind_scal": [1045, 1218], "fisapt_fssapt_filepath": [1046, 1218], "fisapt_link_assign": [1047, 1218], "fisapt_link_ortho": [1048, 1218, 1770], "fisapt_link_select": [1049, 1218], "fisapt_manual_link": [1050, 1218], "fisapt_mem_safety_factor": [1051, 1218], "fisapt_plot_filepath": [1052, 1218], "fit": [1733, 1756, 1757, 1771, 1838], "fittedslatercorrelationfactor": 77, "fittingmetr": 78, "fix": [1738, 1746, 1786], "flexible_g_converg": [1226, 1312], "flip": [1805, 1837], "flush_outfil": 189, "fno": 1771, "fnocc": [190, 1219, 1680, 1771], "fock": [1781, 1805, 1828, 1838, 1841, 1844], "follow": 1210, "follow_root": [828, 1181, 1210, 1222, 1229, 1412], "follow_step_incr": [1231, 1555], "follow_step_scal": [1231, 1556], "follow_vector": [829, 1210], "font": [1694, 1695, 1696, 1697, 1699, 1700, 1701, 1702, 1706, 1707, 1708, 1731, 1732, 1733, 1735, 1736, 1737, 1739, 1742, 1743, 1746, 1748, 1758, 1764, 1777, 1778, 1780, 1781, 1797, 1799, 1802, 1804, 1810, 1814, 1815, 1816, 1817, 1818, 1819, 1824, 1825, 1827, 1830, 1833, 1838, 1844], "force_restart": [440, 1199], "force_twocon": [1182, 1222], "fork": 1737, "format": [2, 1747], "format_molecule_for_input": 350, "format_options_for_input": 351, "fortran": 1738, "frac_dii": [1231, 1557], "frac_load": [1231, 1558], "frac_occ": [1231, 1559], "frac_renorm": [1231, 1560], "frac_start": [1231, 1561], "frac_val": [1231, 1562], "fraction": [1231, 1757], "frag_mod": [1226, 1313], "frag_ref_atom": [1226, 1314], "fragment": [1226, 1782, 1802, 1833], "fragmenttyp": 79, "free_atom_volum": 352, "freeze_all_dihedr": [1226, 1315], "freeze_cor": [1125, 1221, 1230, 1454, 1771, 1837], "freeze_core_polici": [1126, 1221], "freeze_interfrag": [1226, 1316], "freeze_intrafrag": [1226, 1317], "freq": 300, "frequenc": [301, 302, 1772, 1828, 1844], "frequency_analysi": 1772, "from": [1735, 1737, 1738, 1786, 1802], "frozen": 1771, "frozen_bend": [1226, 1318], "frozen_cartesian": [1226, 1319], "frozen_dihedr": [1226, 1320], "frozen_dist": [1226, 1321], "frozen_docc": [1127, 1221, 1755], "frozen_oofp": [1226, 1322], "frozen_uocc": [1128, 1221, 1755], "full": 1824, "full_hess_everi": [1226, 1323, 1802], "full_matrix": [477, 1200], "function": [2, 80, 1695, 1696, 1697, 1699, 1700, 1701, 1702, 1733, 1743, 1757, 1758, 1770, 1772, 1779, 1821, 1827, 1831, 1841], "further": 1754, "futur": 1738, "g": [1739, 1742, 1756, 1757, 1771, 1773, 1781, 1788, 1798, 1810], "g_converg": [1226, 1324, 1802], "gau2grid": 1773, "gau2gridfor": 1773, "gaug": [402, 414, 539, 1197, 1198, 1203, 1742], "gauss": 1743, "gaussian": 322, "gaussianshel": 81, "gaussiantyp": 82, "gcc": 1738, "gcp": [1718, 1774], "gdb": 1738, "gdma": [303, 1220, 1681, 1719, 1775], "gdma_limit": [1097, 1220, 1775], "gdma_multipole_unit": [1098, 1220, 1775], "gdma_origin": [1099, 1220, 1775], "gdma_radiu": [1100, 1220, 1775], "gdma_switch": [1101, 1220, 1775], "gener": [1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1227, 1228, 1229, 1231, 1232, 1750, 1788, 1805, 1823], "geom_maxit": [1226, 1325, 1802], "geometr": 1802, "geometri": [304, 1800, 1802, 1828, 1832, 1833, 1844], "geometryunit": 83, "get": [1738, 1816], "get_active_molecul": 191, "get_array_vari": [192, 193], "get_datadir": 194, "get_global_opt": 195, "get_global_option_list": 196, "get_local_opt": 197, "get_memori": [198, 305, 353], "get_num_thread": 199, "get_opt": [200, 201], "get_output_fil": 202, "get_psifil": 354, "get_vari": [203, 204], "get_writer_file_prefix": 205, "getattr_ignorecas": 355, "gga": [1699, 1758], "ghost": 1833, "gib": 1821, "git": [1738, 1747, 1786, 1787], "git_vers": 206, "github": [1737, 1786, 1788], "global": [1221, 1801], "gn": 1771, "gpu": 1735, "gpu_dfcc": 1720, "gradient": [306, 1753, 1800], "gradient_writ": [1025, 1217], "grid": [1214, 1757, 1799], "grimm": [1759, 1774], "group": [1746, 1770, 1781], "guess": [1210, 1231, 1563, 1838], "guess_mix": [1231, 1564], "guess_persist": [1231, 1565], "guess_r_converg": [739, 1208], "guess_vector": [830, 1210], "h0_block_coupl": [831, 1210], "h0_block_coupling_s": [832, 1210], "h0_blocksiz": [833, 1210], "h0_guess_siz": [834, 1210], "h_bond_connect": [1226, 1326], "h_guess_everi": [1226, 1327], "h_update_den_tol": [1226, 1328], "hamiltonian": 1836, "hamiltonian_solv": 356, "handl": [1210, 1738, 1746, 1801], "harmon": 1772, "harmonic_analysi": 386, "hartre": [1781, 1828, 1838, 1841, 1844], "has_array_vari": 207, "has_chang": 1801, "has_global_option_chang": 208, "has_local_option_chang": 209, "has_option_chang": 210, "has_scalar_vari": 211, "has_vari": 212, "hbc6": [1692, 1752], "hd_avg": [835, 1210], "hd_otf": [836, 1210], "header": 1820, "heff4": [1229, 1413], "heff_print": [1229, 1414], "help": 1816, "helper": 1733, "herbst": [1, 1754], "hess": 1762, "hess_typ": [926, 1213, 1798], "hess_upd": [1226, 1329], "hess_update_limit": [1226, 1330], "hess_update_limit_max": [1226, 1331], "hess_update_limit_scal": [1226, 1332], "hess_update_use_last": [1226, 1333], "hessian": [307, 1226, 1772, 1802], "hessian_symmetr": 387, "hessian_writ": [1026, 1217], "hf": [84, 1230, 1838], "hidden": 1738, "high": 1738, "higher": [1755, 1837], "highlight": 1738, "hold_options_st": 357, "homebrew": 1738, "hook": 1747, "how": [1, 1737, 1738, 1746, 1747, 1748, 1749, 1754, 1762, 1765, 1773, 1775, 1782, 1783, 1784, 1785, 1786, 1803, 1810, 1822, 1839], "hsg": [1692, 1752], "htbh": [1692, 1752], "htr40": [1692, 1752], "hybrid": [1696, 1700, 1758], "i": [1737, 1738, 1739, 1742, 1756, 1757, 1770, 1771, 1781, 1782, 1786, 1798, 1801, 1828], "icor": [837, 1210, 1755], "idamax": 85, "ignor": 1822, "ii": 1828, "iii": 1828, "imag": 1788, "implement": [1739, 1759, 1829], "import": [1786, 1802, 1810], "import_ignorecas": 358, "impos": 1747, "incfock": [1231, 1566], "incfock_converg": [1231, 1567], "incfock_full_fock_everi": [1231, 1568], "includ": [1739, 1804], "incorpor": 1824, "induced_converg": [1228, 1389, 1749], "inf": 1837, "info": 1231, "inherit": 1827, "initi": [213, 1788, 1824, 1838], "initio": 0, "inpsight": 323, "input": [2, 1730, 1753, 1757, 1762, 1775, 1805, 1806, 1828, 1832, 1838, 1842, 1844], "instal": [1, 1735, 1736, 1737, 1738, 1743, 1746, 1748, 1749, 1754, 1759, 1762, 1764, 1765, 1767, 1773, 1774, 1775, 1782, 1783, 1784, 1792, 1803, 1805, 1806, 1807, 1839], "instanti": 1817, "int": 1817, "intcos_generate_exit": [1226, 1334], "integr": [1738, 1754, 1785, 1815, 1817, 1823, 1824, 1838], "integral_cutoff": [927, 1213], "integral_packag": [1129, 1221], "integralfactori": 89, "integraltransform": 90, "interact": [1755, 1771, 1781, 1828, 1844], "intercal": 1779, "interfac": [0, 1, 1735, 1743, 1746, 1749, 1754, 1759, 1762, 1765, 1769, 1772, 1773, 1774, 1775, 1780, 1782, 1783, 1784, 1791, 1792, 1797, 1802, 1803, 1814, 1839], "interfrag_collinear_tol": [1226, 1335], "interfrag_coord": [1226, 1336], "interfrag_dist_inv": [1226, 1337], "interfrag_hess": [1226, 1338], "interfrag_mod": [1226, 1339], "interfrag_step_limit": [1226, 1340], "interfragment_connect": [1226, 1341], "intermedi": 1708, "intermolecular": [1828, 1844], "intern": [1206, 1226, 1739, 1781], "internal_rot": [1183, 1222], "interpret": 1837, "intrafrag_hess": [1226, 1342], "intrafrag_step_limit": [1226, 1343], "intrafrag_step_limit_max": [1226, 1344], "intrafrag_step_limit_min": [1226, 1345], "intramolecular": 1770, "introduct": [1750, 1756, 1763, 1781, 1798, 1817, 1818, 1838, 1841], "ints_toler": [415, 740, 905, 1053, 1198, 1208, 1212, 1218, 1224, 1230, 1231, 1234, 1455, 1569, 1837], "intvector": 88, "invok": [1738, 1831], "io": 86, "iomanag": 87, "ip": [1757, 1805], "ip_pol": [1225, 1264], "ipi_brok": 308, "irc_direct": [1226, 1346], "irc_point": [1226, 1347], "irc_step_s": [1226, 1348], "irreduc": 1833, "irreduciblerepresent": 91, "irrep": [1797, 1833], "isotop": 1833, "isotropic_pol": [1228, 1390, 1749], "issu": 1786, "istop": [838, 1210], "iter": [1753, 1754, 1799], "iv": 1828, "j": [1743, 1775], "januari": 1788, "jensen": 1733, "jha": 1754, "jk": [92, 1733], "job": [1767, 1832], "jobtyp": [516, 1202], "jsch": [1692, 1752], "json": 1721, "kaliman": 1782, "karlsruh": 1733, "ket": 1817, "keyword": [1, 400, 1704, 1705, 1735, 1742, 1746, 1749, 1750, 1754, 1755, 1762, 1770, 1771, 1772, 1785, 1789, 1798, 1799, 1802, 1803, 1832, 1833, 1836, 1837, 1841, 1843], "kind": [1, 403, 1197], "kineticint": 93, "known": 1841, "kroll": 1733, "kwargs_low": 359, "k\u00e1llai": 1792, "l": 1784, "lapack": [1738, 1810], "laplacedenomin": 95, "larger": 1742, "layout": [1738, 1823], "level": [1733, 1737, 1786, 1810], "level_shift": [928, 1184, 1213, 1222, 1225, 1231, 1265, 1570], "level_shift_cutoff": [1231, 1571], "levenshtein": [309, 360], "libecpint": 1765, "libefp": [1722, 1782], "libint": 1783, "libint2_configur": [310, 361], "libint2_print_out": [311, 362], "libint2_solid_harmonics_ord": 214, "libopt": 1801, "librari": [1738, 1782, 1812], "libxc": 1784, "libxcfunct": 96, "licens": 1781, "limit": 1841, "line": [1748, 1767], "linear": [540, 1203, 1742, 1810, 1838], "lineq_solv": [929, 1213], "lineshap": 324, "link": [1770, 1827], "link_ints_toler": [1231, 1572], "linux": 1738, "literal_cfour": [1130, 1221], "live": 1823, "lldb": 1738, "local": [97, 441, 478, 517, 541, 1199, 1200, 1202, 1203, 1738, 1763, 1801], "local_converg": [973, 1054, 1214, 1218, 1231, 1573], "local_cphf_cutoff": [442, 518, 542, 1199, 1202, 1203], "local_cutoff": [443, 479, 519, 543, 1199, 1200, 1202, 1203], "local_do_singl": [480, 1200], "local_filter_singl": [481, 520, 544, 1200, 1202, 1203], "local_ibo_condit": [1055, 1218], "local_ibo_pow": [1056, 1218], "local_ibo_star": [1057, 1218], "local_ibo_stars_complet": [1058, 1218], "local_ibo_use_star": [1059, 1218], "local_maxit": [974, 1060, 1214, 1218, 1231, 1574], "local_method": [444, 482, 521, 545, 1199, 1200, 1202, 1203], "local_pairdef": [445, 522, 546, 1199, 1202, 1203], "local_precondition": [483, 1200], "local_use_ghost": [1061, 1218], "local_weakp": [446, 484, 523, 547, 1199, 1200, 1202, 1203], "locat": 1786, "lock_singlet": [1229, 1415], "log": 1738, "logo": 1738, "long": [1701, 1758, 1788], "loop": 1832, "lorentzian": 325, "low": 1810, "ls_thc_basis_toler": [1131, 1221], "ls_thc_comput": 94, "ls_thc_df": [1132, 1221], "ls_thc_pruning_schem": [1133, 1221], "ls_thc_radial_point": [1134, 1221], "ls_thc_s_epsilon": [1135, 1221], "ls_thc_spherical_point": [1136, 1221], "ls_thc_weights_toler": [1137, 1221], "lse": [839, 1210], "lse_collaps": [840, 1210], "lse_toler": [841, 1210], "lto": 1746, "m": [1, 1749, 1754, 1762, 1784, 1792], "mac": 1738, "macport": 1738, "made": [1828, 1844], "madmp2_sleep": [906, 1212], "mai": 1738, "make_shar": 1821, "manag": [1736, 1786, 1787, 1809], "managedmethoderror": 268, "mani": 1771, "manipul": 1757, "manual": [1747, 1764, 1777], "map": 1764, "mark": 1821, "marqu": 1784, "mat2arr": 363, "mat_num_column_print": [1138, 1221], "math": 1764, "matric": 1210, "matrix": [100, 1746, 1781, 1797, 1810], "matrixfactori": 101, "max_attempt": [1231, 1575], "max_ccd_diisvec": [1230, 1456], "max_disp_g_converg": [1226, 1349], "max_energy_g_converg": [1226, 1350], "max_force_g_converg": [1226, 1351], "max_mem_buf": [1231, 1576], "max_mograd_converg": [930, 1213, 1225, 1266, 1798], "max_num_vec": [1, 404, 842, 1197, 1210], "max_radial_mo": [1139, 1221], "maxit": [1, 405, 447, 485, 524, 548, 741, 1062, 1080, 1185, 1197, 1199, 1200, 1202, 1203, 1208, 1218, 1219, 1222, 1228, 1229, 1230, 1231, 1391, 1416, 1457, 1577, 1742, 1749, 1771, 1837], "mbis_d_converg": [1140, 1221], "mbis_maxit": [1141, 1221], "mbis_pruning_schem": [1142, 1221], "mbis_radial_point": [1143, 1221], "mbis_spherical_point": [1144, 1221], "mcscf": [215, 1210, 1222, 1682, 1789], "mcscf_algorithm": [843, 1210, 1789], "mcscf_ci_cleanup": [844, 1210], "mcscf_diis_error_typ": [845, 1210], "mcscf_diis_freq": [846, 1210], "mcscf_diis_max_vec": [847, 1210], "mcscf_diis_start": [848, 1210, 1789], "mcscf_dpd_cleanup": [849, 1210], "mcscf_e_converg": [850, 1210, 1789], "mcscf_guess": [851, 1210], "mcscf_max_rot": [852, 1210], "mcscf_maxit": [853, 1210, 1789], "mcscf_r_converg": [854, 1210, 1789], "mcscf_rotat": [855, 1210, 1789], "mcscf_so_start_": [856, 1210], "mcscf_so_start_grad": [857, 1210], "mcscf_type": [858, 1210, 1789], "mdi_run": 312, "memdfjk": 102, "memori": [1821, 1832], "merg": 1738, "message_box": [313, 364], "meta": [1702, 1758], "method": [0, 1210, 1746, 1753, 1771, 1781, 1790, 1792, 1798, 1809, 1823, 1834, 1838], "mid": 1837, "mikhalev": 1754, "min_ccd_diisvec": [1230, 1458], "minao_basi": [1063, 1218], "miniconda": 1748, "minim": [1753, 1757, 1799, 1838], "minima": 1802, "mint": 1223, "mintshelp": 103, "minut": 1738, "misc": [1226, 1231, 1743, 1788], "miscellan": [400, 1736, 1814], "missingmethoderror": 269, "mix": [859, 1210, 1730], "mixed4": [860, 1210], "mk": [1781, 1829], "mm": 1838, "mo_diis_num_vec": [931, 1213, 1798], "mo_maxit": [932, 1213, 1225, 1267, 1798], "mo_read": [1186, 1222, 1225, 1268], "mo_step_max": [933, 1213, 1225, 1269], "mo_writ": [1225, 1270], "mode": 1772, "model": [1749, 1754, 1803, 1829], "modifi": 1824, "modul": [719, 1207, 1705, 1709, 1735, 1738, 1739, 1742, 1756, 1757, 1771, 1772, 1798, 1801, 1814, 1827, 1828], "modular": 1808, "modulenotfounderror": 1738, "mograd_damp": [1225, 1271], "molden": [314, 1772, 1791], "molden_with_virtu": [1145, 1221, 1791], "molden_writ": [934, 1213, 1231, 1578, 1791], "moldenwrit": 104, "molecul": [106, 1782, 1832, 1833], "moleculargrid": 105, "molecule_get_attr": 315, "molecule_set_attr": 316, "mom_occ": [1231, 1579], "mom_start": [1231, 1580], "mom_vir": [1231, 1581], "momentum": 1738, "monom": 1837, "more": 1824, "mospac": 98, "mowrit": 99, "mp": 1798, "mp2": [1733, 1756, 1763, 1806, 1837], "mp2_amp_typ": [935, 1213], "mp2_amps_print": [448, 1199, 1742], "mp2_ccsd_method": [1229, 1417], "mp2_guess": [1229, 1418], "mp2_os_scal": [449, 907, 936, 1199, 1212, 1213, 1225, 1272, 1798], "mp2_scale_o": [1081, 1219, 1771], "mp2_scale_ss": [1082, 1219, 1771], "mp2_sos_scal": [937, 1213, 1225, 1273, 1798], "mp2_sos_scale2": [938, 1213, 1225, 1274, 1798], "mp2_ss_scale": [450, 908, 939, 1199, 1212, 1213, 1225, 1275, 1798], "mp2_type": [1146, 1221], "mp4": 1771, "mp_type": [1147, 1221], "mpn": [861, 1210, 1755], "mpn_order_sav": [862, 1210], "mpn_schmidt": [863, 1210], "mpn_wigner": [864, 1210], "mrcc": [1224, 1683, 1723, 1781, 1792, 1829], "mrcc_generate_input": 216, "mrcc_level": [1224, 1235], "mrcc_load_dens": 217, "mrcc_method": [1224, 1236], "mrcc_num_doublet_root": [1224, 1237], "mrcc_num_singlet_root": [1224, 1238], "mrcc_num_triplet_root": [1224, 1239], "mrcc_omp_num_thread": [1224, 1240], "mrcc_restart": [1224, 1241], "ms0": [865, 1210], "mukherje": 1781, "multi": [1781, 1789, 1802], "multipl": [1755, 1833], "multipol": 1775, "multipoleint": 107, "multipolesymmetri": 108, "multirefer": 1810, "m\u00f8ller": [1756, 1798], "nablaint": 109, "name": [1738, 1785, 1786, 1810], "nat_orb": [866, 940, 1083, 1210, 1213, 1219, 1225, 1276, 1771, 1798], "nat_orbs_t2": [1230, 1459, 1837], "nat_orbs_t3": [1230, 1460, 1837], "nat_orbs_v4": [1230, 1461, 1837], "natur": [1763, 1771, 1837], "nbc10": [1692, 1752], "ncb31": [1692, 1752], "necessari": 1735, "need": [1746, 1824], "nest": 1779, "network": 1806, "new": [1788, 1808, 1815, 1817, 1819, 1821, 1823, 1825], "new_tripl": [451, 486, 1199, 1200], "next": 1788, "nhtbh": [1692, 1752], "nl": 1760, "nl_dispersion_paramet": [1231, 1582], "no_dfil": [867, 1210], "no_singl": [1229, 1419], "non": [1736, 1786, 1798, 1833], "none": [1694, 1695, 1696, 1697, 1699, 1700, 1701, 1702, 1706, 1707, 1708, 1731, 1732, 1733, 1735, 1736, 1737, 1739, 1742, 1743, 1746, 1748, 1758, 1764, 1777, 1778, 1780, 1781, 1797, 1799, 1802, 1804, 1810, 1814, 1815, 1816, 1817, 1818, 1819, 1824, 1825, 1827, 1830, 1833, 1838, 1844], "normal": 1772, "normal_modes_writ": [1027, 1217, 1772], "note": [1770, 1795, 1796], "nottoli": 1754, "null": 1821, "nullptr": 1821, "num_amps_print": [452, 487, 525, 549, 868, 1199, 1200, 1202, 1203, 1210, 1742], "num_core_orbit": [1, 406, 1197], "num_dets_print": [869, 1210], "num_frozen_docc": [1148, 1221], "num_frozen_uocc": [1149, 1221], "num_guess": [0, 1, 407, 1197], "num_init_vec": [870, 1210], "num_root": [871, 1210, 1755], "numer": 1754, "numinthelp": 110, "numpi": 1797, "o": 1738, "o24by5": [1692, 1752], "o24by5mb": [1692, 1752], "objdir": 1738, "object": [2, 1746, 1768, 1797, 1817], "obtain": [1736, 1737, 1738], "occ": [218, 1225, 1684, 1798], "occ_orbs_print": [941, 1213, 1225, 1277, 1798], "occ_percentag": [1084, 1219], "occ_toler": [1085, 1219, 1230, 1462, 1771, 1837], "occup": 1231, "odc_guess": [742, 1208], "oeprop": [111, 317, 365, 942, 1213, 1225, 1278, 1685, 1799], "offdiagonal_ccsd_t": [1229, 1420], "old": 2, "older": 1817, "omega": [550, 1203, 1742], "omega_erf": [1196, 1223], "one": [1799, 1841], "onebodyaoint": 112, "onebodysoint": 113, "onepdm": [909, 1212], "onepot_grid_read": [1231, 1583], "oo": 1798, "oo_scal": [943, 1213], "opdm": [743, 872, 1208, 1210, 1755], "opdm_onli": [416, 1198], "opdm_relax": [417, 910, 1198, 1212], "open": [1777, 1837], "oper": [1817, 1823], "opt": 318, "opt_coordin": [1226, 1352], "opt_method": [944, 1213, 1225, 1279, 1798], "opt_restart": [1226, 1353], "opt_typ": [1226, 1354, 1802], "optim": [319, 1226, 1781, 1798, 1800, 1802, 1828, 1844], "optima": [1694, 1695, 1696, 1697, 1699, 1700, 1701, 1702, 1706, 1707, 1708, 1731, 1732, 1733, 1735, 1736, 1737, 1739, 1742, 1743, 1746, 1748, 1758, 1764, 1777, 1778, 1780, 1781, 1797, 1799, 1802, 1804, 1810, 1814, 1815, 1816, 1817, 1818, 1819, 1824, 1825, 1827, 1830, 1833, 1838, 1844], "optimizationconvergenceerror": 270, "optimize_geometr": 320, "option": [114, 1210, 1214, 1735, 1738, 1750, 1767, 1775, 1791, 1795, 1796, 1801, 1836], "option_exists_in_modul": 219, "options_to_python": 220, "optionsst": 327, "optionsstatecm": 328, "optionst": 326, "optk": [1226, 1802], "orb_opt": [945, 1213, 1225, 1280, 1798], "orb_resp_solv": [946, 1213, 1225, 1281], "orbit": [1733, 1750, 1755, 1763, 1770, 1771, 1781, 1789, 1798, 1810, 1829, 1837], "orbital_level_shift": [744, 1208], "orbitals_writ": [1231, 1584], "orbitalspac": 115, "order": [1210, 1755, 1756, 1770, 1829, 1833, 1837, 1838], "org": 1788, "organ": 1830, "origin": 1799, "orth_typ": [947, 1213, 1225, 1282, 1798], "orthogon": 1838, "os_scal": [1225, 1283], "other": [1733, 1770], "outfile_nam": 221, "output": [2, 1740, 1743, 1752, 1786, 1802, 1843], "overal": 1781, "overlap": 1739, "overlap_check": [488, 1200], "overlapint": 116, "overrid": 1821, "overview": [1781, 1815, 1817], "p": [1232, 1665, 1694, 1695, 1696, 1697, 1699, 1700, 1701, 1702, 1706, 1707, 1708, 1731, 1732, 1733, 1735, 1736, 1737, 1739, 1742, 1743, 1746, 1748, 1758, 1764, 1777, 1778, 1780, 1781, 1797, 1799, 1802, 1804, 1810, 1814, 1815, 1816, 1817, 1818, 1819, 1824, 1825, 1827, 1830, 1833, 1838, 1843, 1844], "p4util": 1827, "packag": [1737, 1748, 1759, 1781, 1788, 1827], "page": 1788, "pair": [1763, 1771, 1817], "pair_energies_print": [453, 1199], "parallel": [1231, 1585, 1840], "paramet": 1754, "parent_symmetri": [1150, 1221], "parsingerror": 271, "particl": 1757, "partit": 1770, "pass": 1788, "pasturerequirederror": 272, "path": [1738, 1802, 1804], "pb": [1738, 1767], "pcg_beta_typ": [948, 1213, 1225, 1284], "pcg_converg": [949, 1213, 1225, 1285], "pcg_maxit": [950, 1213, 1225, 1286], "pcm": [1151, 1221, 1227, 1686, 1803], "pcm_cc_type": [1227, 1375, 1803], "pcm_helper": [366, 379], "pcm_scf_type": [1227, 1376, 1803], "pcmsolver": [1724, 1803], "pcmsolver_parsed_fnam": [1227, 1377], "pe": [1152, 1221, 1228, 1687, 1749], "pe_ecp": [1228, 1392], "pep1": 1804, "permit": 1779, "permut": 1817, "perturb": [1210, 1755, 1756, 1771, 1781, 1798, 1837], "perturb_cb": [1229, 1421], "perturb_cbs_coupl": [1229, 1422], "perturb_dipol": [1231, 1586], "perturb_h": [1231, 1587], "perturb_magnitud": [873, 1210, 1231, 1588], "perturb_with": [1231, 1589], "petersson": 1733, "petitelist": 118, "phi_point": [1231, 1590], "photon": 1841, "physic": [1706, 1832], "pk_all_nonsym": [1231, 1591], "pk_max_bucket": [1231, 1592], "plain": 2, "plan": [1738, 1830], "plesset": [1756, 1798], "plot": 1841, "plugin": [222, 1746, 1807, 1808, 1824], "plugin_clos": 223, "plugin_close_al": 224, "plugin_load": 225, "plump_qcvar": 367, "pmlocal": 117, "pno_converg": [975, 1214], "point": [1028, 1217, 1766, 1770], "pointfunct": 119, "pointgroup": 120, "polar": 0, "polariz": [1749, 1803], "popl": 1733, "post": [1760, 1781, 1788, 1838], "postreleas": 1788, "potenti": [1730, 1817, 1828, 1838, 1844], "potentialint": 121, "potfil": [1228, 1393, 1749], "ppl_type": [951, 1213], "practic": 1830, "pre": [1788, 1808], "precondition": [874, 1210], "prefactor_ecd": 368, "prefactor_opa": 369, "prefer": 1821, "prepare_options_for_modul": [226, 370], "prepare_options_for_set_opt": 371, "prerequisit": 1750, "primitivetyp": 122, "print": [720, 1021, 1153, 1207, 1216, 1221, 1230, 1463, 1821, 1837], "print_basi": [1231, 1593], "print_global_opt": 227, "print_mo": [1231, 1594], "print_molden_vib": 388, "print_noon": [1154, 1221], "print_opt": 228, "print_opt_param": [1226, 1355], "print_out": 229, "print_trajectory_xyz_fil": [1226, 1356], "print_vari": 230, "print_vib": 389, "pritchard": 1839, "problem": 1798, "problemat": 1802, "proc": 1809, "procedur": 1788, "process_grid": [1231, 1595], "process_input": 380, "profil": 1813, "program": [1769, 1812, 1818], "programm": [1764, 1777, 1814, 1825], "prop": [123, 381], "prop_al": [418, 526, 1198, 1202], "prop_root": [419, 489, 527, 1198, 1200, 1202], "prop_sym": [420, 490, 528, 1198, 1200, 1202], "propag": 0, "properti": [382, 454, 551, 1155, 1199, 1203, 1221, 1742, 1799, 1826], "properties_origin": [1156, 1221], "propos": 1804, "protointvector": 124, "protovector": 125, "provenance_stamp": 372, "psi": [400, 1709, 1776, 1795, 1832], "psi4": [0, 1, 1206, 1737, 1738, 1746, 1748, 1749, 1754, 1762, 1765, 1772, 1773, 1775, 1782, 1783, 1784, 1785, 1786, 1788, 1803, 1810, 1824, 1827, 1828, 1839], "psi4conda": [1748, 1788], "psi4fockci": 1805, "psi4numpi": [1725, 1824], "psi4rc": 1767, "psi_top_srcdir": 231, "psiapi": [2, 1738, 1828, 1841], "psicod": 1788, "psidatadir": 1738, "psiexcept": 273, "psimrcc": [232, 1229, 1688, 1829], "psio_entri": 233, "psioh": 1708, "psipep": [1804, 1830], "psireturntyp": 126, "psithon": [2, 1779, 1831, 1832, 1841, 1844], "pt_energi": [1229, 1423], "pubchem": 1833, "publish": 1788, "puream": [1157, 1221], "py": [2, 1809], "pymol": 1770, "pytest": 2, "python": [1726, 1738, 1822, 1823, 1827, 1828, 1832, 1833], "q": 1817, "qc": 1736, "qc_coupl": [745, 1208], "qc_modul": [1158, 1221, 1739, 1742, 1756, 1757, 1771, 1798], "qc_type": [746, 1208], "qca": 2, "qcdb": 1772, "qchf": [952, 1213, 1231, 1596], "qcisd": 1771, "qcvariabl": 400, "qm": 1838, "qmefp": [1022, 1216], "qmmm": 274, "qmmmbohr": 275, "quadrat": 1771, "quadrupoleint": 127, "quantum": 1777, "queue": 1738, "quick": 1748, "quiz": 1737, "r": [1765, 1803], "r4": [875, 1210], "r_converg": [0, 1, 408, 455, 491, 529, 552, 747, 876, 953, 976, 1086, 1197, 1199, 1200, 1202, 1203, 1208, 1210, 1213, 1214, 1219, 1225, 1229, 1287, 1424, 1742, 1755, 1771, 1798], "r_point": [1231, 1597], "radiu": [1231, 1598], "rang": [1701, 1758], "ranged_bend": [1226, 1357], "ranged_dihedr": [1226, 1358], "ranged_dist": [1226, 1359], "ranged_oofp": [1226, 1360], "rapid": 1824, "ras1": [1159, 1221], "ras2": [1160, 1221], "ras3": [1161, 1221], "ras34_max": [877, 1210], "ras3_max": [878, 1210], "ras4": [1162, 1221], "ras4_max": [879, 1210], "reaction": 1802, "read": 1801, "read_opt": 1785, "read_scf_3index": [954, 1213], "rebuild": 1738, "recommend": [1735, 1753, 1756, 1757, 1763, 1838], "ref": [2, 1786], "refer": [0, 1, 409, 421, 456, 492, 553, 560, 565, 748, 880, 1187, 1197, 1198, 1199, 1200, 1203, 1204, 1205, 1208, 1210, 1222, 1231, 1599, 1738, 1742, 1755, 1762, 1781], "reference_sym": [881, 1210], "reg_param": [955, 1213], "regular": [956, 1213], "reiher": 1762, "relat": 1742, "relativist": [1163, 1221, 1762, 1781, 1836], "relax": [1225, 1288], "relax_guess_orbit": [749, 1208], "releas": [1788, 1814], "remigio": 1803, "remot": 1786, "remov": 1786, "remp_a": [957, 1213, 1225, 1289], "renorm": [1746, 1781], "reopen_outfil": 234, "repl_otf": [882, 1210], "report": 1816, "repositori": [1737, 1738], "repres": 1770, "represent": 1833, "requir": [1738, 1815], "respons": 1742, "response_algorithm": [750, 1208], "restart": [457, 530, 554, 883, 1199, 1202, 1203, 1210, 1742, 1767, 1838], "restart_eom_cc3": [493, 1200], "restricted_docc": [1164, 1221, 1755], "restricted_uocc": [1165, 1221, 1755], "restructuredtext": 1764, "result": [1772, 1832, 1837], "retain": 1738, "return": 1832, "review": 1786, "revoke_global_option_chang": 235, "revoke_local_option_chang": 236, "rfo_follow_root": [1226, 1361], "rfo_normalization_max": [1226, 1362], "rfo_root": [1226, 1363], "rgc10": [1692, 1752], "rhf": 128, "rhf_triplet": [494, 1200], "rksfunction": 129, "rms_disp_g_converg": [1226, 1364], "rms_force_g_converg": [1226, 1365], "rms_mograd_converg": [958, 1213, 1225, 1290, 1798], "rohf": 130, "role": 1804, "root": [1210, 1755], "roots_per_irrep": [1, 410, 422, 495, 531, 1197, 1198, 1200, 1202, 1742], "rotate_mo_angl": [1188, 1222], "rotate_mo_irrep": [1189, 1222], "rotate_mo_p": [1190, 1222], "rotate_mo_q": [1191, 1222], "rotational_symmetry_numb": [1232, 1666, 1843], "routin": 1810, "rse42": [1692, 1752], "rsrfo_alpha_max": [1226, 1366], "run": [0, 2, 1736, 1738, 1739, 1742, 1743, 1747, 1750, 1756, 1757, 1759, 1771, 1774, 1781, 1782, 1786, 1788, 1792, 1798, 1828, 1844], "run_ccsd": [1087, 1219, 1771], "run_cctransort": [561, 1204], "run_cepa": [1088, 1219, 1771], "run_mp2": [1089, 1219, 1771], "run_mp3": [1090, 1219, 1771], "run_mp4": [1091, 1219, 1771], "runtim": [1231, 1736, 1738, 1767], "s2": 1837, "s22": [1692, 1752], "s22by5": [1692, 1752], "s66": [1692, 1752], "s66by8": [1692, 1752], "s_cholesky_toler": [1231, 1600], "s_cut": [977, 1214], "s_orthogon": [1231, 1601], "s_toler": [1231, 1602], "sad": 1231, "sad_chol_toler": [1231, 1603], "sad_d_converg": [1231, 1604], "sad_e_converg": [1231, 1605], "sad_frac_occ": [1231, 1606], "sad_maxit": [1231, 1607], "sad_print": [1231, 1608], "sad_scf_typ": [1231, 1609], "sad_spin_averag": [1231, 1610], "sadguess": 131, "salccompon": 134, "sampl": [1788, 1805, 1806, 1842, 1844], "san": [1694, 1695, 1696, 1697, 1699, 1700, 1701, 1702, 1706, 1707, 1708, 1731, 1732, 1733, 1735, 1736, 1737, 1739, 1742, 1743, 1746, 1748, 1758, 1764, 1777, 1778, 1780, 1781, 1797, 1799, 1802, 1804, 1810, 1814, 1815, 1816, 1817, 1818, 1819, 1824, 1825, 1827, 1830, 1833, 1838, 1844], "sanitize_method": [373, 391], "sanitize_nam": 392, "saon": 1770, "sapgau_basi": [1231, 1611], "sapt": [237, 1230, 1231, 1612, 1689, 1770, 1781, 1837], "sapt0": 1837, "sapt0_e10": [1230, 1464], "sapt0_e20disp": [1230, 1465], "sapt0_e20ind": [1230, 1466], "sapt_dft_do_dhf": [1230, 1467, 1837], "sapt_dft_do_hybrid": [1230, 1468, 1837], "sapt_dft_exch_disp_fixed_scal": [1230, 1469, 1837], "sapt_dft_exch_disp_scale_schem": [1230, 1470, 1837], "sapt_dft_funct": [1230, 1471, 1837], "sapt_dft_grac_determin": [1230, 1472], "sapt_dft_grac_shift_a": [1230, 1473, 1837], "sapt_dft_grac_shift_b": [1230, 1474, 1837], "sapt_dft_mp2_disp_alg": [1230, 1475, 1837], "sapt_fdds_disp_leg_lambda": [1230, 1476], "sapt_fdds_disp_num_point": [1230, 1477], "sapt_fdds_v2_rho_cutoff": [1230, 1478], "sapt_level": [1230, 1479, 1837], "sapt_mem_check": [1230, 1480, 1837], "sapt_mem_factor": [1230, 1481], "sapt_mem_safeti": [1230, 1482, 1837], "sapt_quiet": [1230, 1483, 1837], "satisfi": 1738, "save": [1738, 1760, 1767], "save_jk": [1231, 1613], "save_optim": [1226, 1367], "save_uhf_no": [1231, 1614], "savetyp": 135, "sc": 1758, "scalar": [1781, 1836], "scalar_vari": [238, 239], "scale": [1798, 1806, 1837], "scan": [1828, 1844], "scatter": 240, "scf": [1231, 1690, 1757, 1760, 1790, 1838], "scf_helper": 393, "scf_initial_acceler": [1231, 1615], "scf_initial_finish_diis_transit": [1231, 1616], "scf_initial_start_diis_transit": [1231, 1617], "scf_mem_safety_factor": [1231, 1618], "scf_properti": [1231, 1619], "scf_subtyp": [1231, 1620], "scf_type": [721, 1166, 1207, 1221], "scf_wavefunction_factori": 394, "scfconvergenceerror": 276, "scfgrad": 241, "scfhess": 242, "scheme": 1740, "scheurer": [1, 1749], "schmidt_add_residual_toler": [496, 1200, 1742], "scratch": [1738, 1767], "screen": [1167, 1221, 1817], "script": [1750, 1788], "scs_ccsd": [458, 1092, 1199, 1219, 1771], "scs_cepa": [1093, 1219], "scs_mp2": [459, 1094, 1199, 1219, 1771], "scs_type": [959, 1213, 1225, 1291], "scsn_mp2": [460, 1199], "second": 1838, "see": 1738, "sekino": [532, 555, 1202, 1203], "select": [1757, 1829], "selector": [1739, 1742, 1756, 1757, 1771, 1781, 1798], "self": 1789, "semicanon": [461, 497, 562, 566, 1199, 1200, 1204, 1205], "seminumer": 1838, "serif": [1694, 1695, 1696, 1697, 1699, 1700, 1701, 1702, 1706, 1707, 1708, 1731, 1732, 1733, 1735, 1736, 1737, 1739, 1742, 1743, 1746, 1748, 1758, 1764, 1777, 1778, 1780, 1781, 1797, 1799, 1802, 1804, 1810, 1814, 1815, 1816, 1817, 1818, 1819, 1824, 1825, 1827, 1830, 1833, 1838, 1844], "set": [400, 1694, 1707, 1730, 1731, 1732, 1733, 1738, 1740, 1788, 1794, 1802, 1820, 1832, 1836], "set_active_molecul": 243, "set_array_vari": 244, "set_datadir": 245, "set_global_opt": 246, "set_global_option_python": 247, "set_local_opt": 248, "set_local_option_python": 249, "set_memori": [374, 395], "set_memory_byt": 250, "set_module_opt": [375, 396], "set_num_thread": 251, "set_opt": [376, 397], "set_output_fil": 252, "set_psi_file_prefix": 253, "set_scalar_vari": 254, "set_vari": 255, "setup": 1736, "sf_restrict": [885, 1210], "shaw": [1765, 1806], "shell": [662, 1206, 1817, 1837], "shellinfo": 136, "should": 1823, "si": [1694, 1695, 1696, 1697, 1699, 1700, 1701, 1702, 1706, 1707, 1708, 1731, 1732, 1733, 1735, 1736, 1737, 1739, 1742, 1743, 1746, 1748, 1758, 1764, 1777, 1778, 1780, 1781, 1797, 1799, 1802, 1804, 1810, 1814, 1815, 1816, 1817, 1818, 1819, 1824, 1825, 1827, 1830, 1833, 1838, 1844], "siaon": 1770, "siev": 1817, "sigma_overlap": [886, 1210], "simint": [1727, 1839], "simpl": [1751, 1829], "singl": [1739, 1742, 1756, 1757, 1766, 1771, 1798, 1837], "singles_print": [498, 1200, 1742], "site": 1748, "size": [1694, 1695, 1696, 1697, 1699, 1700, 1701, 1702, 1706, 1707, 1708, 1731, 1732, 1733, 1735, 1736, 1737, 1739, 1742, 1743, 1746, 1748, 1758, 1764, 1777, 1778, 1780, 1781, 1797, 1799, 1802, 1804, 1810, 1814, 1815, 1816, 1817, 1818, 1819, 1824, 1825, 1827, 1830, 1833, 1838, 1844], "slack": 1816, "slice": 137, "small_cutoff": [1229, 1425], "smith": 1773, "sn": 1806, "snapshot": 1788, "snlink": 1231, "snlink_basis_toler": [1231, 1621], "snlink_density_toler": [1231, 1622], "snlink_force_cartesian": [1231, 1623], "snlink_gpu_mem": [1231, 1624], "snlink_grid_batch_s": [1231, 1625], "snlink_integrator_kernel": [1231, 1626], "snlink_ints_toler": [1231, 1627], "snlink_load_balancer_kernel": [1231, 1628], "snlink_lwd_kernel": [1231, 1629], "snlink_mol_weights_kernel": [1231, 1630], "snlink_pruning_schem": [1231, 1631], "snlink_radial_point": [1231, 1632], "snlink_radial_schem": [1231, 1633], "snlink_reduction_kernel": [1231, 1634], "snlink_spherical_point": [1231, 1635], "snlink_use_debug_grid": [1231, 1636], "snlink_use_gpu": [1231, 1637], "snsmp2": 1728, "so": 1810, "sobasisset": 132, "socc": [1168, 1192, 1221, 1222], "solv": 1738, "solvat": 1754, "solvent": 1754, "solver": 1754, "solver_converg": [722, 1207, 1231, 1638], "solver_maxit": [723, 1207, 1231, 1639], "solver_n_guess": [724, 1207, 1231, 1640], "solver_n_root": [1231, 1641], "solver_precondit": [725, 1207], "solver_roots_per_irrep": [1231, 1642], "solverengin": 329, "somcscf": 133, "sos_typ": [960, 1213, 1225, 1292], "soscf": [1231, 1643], "soscf_conv": [1231, 1644], "soscf_max_it": [1231, 1645], "soscf_min_it": [1231, 1646], "soscf_print": [1231, 1647], "soscf_start_converg": [1231, 1648], "sourc": [1736, 1738, 1777], "space": [1755, 1789, 1805, 1810, 1829], "span": [1694, 1695, 1696, 1697, 1699, 1700, 1701, 1702, 1706, 1707, 1708, 1731, 1732, 1733, 1735, 1736, 1737, 1739, 1742, 1743, 1746, 1748, 1758, 1764, 1777, 1778, 1780, 1781, 1797, 1799, 1802, 1804, 1810, 1814, 1815, 1816, 1817, 1818, 1819, 1824, 1825, 1827, 1830, 1833, 1838, 1844], "specif": [1738, 1743, 1781, 1782, 1799, 1832, 1833, 1837], "spectra": 1841, "spectroscop": 1761, "spectrum": 377, "sphinx": 1764, "spin": [1755, 1757, 1798, 1805, 1806, 1837, 1838], "spin_scale_typ": [1225, 1293], "src": 1785, "ss_e_converg": [499, 1200], "ss_r_converg": [500, 1200], "ss_scale": [1225, 1294], "ss_skip_diag": [501, 1200], "ss_vecs_per_root": [502, 1200], "ssapt0_scal": [1064, 1218], "ssi": [1692, 1752], "stabil": [1231, 1838], "stability_add_vector": [751, 1208], "stability_analysi": [1231, 1649], "stability_augment_space_tol": [752, 1208], "stability_check": [753, 1208], "stability_converg": [754, 1208], "stability_max_space_s": [755, 1208], "stability_n_eigenvalu": [756, 1208], "stability_n_guess_vector": [757, 1208], "stack": 1788, "stage": 1738, "standard": 1733, "stanton": 1743, "start": 1737, "state": [1742, 1781, 1802], "state_to_atomicinput": 378, "std": 1821, "step": 1815, "step_typ": [1226, 1368, 1802], "stockhold": 1799, "stone": 1775, "strictli": 1738, "structur": [1764, 1785, 1828, 1832, 1844], "style": [1694, 1695, 1696, 1697, 1699, 1700, 1701, 1702, 1706, 1707, 1708, 1731, 1732, 1733, 1735, 1736, 1737, 1739, 1742, 1743, 1746, 1747, 1748, 1758, 1764, 1777, 1778, 1780, 1781, 1797, 1799, 1802, 1804, 1810, 1814, 1815, 1816, 1817, 1818, 1819, 1821, 1822, 1824, 1825, 1827, 1830, 1833, 1838, 1844], "subset": 1738, "substitut": 1833, "suggest": 1737, "suit": [2, 1842], "summari": [1733, 1753, 1781, 1802], "summation_field": [1228, 1394], "superfunct": 138, "superposit": 1794, "support": [1771, 1781], "surfac": [1828, 1844], "symbol": 1738, "symmetr": [1225, 1295], "symmetri": [1757, 1781, 1817, 1833, 1837, 1838], "symmetryoper": 139, "syntax": 1817, "system": 1781, "t": [1232, 1667, 1771, 1843], "t2_coupl": [462, 1199], "t3_ws_incor": [463, 503, 1199, 1200], "t_amp": [509, 1201], "t_cut_clmo": [978, 1214], "t_cut_cpao": [979, 1214], "t_cut_do": [980, 1214], "t_cut_do_ij": [981, 1214], "t_cut_do_pr": [982, 1214], "t_cut_mkn": [983, 1214], "t_cut_pno": [984, 1214], "t_cut_pr": [985, 1214], "tabl": 1832, "tag": [1786, 1788], "tarbal": 1737, "task": 1750, "tdm": [887, 1210, 1755], "tdscf": [398, 1231, 1841], "tdscf_coeff_cutoff": [1231, 1650, 1841], "tdscf_guess": [1231, 1651, 1841], "tdscf_maxit": [1231, 1652, 1841], "tdscf_print": [1231, 1653, 1841], "tdscf_r_converg": [1231, 1654, 1841], "tdscf_state": [1231, 1655, 1841], "tdscf_tda": [1231, 1656, 1841], "tdscf_tdm_print": [1231, 1657, 1841], "tdscf_triplet": [1231, 1658, 1841], "tdscfconvergenceerror": 277, "team": 1735, "technic": 1781, "technologi": 1823, "term": 1837, "test": [2, 1736, 1738, 1785, 1786, 1788, 1842], "test_b": [1226, 1369], "test_derivative_b": [1226, 1370], "test_input": 2, "test_matrix_dpd_interfac": 256, "testcomparisonerror": 278, "text": [1694, 1695, 1696, 1697, 1699, 1700, 1701, 1702, 1706, 1707, 1708, 1731, 1732, 1733, 1735, 1736, 1737, 1739, 1742, 1743, 1746, 1748, 1758, 1764, 1777, 1778, 1780, 1781, 1797, 1799, 1802, 1804, 1810, 1814, 1815, 1816, 1817, 1818, 1819, 1824, 1825, 1827, 1830, 1833, 1838, 1844], "than": 1738, "theoret": [1771, 1781, 1790, 1798], "theori": [1210, 1742, 1753, 1755, 1756, 1757, 1759, 1763, 1771, 1781, 1798, 1829, 1836, 1837, 1838, 1841], "thermo": [390, 1232, 1691], "thermochem": 1843, "theta_point": [1231, 1659], "thick": [1231, 1660], "thread": 1767, "three": 1759, "three_particl": [758, 1208], "threecenteroverlapint": 141, "through": [1746, 1747, 1769, 1771, 1772, 1798], "tikhonow_max": [1229, 1426], "tikhonow_omega": [759, 1208, 1229, 1427], "tikhonow_tripl": [1229, 1428], "tile_sz": [1231, 1661], "time": [1760, 1841], "timer_off": 257, "timer_on": 258, "tlaplacedenomin": 140, "tool": [1738, 1747], "top": [1737, 1786], "tpdm": [888, 1210], "tpdm_abcd_typ": [1225, 1296, 1798], "tracelessquadrupoleint": 142, "transfer": 1837, "transform": [1694, 1695, 1696, 1697, 1699, 1700, 1701, 1702, 1706, 1707, 1708, 1731, 1732, 1733, 1735, 1736, 1737, 1739, 1742, 1743, 1746, 1748, 1758, 1764, 1777, 1778, 1780, 1781, 1797, 1799, 1802, 1804, 1810, 1814, 1815, 1816, 1817, 1818, 1819, 1824, 1825, 1827, 1830, 1833, 1838, 1844], "transit": 1802, "translate_psi4": [713, 1206], "treatment": [1757, 1838], "tree_expansion_ord": [1228, 1395], "tree_theta": [1228, 1396], "triples_algorithm": [1229, 1429], "triples_dii": [1229, 1430], "triples_iabc_typ": [961, 1213], "triples_low_memori": [1095, 1219, 1771], "triplet": 259, "truncat": 1733, "tstart": 260, "tstop": 261, "turn_on_actv": [1193, 1222], "tutori": [1778, 1828, 1844], "tweak": 1788, "twobodyaoint": 143, "twoelectronint": 144, "txt": 2, "type": [1739, 1742, 1756, 1757, 1771, 1781, 1798, 1821, 1838], "uhf": [145, 1231], "uhf_noon": [1231, 1662], "uk": 1231, "uksfunct": 146, "undefin": [1738, 1786], "underlin": [1739, 1742, 1756, 1757, 1771, 1781, 1798], "unfreeze_dihedr": [1226, 1371], "unspecifi": [1739, 1742, 1756, 1757, 1771, 1781, 1798], "up": [1738, 1820], "updat": [889, 1210, 1226, 1736, 1738, 1748, 1764, 1788], "upgradehelp": 279, "us": [1735, 1738, 1748, 1749, 1754, 1757, 1785, 1803, 1808, 1810, 1816, 1817, 1821, 1824, 1828, 1833, 1844], "usag": 1841, "use_df_int": [1096, 1219], "use_spin_sym": [1229, 1431], "use_spin_symmetri": [1229, 1432], "user": [1730, 1735, 1743, 1764, 1802], "usr": 1738, "v": 1828, "v1": 1788, "v2rdm_casscf": [1729, 1807], "val_ex_level": [890, 1210], "valeev": 1783, "validationerror": 280, "valu": [1735, 1832], "variabl": [262, 263, 400, 1709, 1735, 1767, 1776, 1795, 1832], "variant": 1759, "vbase": 147, "vecs_cc3": [504, 1200], "vecs_per_root": [505, 1200], "vector": [148, 1210], "vector3": 149, "versa": 1738, "version": [264, 1738, 1786, 1814], "vi": 1738, "via": 1736, "vib": 1772, "vibanal_wfn": 399, "vibrat": [1772, 1828, 1843, 1844], "vice": 1738, "view": 1797, "virtual": 1821, "visual": [1750, 1770, 1772], "vmd": 1750, "wabei_lowdisk": [510, 1201], "wai": 1824, "wavefunct": [150, 1231, 1767, 1772], "wcombin": [1231, 1663], "welcom": 1825, "wfn": [423, 464, 506, 511, 533, 556, 563, 567, 891, 1169, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1210, 1221, 1231, 1664], "wfn_sym": [1194, 1222, 1229, 1433], "wfn_type": [962, 1213, 1225, 1297, 1798], "what": [1737, 1738, 1748, 1786, 1801], "when": [1735, 1738, 1739, 1742, 1746, 1747, 1756, 1757, 1771, 1781, 1798], "where": [1816, 1823], "why": 1738, "within": 1738, "without": [1738, 1786, 1837], "wolf": 1762, "workflow": [1737, 1814], "worth": 1738, "wouter": 1746, "wrapper": [1810, 1832], "write_no": [424, 1198], "write_opt_histori": [1226, 1372], "write_opt_result": [1226, 1373], "write_trajectori": [1226, 1374], "writer_file_label": [1170, 1221, 1772, 1791], "xi": [425, 1198], "xi_connect": [426, 1198], "yapf": 1747, "year": 1788, "your": [1747, 1820], "zero_internal_amp": [1229, 1434], "zeta": [427, 534, 1198, 1202]}})
\ No newline at end of file
diff --git a/sphinxman/master/simint.html b/sphinxman/master/simint.html
index e9a48fabdf8..b37ae218d77 100644
--- a/sphinxman/master/simint.html
+++ b/sphinxman/master/simint.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/simint.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -302,7 +302,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/simint.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -316,7 +316,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/sowreap.html b/sphinxman/master/sowreap.html
index 14ebcd1406f..e8ed7f486c6 100644
--- a/sphinxman/master/sowreap.html
+++ b/sphinxman/master/sowreap.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/sowreap.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -231,7 +231,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/sowreap.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -245,7 +245,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/tdscf.html b/sphinxman/master/tdscf.html
index b77359086b0..b2ae8f799b8 100644
--- a/sphinxman/master/tdscf.html
+++ b/sphinxman/master/tdscf.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/tdscf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -572,7 +572,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/tdscf.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -586,7 +586,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/testsuite.html b/sphinxman/master/testsuite.html
index d86ad6e7b09..d95e76cc7fc 100644
--- a/sphinxman/master/testsuite.html
+++ b/sphinxman/master/testsuite.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/testsuite.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1723,7 +1723,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/testsuite.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -1737,7 +1737,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/thermo.html b/sphinxman/master/thermo.html
index 575679097de..bb792370c8d 100644
--- a/sphinxman/master/thermo.html
+++ b/sphinxman/master/thermo.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/thermo.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -281,7 +281,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/thermo.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -295,7 +295,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->
diff --git a/sphinxman/master/tutorial.html b/sphinxman/master/tutorial.html
index 39ec1819e47..30347065774 100644
--- a/sphinxman/master/tutorial.html
+++ b/sphinxman/master/tutorial.html
@@ -47,7 +47,7 @@
     <link rel="stylesheet" href="https://maxcdn.bootstrapcdn.com/font-awesome/4.4.0/css/font-awesome.min.css" type="text/css" />
     <link rel="stylesheet" href="https://fonts.googleapis.com/css?family=Noticia+Text:400,i,b,bi|Open+Sans:400,i,b,bi|Roboto+Mono:400,i,b,bi&amp;display=swap" type="text/css" />
     
-    <script src="_static/documentation_options.js?v=3583bb1d"></script>
+    <script src="_static/documentation_options.js?v=7accc8dd"></script>
     <script src="_static/doctools.js?v=9a2dae69"></script>
     <script src="_static/sphinx_highlight.js?v=dc90522c"></script>
     <script crossorigin="anonymous" integrity="sha256-Ae2Vz/4ePdIu6ZyI/5ZGsYnb+m0JlOmKPjt6XZ9JJkA=" src="https://cdnjs.cloudflare.com/ajax/libs/require.js/2.3.4/require.min.js"></script>
@@ -102,7 +102,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/tutorial.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -715,7 +715,7 @@ <h3>Navigation</h3>
     <li><a href="http://forum.psicode.org"><i class="fa fa-comments-o fa-lg"></i></a></li>
     <li><a href="http://github.com/psi4/psi4/edit/master/doc/sphinxman/source/tutorial.rst"><i class="fa fa-pencil fa-lg"></i></a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
-    <li><a href="http://github.com/psi4/psi4/tree/7bfb86a">1.10a1.dev54</a></li>
+    <li><a href="http://github.com/psi4/psi4/tree/dfebe5b">1.10a1.dev55</a></li>
     <li style="color: #1a4162">&nbsp;&middot;&nbsp;</li>
     <li class="nav-item nav-item-0"><a href="index.html">
         <span style="font-family: Optima, sans-serif;">P<span style="font-size: 82%;">SI</span>4</span>
@@ -729,7 +729,7 @@ <h3>Navigation</h3>
 
     <div class="footer" role="contentinfo">
     &#169; Copyright 2007-2024, The Psi4 Project.
-      Last updated on Monday, 09 September 2024 08:09PM.
+      Last updated on Friday, 13 September 2024 03:46PM.
       Created using <a href="https://www.sphinx-doc.org/">Sphinx</a> 7.4.7.
     </div>
     <!-- cloud_sptheme 1.4 -->